smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC(C)(C)/C=C/C(=O)Nc1c([O-])cc(Br)cc1Cl ZINC000819787975 1049376283 /nfs/dbraw/zinc/37/62/83/1049376283.db2.gz PXLXDSZJGNKSEM-SNAWJCMRSA-N -1 1 332.625 4.349 20 0 EIADMM CCc1noc(C)c1[N-]C(=O)c1ncoc1-c1ccccc1Cl ZINC000120955433 1032481485 /nfs/dbraw/zinc/48/14/85/1032481485.db2.gz NTUVFAGKGVSKCF-UHFFFAOYSA-N -1 1 331.759 4.106 20 0 EIADMM O=C(NCc1nccc2ccccc21)c1cc2ccccc2cc1[O-] ZINC000014386742 1019043453 /nfs/dbraw/zinc/04/34/53/1019043453.db2.gz LCKDLGDTYZKIGV-UHFFFAOYSA-N -1 1 328.371 4.024 20 0 EIADMM CC[C@H](C)c1ccc(S(=O)(=O)[N-]c2cccc(COC)c2)cc1 ZINC000026547200 1019231854 /nfs/dbraw/zinc/23/18/54/1019231854.db2.gz UNYPHFRDNNYFJF-AWEZNQCLSA-N -1 1 333.453 4.147 20 0 EIADMM O=C(Nc1cccc(OC(F)F)c1)c1ccc(C(F)(F)F)cc1[O-] ZINC001625796118 1019255201 /nfs/dbraw/zinc/25/52/01/1019255201.db2.gz KDWSWJYYXMRGQT-UHFFFAOYSA-N -1 1 347.239 4.265 20 0 EIADMM CC(C)Nc1ccccc1NC(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC001167091762 1019873085 /nfs/dbraw/zinc/87/30/85/1019873085.db2.gz KVNCIOADRLWSJH-UHFFFAOYSA-N -1 1 338.329 4.484 20 0 EIADMM O=C([O-])c1coc(CNCc2ccc(-c3cccc(F)c3)s2)c1 ZINC000426688581 1032880969 /nfs/dbraw/zinc/88/09/69/1032880969.db2.gz RGPVRTRHBBZCMW-UHFFFAOYSA-N -1 1 331.368 4.135 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc3cnn(C(C)C)c3c2)cc1C ZINC000509534872 1032884400 /nfs/dbraw/zinc/88/44/00/1032884400.db2.gz ASRUDGVZBVQWRY-UHFFFAOYSA-N -1 1 343.452 4.035 20 0 EIADMM CC(C)N(Cc1ccc(F)cc1)C(=O)Cc1ccc([O-])c(Cl)c1 ZINC001625853468 1020298519 /nfs/dbraw/zinc/29/85/19/1020298519.db2.gz YUBQLYCQGLSGCX-UHFFFAOYSA-N -1 1 335.806 4.164 20 0 EIADMM Cc1c2cccc(F)c2oc1-c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000683593546 1020949154 /nfs/dbraw/zinc/94/91/54/1020949154.db2.gz NKWPGBPUBRIJJC-UHFFFAOYSA-N -1 1 328.274 4.442 20 0 EIADMM Cc1cccc2nc(-c3ccc(Br)cc3F)[n-]c(=O)c12 ZINC000446994129 1032947894 /nfs/dbraw/zinc/94/78/94/1032947894.db2.gz PIVXRPUSEGEJOH-UHFFFAOYSA-N -1 1 333.160 4.212 20 0 EIADMM COc1ccc([C@@H]2C[C@H]2CC(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000612760471 1021347898 /nfs/dbraw/zinc/34/78/98/1021347898.db2.gz WLGNHOPMUPYXIC-WFASDCNBSA-N -1 1 331.799 4.187 20 0 EIADMM CCS[C@@H]1CC[C@@H](N(C)C(=O)c2cc3ccccc3cc2[O-])C1 ZINC000175393084 1022348944 /nfs/dbraw/zinc/34/89/44/1022348944.db2.gz FCBINFWCJJBVKL-HZPDHXFCSA-N -1 1 329.465 4.292 20 0 EIADMM Cc1oc(-c2cccs2)nc1C(=O)[N-]c1nnc(CC(C)C)s1 ZINC000047075512 1022392331 /nfs/dbraw/zinc/39/23/31/1022392331.db2.gz MLPOQPNGLKDDFV-UHFFFAOYSA-N -1 1 348.453 4.014 20 0 EIADMM COc1cc(C(=O)N(C)c2ccc(OC(C)C)cc2)cc(Cl)c1[O-] ZINC000430525507 1022679183 /nfs/dbraw/zinc/67/91/83/1022679183.db2.gz OXZWPGRFWZJXRG-UHFFFAOYSA-N -1 1 349.814 4.118 20 0 EIADMM CC(C)[C@H]1CCCN(C(=O)c2ccc(Br)c([O-])c2)CC1 ZINC000228317182 1022775517 /nfs/dbraw/zinc/77/55/17/1022775517.db2.gz HRHPFPMLJSTUMB-LBPRGKRZSA-N -1 1 340.261 4.053 20 0 EIADMM COCc1ncc(C(=O)Nc2cc(Cl)c([O-])c3ccccc23)s1 ZINC001167445413 1022828608 /nfs/dbraw/zinc/82/86/08/1022828608.db2.gz XJTKAECLYZGTKV-UHFFFAOYSA-N -1 1 348.811 4.054 20 0 EIADMM CCCN(CCc1cccs1)C(=O)c1ncc2ccccc2c1[O-] ZINC000613550205 1022954738 /nfs/dbraw/zinc/95/47/38/1022954738.db2.gz BTXBDJNNTHWTPU-UHFFFAOYSA-N -1 1 340.448 4.097 20 0 EIADMM CCC1(c2ccc(Cl)cc2)CCN(C(=O)c2ncccc2[O-])CC1 ZINC000473318825 1033110534 /nfs/dbraw/zinc/11/05/34/1033110534.db2.gz KEPPNCHAHDDANE-UHFFFAOYSA-N -1 1 344.842 4.025 20 0 EIADMM CCc1nc(CNCc2ccc(C3CCCC3)cc2)ccc1C(=O)[O-] ZINC000417567007 1023360312 /nfs/dbraw/zinc/36/03/12/1023360312.db2.gz OCXSVMXGFFHVOS-UHFFFAOYSA-N -1 1 338.451 4.290 20 0 EIADMM CC(C)(C)c1ccc(-c2ccc(CN[C@@H](C(=O)[O-])C3CC3)o2)cc1 ZINC000417610518 1023371753 /nfs/dbraw/zinc/37/17/53/1023371753.db2.gz TYBPBQOJNUPNNP-GOSISDBHSA-N -1 1 327.424 4.197 20 0 EIADMM CCOc1c(Cl)cccc1CN[C@@H]1C[C@H](C(=O)[O-])c2ccccc21 ZINC000417624514 1023385976 /nfs/dbraw/zinc/38/59/76/1023385976.db2.gz KWVCHFGFNBQDHH-DOTOQJQBSA-N -1 1 345.826 4.142 20 0 EIADMM CC(C)(C)c1ccc(CNCc2ccc(C(=O)[O-])c(C3CC3)n2)cc1 ZINC000417707747 1023410911 /nfs/dbraw/zinc/41/09/11/1023410911.db2.gz QZBLWZWWXIIJQB-UHFFFAOYSA-N -1 1 338.451 4.245 20 0 EIADMM Cc1cc(OCCCC(=O)Nc2c([O-])cccc2F)ccc1Cl ZINC000605440201 1023411343 /nfs/dbraw/zinc/41/13/43/1023411343.db2.gz MPPAIRAEDQHSTG-UHFFFAOYSA-N -1 1 337.778 4.291 20 0 EIADMM O=C([O-])c1ccc(CNCc2ccc(C3CCC3)cc2)nc1C1CC1 ZINC000417712397 1023412734 /nfs/dbraw/zinc/41/27/34/1023412734.db2.gz WVXQQPCNWYEITA-UHFFFAOYSA-N -1 1 336.435 4.215 20 0 EIADMM CSCc1ccccc1[N-]S(=O)(=O)c1ccc2c(c1)CCCC2 ZINC000545366007 1023466700 /nfs/dbraw/zinc/46/67/00/1023466700.db2.gz DKORUQBRJRMTIO-UHFFFAOYSA-N -1 1 347.505 4.229 20 0 EIADMM O=C(CCc1cccc(Cl)c1)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC000613666461 1023475503 /nfs/dbraw/zinc/47/55/03/1023475503.db2.gz AKAVQRLEURSFAX-UHFFFAOYSA-N -1 1 341.798 4.007 20 0 EIADMM Cc1noc(-c2ccccc2)c1[N-]C(=O)c1cc(Cl)ncc1F ZINC001267650086 1023569397 /nfs/dbraw/zinc/56/93/97/1023569397.db2.gz DHDKEIWCZBSDFK-UHFFFAOYSA-N -1 1 331.734 4.090 20 0 EIADMM O=C(c1ccc([O-])c(F)c1)N1CC=C(c2cccc(Cl)c2)CC1 ZINC000684499149 1023956363 /nfs/dbraw/zinc/95/63/63/1023956363.db2.gz KSOJOGOGDWPFMC-UHFFFAOYSA-N -1 1 331.774 4.114 20 0 EIADMM O=S(=O)([N-]CC1CCCC1)c1c(Cl)cc(Cl)cc1Cl ZINC000049001868 1024787343 /nfs/dbraw/zinc/78/73/43/1024787343.db2.gz PVMOLGKKVZHOMF-UHFFFAOYSA-N -1 1 342.675 4.115 20 0 EIADMM C[C@H](c1ccc(Cl)c(Cl)c1)N(C)Cc1occc1C(=O)[O-] ZINC000652391163 1024802689 /nfs/dbraw/zinc/80/26/89/1024802689.db2.gz KIQVCLRPUWCXJO-SECBINFHSA-N -1 1 328.195 4.478 20 0 EIADMM CSc1cccc(C)c1[N-]S(=O)(=O)c1ccc2c(c1)CCC2 ZINC000471963217 1024820884 /nfs/dbraw/zinc/82/08/84/1024820884.db2.gz HPYXICNIPYDSOC-UHFFFAOYSA-N -1 1 333.478 4.006 20 0 EIADMM Cc1cc([C@@H](C)N2CC[C@@H](Oc3ccccc3Cl)C2)oc1C(=O)[O-] ZINC000652434838 1024829586 /nfs/dbraw/zinc/82/95/86/1024829586.db2.gz GBWKAHGQUWGLLF-CHWSQXEVSA-N -1 1 349.814 4.154 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1C[C@@H]2CCC(=O)c3cccc1c32 ZINC000184381390 1024846859 /nfs/dbraw/zinc/84/68/59/1024846859.db2.gz SDEBVKQFNMWSSH-HNNXBMFYSA-N -1 1 343.382 4.266 20 0 EIADMM Cc1ccc(-c2nc(CN3CCC[C@@H](C(C)(C)C(=O)[O-])C3)cs2)o1 ZINC000652497800 1024860596 /nfs/dbraw/zinc/86/05/96/1024860596.db2.gz JELYEJLBCWCGHY-CYBMUJFWSA-N -1 1 348.468 4.034 20 0 EIADMM O=C([O-])C[C@H](NCc1cc(F)cc(C(F)(F)F)c1)c1ccsc1 ZINC000277041969 1025008192 /nfs/dbraw/zinc/00/81/92/1025008192.db2.gz QYUXVAVEHINLDL-ZDUSSCGKSA-N -1 1 347.333 4.212 20 0 EIADMM CCc1nc(NC(=O)c2c(F)ccc([O-])c2F)sc1C(C)(C)C ZINC000458267169 1025096692 /nfs/dbraw/zinc/09/66/92/1025096692.db2.gz CTMXHXHYYAUKPU-UHFFFAOYSA-N -1 1 340.395 4.239 20 0 EIADMM Cc1cnc(SCCCc2ccc(C(F)(F)F)cc2)[n-]c1=O ZINC000657261719 1025442749 /nfs/dbraw/zinc/44/27/49/1025442749.db2.gz BBHKSFSKLRVNKU-UHFFFAOYSA-N -1 1 328.359 4.234 20 0 EIADMM Cc1ccccc1[C@@H](C)CC(=O)N=c1cc(-c2cccs2)[n-][nH]1 ZINC000604789320 1025735826 /nfs/dbraw/zinc/73/58/26/1025735826.db2.gz WCUILRZPTRMDDN-ZDUSSCGKSA-N -1 1 325.437 4.001 20 0 EIADMM Cc1nc(CNCc2ccc(-c3ccccc3)cc2)ccc1C(=O)[O-] ZINC000426651412 1025849582 /nfs/dbraw/zinc/84/95/82/1025849582.db2.gz LTINNAUGABMMQT-UHFFFAOYSA-N -1 1 332.403 4.045 20 0 EIADMM O=C([N-]c1nnc(-c2ccccn2)s1)c1occc1-c1ccccc1 ZINC000344025054 1025883467 /nfs/dbraw/zinc/88/34/67/1025883467.db2.gz WGPFSNHKKGIJOG-UHFFFAOYSA-N -1 1 348.387 4.112 20 0 EIADMM C[C@H](CC1CCCCC1)C(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC000512106353 1026020199 /nfs/dbraw/zinc/02/01/99/1026020199.db2.gz RKSHOZOKBFXDPI-CYBMUJFWSA-N -1 1 327.428 4.327 20 0 EIADMM Cc1cc(Cl)ccc1S(=O)(=O)[N-]c1cccc(Cl)c1C ZINC000048652635 1026026225 /nfs/dbraw/zinc/02/62/25/1026026225.db2.gz CTLHCZJSMJRFEA-UHFFFAOYSA-N -1 1 330.236 4.411 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2cccc(Cl)c2F)c(Cl)c1 ZINC000048652691 1026030293 /nfs/dbraw/zinc/03/02/93/1026030293.db2.gz LHALBHNUCOSIBV-UHFFFAOYSA-N -1 1 334.199 4.242 20 0 EIADMM Cc1nc(CNCc2cc(-c3ccccc3)cs2)ccc1C(=O)[O-] ZINC000426661493 1026146634 /nfs/dbraw/zinc/14/66/34/1026146634.db2.gz UOJPSBPMLAZOMZ-UHFFFAOYSA-N -1 1 338.432 4.107 20 0 EIADMM CC1([N-]S(=O)(=O)c2c(Cl)cc(Cl)cc2Cl)CCCC1 ZINC000049239905 1026153686 /nfs/dbraw/zinc/15/36/86/1026153686.db2.gz PVTKNDGFZXETKQ-UHFFFAOYSA-N -1 1 342.675 4.258 20 0 EIADMM O=C(Nc1ccccc1-c1cc(F)c(F)c(F)c1)c1cncc([O-])c1 ZINC000559555842 1026247130 /nfs/dbraw/zinc/24/71/30/1026247130.db2.gz DEZSPGZBLXLFKM-UHFFFAOYSA-N -1 1 344.292 4.124 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1ccn(-c2cccc(Cl)c2)n1 ZINC000111667865 1026314916 /nfs/dbraw/zinc/31/49/16/1026314916.db2.gz ZHDHVIJPORIWJA-UHFFFAOYSA-N -1 1 348.189 4.137 20 0 EIADMM O=C(CCCc1c[nH]c2ccccc12)Nc1ccc([O-])c(Cl)c1 ZINC000111665878 1026315587 /nfs/dbraw/zinc/31/55/87/1026315587.db2.gz PJPVPZBDWYBYKU-UHFFFAOYSA-N -1 1 328.799 4.488 20 0 EIADMM CCC1(CC)CCN(c2ccc(-c3nc(C)c(C)c(=O)[n-]3)cn2)CC1 ZINC000302507433 1026335282 /nfs/dbraw/zinc/33/52/82/1026335282.db2.gz WNPWPEZBAVUVJL-UHFFFAOYSA-N -1 1 340.471 4.268 20 0 EIADMM Cc1ccc(F)cc1-c1nnc([N-]C(=O)c2cc(C(C)C)on2)s1 ZINC000279343138 1026384309 /nfs/dbraw/zinc/38/43/09/1026384309.db2.gz FTZICKJXCJAXGI-UHFFFAOYSA-N -1 1 346.387 4.016 20 0 EIADMM C[C@@H](NC(=O)c1c(F)ccc([O-])c1F)c1cccc(C(F)(F)F)c1 ZINC000684828499 1026469663 /nfs/dbraw/zinc/46/96/63/1026469663.db2.gz KYOPCRRIWMLEFC-MRVPVSSYSA-N -1 1 345.267 4.180 20 0 EIADMM O=C([O-])C[C@H](NCc1cc(Cl)ccc1Cl)c1ccsc1 ZINC000426683937 1026472150 /nfs/dbraw/zinc/47/21/50/1026472150.db2.gz WMFCVCWZPJDNLT-ZDUSSCGKSA-N -1 1 330.236 4.361 20 0 EIADMM Cc1ccc([C@H](NCc2cc(C(F)(F)F)ccc2F)C(=O)[O-])cc1 ZINC000426700600 1026486558 /nfs/dbraw/zinc/48/65/58/1026486558.db2.gz SFGPBPFHGISNDI-HNNXBMFYSA-N -1 1 341.304 4.068 20 0 EIADMM O=C([O-])[C@@H](NCc1cc(Cl)ccc1F)c1cccc(Cl)c1 ZINC000426733265 1026517455 /nfs/dbraw/zinc/51/74/55/1026517455.db2.gz MBKCWDWBULXRDC-AWEZNQCLSA-N -1 1 328.170 4.048 20 0 EIADMM C[C@H](C(=O)[O-])[C@H](NCc1ccccc1Br)c1ccccc1 ZINC000426740544 1026522177 /nfs/dbraw/zinc/52/21/77/1026522177.db2.gz BFGUESGJYPWPGP-LRDDRELGSA-N -1 1 348.240 4.001 20 0 EIADMM Cc1cc2cc(CN[C@@H](CCc3ccccc3)C(=O)[O-])oc2cc1C ZINC000426765866 1026532699 /nfs/dbraw/zinc/53/26/99/1026532699.db2.gz TUTIVPMLNQVJKZ-IBGZPJMESA-N -1 1 337.419 4.225 20 0 EIADMM O=C([O-])[C@@H](NCc1cc(Cl)ccc1F)c1ccc(Cl)c(F)c1 ZINC000426754151 1026538945 /nfs/dbraw/zinc/53/89/45/1026538945.db2.gz OCZUCSIZYFUDQT-AWEZNQCLSA-N -1 1 346.160 4.187 20 0 EIADMM O=C(Nc1ccc(CCC(F)(F)F)cc1)c1c(F)ccc([O-])c1F ZINC000582387962 1026539192 /nfs/dbraw/zinc/53/91/92/1026539192.db2.gz TXXSBLWNSJCZMW-UHFFFAOYSA-N -1 1 345.267 4.418 20 0 EIADMM Cc1ccc([C@@H](CC(=O)[O-])NCc2cnc(-c3ccccc3)s2)o1 ZINC000426790265 1026562631 /nfs/dbraw/zinc/56/26/31/1026562631.db2.gz CCIIVPDRQDARKE-OAHLLOKOSA-N -1 1 342.420 4.017 20 0 EIADMM CCCCN(CCCC)c1ccc(-c2nc(C)c(C)c(=O)[n-]2)cn1 ZINC000426884565 1026610299 /nfs/dbraw/zinc/61/02/99/1026610299.db2.gz UXOCKCWVLVZAMM-UHFFFAOYSA-N -1 1 328.460 4.268 20 0 EIADMM CSc1cccc(NC(=O)c2ccc(C(F)(F)F)c([O-])c2)c1 ZINC000684870071 1026627703 /nfs/dbraw/zinc/62/77/03/1026627703.db2.gz KDUONHIMCDOWHP-UHFFFAOYSA-N -1 1 327.327 4.385 20 0 EIADMM O=C(Nc1ccc2ncccc2c1)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684871322 1026635690 /nfs/dbraw/zinc/63/56/90/1026635690.db2.gz FICIGHOWPFDTOQ-UHFFFAOYSA-N -1 1 332.281 4.212 20 0 EIADMM CC(C)Oc1ccccc1NC(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684871221 1026635964 /nfs/dbraw/zinc/63/59/64/1026635964.db2.gz CACGPIWZPWBISP-UHFFFAOYSA-N -1 1 339.313 4.451 20 0 EIADMM CCN(C(=O)c1ccc(C(F)(F)F)c([O-])c1)[C@H](C)c1cccnc1 ZINC000684874141 1026642389 /nfs/dbraw/zinc/64/23/89/1026642389.db2.gz LWWBOKUGTCWLOV-LLVKDONJSA-N -1 1 338.329 4.029 20 0 EIADMM CN(Cc1cc2ccccc2o1)C(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684875793 1026646334 /nfs/dbraw/zinc/64/63/34/1026646334.db2.gz NYUFJOJTCPTEBE-UHFFFAOYSA-N -1 1 349.308 4.429 20 0 EIADMM O=C(c1ccc(C(F)(F)F)c([O-])c1)N(CC1CC1)c1ccccc1 ZINC000684875760 1026646529 /nfs/dbraw/zinc/64/65/29/1026646529.db2.gz NGTAIAWTKHMYPM-UHFFFAOYSA-N -1 1 335.325 4.468 20 0 EIADMM CCC[C@H](Cc1ccccc1)N(CCC)C(=O)c1ncccc1[O-] ZINC000427116690 1026731760 /nfs/dbraw/zinc/73/17/60/1026731760.db2.gz WUAPUNLYGWDDML-QGZVFWFLSA-N -1 1 326.440 4.051 20 0 EIADMM CCC[C@@H](Cc1ccccc1)N(CCC)C(=O)c1ncccc1[O-] ZINC000427116689 1026731869 /nfs/dbraw/zinc/73/18/69/1026731869.db2.gz WUAPUNLYGWDDML-KRWDZBQOSA-N -1 1 326.440 4.051 20 0 EIADMM CCc1ccc(S(=O)(=O)[N-]c2cccc(-c3ncco3)c2C)cc1 ZINC000427333741 1026821976 /nfs/dbraw/zinc/82/19/76/1026821976.db2.gz BYIBNVSLFRGIRN-UHFFFAOYSA-N -1 1 342.420 4.013 20 0 EIADMM COc1cnc(=S)[n-]c1O[C@H](C)c1ccc(Cl)c(Cl)c1 ZINC001226242013 1026907312 /nfs/dbraw/zinc/90/73/12/1026907312.db2.gz GLUSOGYHMRBUJT-SSDOTTSWSA-N -1 1 331.224 4.221 20 0 EIADMM Cc1ccc2nc(-c3ccc(Oc4cccnc4)cc3)[n-]c(=O)c2c1 ZINC000076029720 1027080586 /nfs/dbraw/zinc/08/05/86/1027080586.db2.gz FPMZHNQCGWGNMP-UHFFFAOYSA-N -1 1 329.359 4.086 20 0 EIADMM Cc1c(NC(=O)c2ccccc2)cccc1NC(=O)c1ccccc1[O-] ZINC000097207291 1027095590 /nfs/dbraw/zinc/09/55/90/1027095590.db2.gz HBBADXANFFNXRI-UHFFFAOYSA-N -1 1 346.386 4.205 20 0 EIADMM Oc1cccc(C[NH2+]C[C@H](OC2CCCC2)C(F)(F)F)c1Cl ZINC000657587620 1027214387 /nfs/dbraw/zinc/21/43/87/1027214387.db2.gz FTGULEZIYIUKMK-ZDUSSCGKSA-N -1 1 337.769 4.025 20 0 EIADMM Cc1nc(=O)[n-]c(O[C@@H](C)c2cccc(Br)c2)c1Cl ZINC001227111049 1027267190 /nfs/dbraw/zinc/26/71/90/1027267190.db2.gz HKAGIEXRYCRFDI-QMMMGPOBSA-N -1 1 343.608 4.047 20 0 EIADMM Cc1nc(-c2ccc(N3CCC(C)(C(C)C)CC3)nc2)[n-]c(=O)c1C ZINC000302466837 1027315823 /nfs/dbraw/zinc/31/58/23/1027315823.db2.gz VMOYJMNCCXMXCT-UHFFFAOYSA-N -1 1 340.471 4.124 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1cnc(-c2ccsc2)s1 ZINC000112404862 1027380128 /nfs/dbraw/zinc/38/01/28/1027380128.db2.gz FFDDFRKYIQUCLS-UHFFFAOYSA-N -1 1 336.825 4.483 20 0 EIADMM Cc1ccc(Cl)cc1[C@H](C)Oc1[n-]c(=O)ncc1Br ZINC001227138671 1027406160 /nfs/dbraw/zinc/40/61/60/1027406160.db2.gz SQDJLZDIKKPQOP-QMMMGPOBSA-N -1 1 343.608 4.047 20 0 EIADMM Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)c1cncc([O-])c1 ZINC000520396249 1027487273 /nfs/dbraw/zinc/48/72/73/1027487273.db2.gz GESICKZTXKMQAA-OAHLLOKOSA-N -1 1 348.402 4.488 20 0 EIADMM Cc1nc(C(C)(C)C)[n-]c(=O)c1C(=O)N[C@H](C)CCC1CCCCC1 ZINC000474815392 1027540149 /nfs/dbraw/zinc/54/01/49/1027540149.db2.gz HZOZUJYPKYZQPZ-CYBMUJFWSA-N -1 1 347.503 4.267 20 0 EIADMM O=S(=O)([N-]c1ccc2[nH]ccc2c1)c1cc(Cl)cc(Cl)c1 ZINC000112617805 1027590180 /nfs/dbraw/zinc/59/01/80/1027590180.db2.gz NUDZDMPPQNYVSY-UHFFFAOYSA-N -1 1 341.219 4.276 20 0 EIADMM COc1cc(C(=O)Nc2ccc3[nH]c(C)cc3c2)cc(Cl)c1[O-] ZINC000153558746 1027607408 /nfs/dbraw/zinc/60/74/08/1027607408.db2.gz AUQDXUXIWACVPI-UHFFFAOYSA-N -1 1 330.771 4.096 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc(-c3ccc[nH]3)cc2)cc1C ZINC000582982273 1027801829 /nfs/dbraw/zinc/80/18/29/1027801829.db2.gz RUDCJNPHGBJANU-UHFFFAOYSA-N -1 1 326.421 4.099 20 0 EIADMM O=C(c1ccc([O-])cc1F)N1C[C@@H](c2ccccc2)c2ccccc21 ZINC000444514145 1027853471 /nfs/dbraw/zinc/85/34/71/1027853471.db2.gz IMZIHCDLTORZCR-SFHVURJKSA-N -1 1 333.362 4.324 20 0 EIADMM CN(Cc1cccc2ccccc21)C(=O)c1c(F)ccc([O-])c1F ZINC000343071762 1028065506 /nfs/dbraw/zinc/06/55/06/1028065506.db2.gz NAVHSOPJGQYZSG-UHFFFAOYSA-N -1 1 327.330 4.096 20 0 EIADMM CCOc1cc(-c2noc(-c3cc(C)oc3C)n2)cc(Cl)c1[O-] ZINC000445412653 1028508823 /nfs/dbraw/zinc/50/88/23/1028508823.db2.gz UMGCNJAARUGAHP-UHFFFAOYSA-N -1 1 334.759 4.371 20 0 EIADMM CCOc1cc(-c2noc(Cc3ccsc3)n2)cc(Cl)c1[O-] ZINC000445404485 1028516443 /nfs/dbraw/zinc/51/64/43/1028516443.db2.gz CLEAZDBMVANSJW-UHFFFAOYSA-N -1 1 336.800 4.147 20 0 EIADMM CCOc1cc(-c2noc([C@H](C)c3cccnc3)n2)cc(Cl)c1[O-] ZINC000445427786 1028523300 /nfs/dbraw/zinc/52/33/00/1028523300.db2.gz RVYWMKXLHCUTPA-SNVBAGLBSA-N -1 1 345.786 4.041 20 0 EIADMM [O-]c1ccc(-c2noc(C/C=C\c3ccccc3F)n2)c(Cl)c1 ZINC000445450842 1028539831 /nfs/dbraw/zinc/53/98/31/1028539831.db2.gz XIUWZPZMZOLELS-HYXAFXHYSA-N -1 1 330.746 4.491 20 0 EIADMM [O-]c1ccc(-c2noc(-c3ccc(C(F)(F)F)nc3)n2)c(Cl)c1 ZINC000445450899 1028540371 /nfs/dbraw/zinc/54/03/71/1028540371.db2.gz YCOAITYCQAKKQJ-UHFFFAOYSA-N -1 1 341.676 4.176 20 0 EIADMM CCSc1ccc(-c2nc(-c3ccc([O-])cc3Cl)no2)cn1 ZINC000445450886 1028541510 /nfs/dbraw/zinc/54/15/10/1028541510.db2.gz XYKOJISBEIZPLP-UHFFFAOYSA-N -1 1 333.800 4.270 20 0 EIADMM [O-]c1c(-c2nc(Cc3ccc(F)c(F)c3)no2)ccc2ccccc21 ZINC000445441887 1028563505 /nfs/dbraw/zinc/56/35/05/1028563505.db2.gz MSJCBVRVVOMFQK-UHFFFAOYSA-N -1 1 338.313 4.464 20 0 EIADMM COc1ccc(CCCCc2nc(-c3ccc([O-])c(F)c3)no2)cc1 ZINC000445472761 1028601031 /nfs/dbraw/zinc/60/10/31/1028601031.db2.gz LWLXCMLIZAMPTO-UHFFFAOYSA-N -1 1 342.370 4.155 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cc(Oc4ccccc4)ccn3)n2)c(F)c1 ZINC000445456398 1028610102 /nfs/dbraw/zinc/61/01/02/1028610102.db2.gz ODJJUJSGWUDDKS-UHFFFAOYSA-N -1 1 349.321 4.436 20 0 EIADMM C[C@H](Oc1ccccc1Cl)c1nc(-c2ccc([O-])cc2F)no1 ZINC000445460699 1028615709 /nfs/dbraw/zinc/61/57/09/1028615709.db2.gz CFPUGQDLVJJKLJ-VIFPVBQESA-N -1 1 334.734 4.375 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cnc(-c4ccccc4)s3)n2)c(F)c1 ZINC000445458130 1028616186 /nfs/dbraw/zinc/61/61/86/1028616186.db2.gz VKANIWNZOQMYOW-UHFFFAOYSA-N -1 1 339.351 4.372 20 0 EIADMM C[C@H](Cc1nc(-c2ccc([O-])cc2F)no1)c1ccc(F)cc1F ZINC000445460094 1028618942 /nfs/dbraw/zinc/61/89/42/1028618942.db2.gz MWOORDPEJLUPQP-SECBINFHSA-N -1 1 334.297 4.206 20 0 EIADMM CC[C@@H](Cc1nc(-c2ccc([O-])c(F)c2)no1)c1ccc(OC)cc1 ZINC000445477388 1028623290 /nfs/dbraw/zinc/62/32/90/1028623290.db2.gz NUQDOKNAIRSEMT-LBPRGKRZSA-N -1 1 342.370 4.326 20 0 EIADMM Cc1oc(-c2ccccc2)nc1-c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445478833 1028625164 /nfs/dbraw/zinc/62/51/64/1028625164.db2.gz DWBFAJQKOXQUCE-UHFFFAOYSA-N -1 1 337.310 4.212 20 0 EIADMM CSc1ccc(O[C@H](C)c2nc(-c3ccc([O-])c(F)c3)no2)cc1 ZINC000445483710 1028632738 /nfs/dbraw/zinc/63/27/38/1028632738.db2.gz QKUBXQYOMNTLPP-SNVBAGLBSA-N -1 1 346.383 4.443 20 0 EIADMM [O-]c1ccc(-c2noc([C@H]3C[C@H]3c3cc(F)ccc3F)n2)cc1F ZINC000445484435 1028632921 /nfs/dbraw/zinc/63/29/21/1028632921.db2.gz ZFCJMVTZGPLHJK-JQWIXIFHSA-N -1 1 332.281 4.131 20 0 EIADMM CCn1ccnc1[C@@H]1CCCCN1C(=O)c1cc2ccccc2cc1[O-] ZINC000281477177 1028638056 /nfs/dbraw/zinc/63/80/56/1028638056.db2.gz CXMJOJLBWNUCSP-SFHVURJKSA-N -1 1 349.434 4.129 20 0 EIADMM C[C@H](Sc1nc(C(F)F)cc(=O)[n-]1)C(=O)c1cccc(Cl)c1 ZINC000583623435 1028949086 /nfs/dbraw/zinc/94/90/86/1028949086.db2.gz KFDPWFUGOYTIQB-ZETCQYMHSA-N -1 1 344.770 4.137 20 0 EIADMM O=S(=O)([N-]c1cc(Cl)ccc1F)c1cc(F)ccc1Cl ZINC000103057969 1029160777 /nfs/dbraw/zinc/16/07/77/1029160777.db2.gz OKKCWIVTUJNZKZ-UHFFFAOYSA-N -1 1 338.162 4.072 20 0 EIADMM CC[C@@H](CNc1ccc(-c2nc(C)c(C)c(=O)[n-]2)cn1)c1ccccc1 ZINC000301380110 1029720692 /nfs/dbraw/zinc/72/06/92/1029720692.db2.gz YOOCRMMPTFWMHY-INIZCTEOSA-N -1 1 348.450 4.467 20 0 EIADMM Cc1cc([C@H](C)Nc2ccc(-c3nc(C)c(C)c(=O)[n-]3)cn2)c(C)o1 ZINC000301384830 1029721597 /nfs/dbraw/zinc/72/15/97/1029721597.db2.gz WMNKVKWAWVVCQW-ZDUSSCGKSA-N -1 1 338.411 4.244 20 0 EIADMM Cc1nc(-c2ccc(NCCCCC(C)(C)C)nc2)[n-]c(=O)c1C ZINC000301418036 1029729334 /nfs/dbraw/zinc/72/93/34/1029729334.db2.gz RKWAOKCZGLONBS-UHFFFAOYSA-N -1 1 328.460 4.489 20 0 EIADMM Cc1cc(C)c(Br)c(C(=O)Nc2c([O-])cccc2F)c1 ZINC000128098770 1029848043 /nfs/dbraw/zinc/84/80/43/1029848043.db2.gz WILJLJPBEWNTHW-UHFFFAOYSA-N -1 1 338.176 4.163 20 0 EIADMM C[C@H]1C[C@H](c2cccnc2)N(C(=O)c2ccc3ccccc3c2[O-])C1 ZINC000182821476 1029968420 /nfs/dbraw/zinc/96/84/20/1029968420.db2.gz WPWSPDJUKMBBSL-IFXJQAMLSA-N -1 1 332.403 4.164 20 0 EIADMM Cc1cc(OC(C)C)ccc1[N-]S(=O)(=O)c1cccc(F)c1C ZINC000525749816 1029996081 /nfs/dbraw/zinc/99/60/81/1029996081.db2.gz IEEIGJLHXPGBDZ-UHFFFAOYSA-N -1 1 337.416 4.031 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc3ncsc3c2)cc1Cl ZINC000107478791 1030029355 /nfs/dbraw/zinc/02/93/55/1030029355.db2.gz DQOOXYXQAGFYEG-UHFFFAOYSA-N -1 1 338.841 4.059 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccccc2C(C)(F)F)c(C)c1 ZINC000451079917 1030220839 /nfs/dbraw/zinc/22/08/39/1030220839.db2.gz BIBBRMZJPRQDJH-UHFFFAOYSA-N -1 1 325.380 4.216 20 0 EIADMM CC(C)c1ccc(S(=O)(=O)[N-]c2ccc3ncsc3c2)cc1 ZINC000033923697 1030453268 /nfs/dbraw/zinc/45/32/68/1030453268.db2.gz FWMBKNFCAZKMNL-UHFFFAOYSA-N -1 1 332.450 4.221 20 0 EIADMM O=S(=O)([N-]c1ccc2n[nH]cc2c1)c1ccc(-c2ccccc2)cc1 ZINC000530879646 1030781236 /nfs/dbraw/zinc/78/12/36/1030781236.db2.gz UISWDIKNWHIZLF-UHFFFAOYSA-N -1 1 349.415 4.031 20 0 EIADMM C[C@@H]1[C@@H](CC(F)(F)F)C[C@H](C)N1C(=O)c1ccc(Cl)cc1[O-] ZINC000452660412 1031229767 /nfs/dbraw/zinc/22/97/67/1031229767.db2.gz KIZAOCPVKWCCEM-IVZWLZJFSA-N -1 1 335.753 4.237 20 0 EIADMM Cc1ccc(-c2nnc([N-]C(=O)c3conc3C(C)C)s2)c(C)c1 ZINC000528208231 1031255705 /nfs/dbraw/zinc/25/57/05/1031255705.db2.gz FUFPLLUVFGVLRI-UHFFFAOYSA-N -1 1 342.424 4.186 20 0 EIADMM O=C(Nc1ccc(F)cc1[O-])[C@H]1C[C@@H]1c1cccc(C(F)(F)F)c1 ZINC000532622136 1031433340 /nfs/dbraw/zinc/43/33/40/1031433340.db2.gz DUQMRRARMBEPMG-OLZOCXBDSA-N -1 1 339.288 4.292 20 0 EIADMM Fc1cccc(F)c1-c1csc([N-]c2ncnc3ncccc23)n1 ZINC000163298778 1031639129 /nfs/dbraw/zinc/63/91/29/1031639129.db2.gz XPYFUGFRFSMADC-UHFFFAOYSA-N -1 1 341.346 4.170 20 0 EIADMM O=C(Nc1ccc(F)cc1[O-])c1cc2c(cccc2Br)[nH]1 ZINC000532012209 1031975612 /nfs/dbraw/zinc/97/56/12/1031975612.db2.gz UETLJANJXGRIEV-UHFFFAOYSA-N -1 1 349.159 4.027 20 0 EIADMM O=C(Nc1ccc(F)cc1[O-])c1ccc(Cl)cc1Br ZINC000532012766 1031976551 /nfs/dbraw/zinc/97/65/51/1031976551.db2.gz DHVSWLPYXHDERW-UHFFFAOYSA-N -1 1 344.567 4.200 20 0 EIADMM [O-]c1cccc(CN2CCO[C@@H](c3cccc(Cl)c3)C2)c1Cl ZINC000512595099 1033459284 /nfs/dbraw/zinc/45/92/84/1033459284.db2.gz JLVTZKSTLPMXAX-MRXNPFEDSA-N -1 1 338.234 4.273 20 0 EIADMM CCOc1cc2c(cc1CNCc1cccc([O-])c1Cl)O[C@@H](C)C2 ZINC000645143140 1033835085 /nfs/dbraw/zinc/83/50/85/1033835085.db2.gz RDEVLDYCWUKNKS-LBPRGKRZSA-N -1 1 347.842 4.058 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2ccc(F)cc2Cl)sc1Cl ZINC000473504026 1034624482 /nfs/dbraw/zinc/62/44/82/1034624482.db2.gz NTOJIOPPFYRMOE-UHFFFAOYSA-N -1 1 340.228 4.303 20 0 EIADMM CCc1cc(C(=O)Nc2ccc(F)cc2[O-])c2c(n1)onc2C(C)C ZINC000513627453 1035076608 /nfs/dbraw/zinc/07/66/08/1035076608.db2.gz ROCKKBDYLCYVIV-UHFFFAOYSA-N -1 1 343.358 4.006 20 0 EIADMM COc1c(Cl)cc([N-]S(=O)(=O)c2ccc(C)cc2)cc1Cl ZINC000509538033 1035513005 /nfs/dbraw/zinc/51/30/05/1035513005.db2.gz FSSQCESESUQQKP-UHFFFAOYSA-N -1 1 346.235 4.111 20 0 EIADMM O=C([N-]c1nncs1)c1nc(-c2ccccc2)oc1-c1ccccc1 ZINC000595900101 1035803451 /nfs/dbraw/zinc/80/34/51/1035803451.db2.gz FHNRAWYCIZKADW-UHFFFAOYSA-N -1 1 348.387 4.112 20 0 EIADMM CCc1oc(CN[C@H](c2ccc(OC)cc2)C2CCC2)cc1C(=O)[O-] ZINC000905750505 1035875191 /nfs/dbraw/zinc/87/51/91/1035875191.db2.gz KZMMFIVVKFVCSI-IBGZPJMESA-N -1 1 343.423 4.180 20 0 EIADMM Cc1cnc(C(=O)N2CCCCC[C@H]2/C=C\c2ccccc2)c([O-])c1 ZINC000460127398 1036092084 /nfs/dbraw/zinc/09/20/84/1036092084.db2.gz MCQQORBQOAHKGY-JYBLJSLWSA-N -1 1 336.435 4.194 20 0 EIADMM COc1cccc(C(=O)CCCC(=O)Nc2ccc([O-])c(Cl)c2)c1 ZINC000485659866 1036135013 /nfs/dbraw/zinc/13/50/13/1036135013.db2.gz QMZGNHLHVKQJHC-UHFFFAOYSA-N -1 1 347.798 4.046 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cccc([C@H]4CCCOC4)c3)n2)cc1F ZINC000571863785 1036274911 /nfs/dbraw/zinc/27/49/11/1036274911.db2.gz MITAXFPHHDPWGZ-HNNXBMFYSA-N -1 1 340.354 4.142 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cccc([C@@H]4CCCOC4)c3)n2)cc1F ZINC000571863786 1036275550 /nfs/dbraw/zinc/27/55/50/1036275550.db2.gz MITAXFPHHDPWGZ-OAHLLOKOSA-N -1 1 340.354 4.142 20 0 EIADMM O=C(NC1CCC(c2ccc(F)cc2)CC1)c1c(F)ccc([O-])c1F ZINC000572287071 1036486354 /nfs/dbraw/zinc/48/63/54/1036486354.db2.gz ARLTWSQHPJTFQK-UHFFFAOYSA-N -1 1 349.352 4.266 20 0 EIADMM Cc1ccc(-c2ccncc2)cc1[N-]S(=O)(=O)c1ccccc1C ZINC000589436823 1036798957 /nfs/dbraw/zinc/79/89/57/1036798957.db2.gz XPCVQMAWKLJGQL-UHFFFAOYSA-N -1 1 338.432 4.166 20 0 EIADMM CC1(C)CC[C@H](CNC(=O)c2c(F)ccc([O-])c2F)c2ccccc21 ZINC000572648068 1036804490 /nfs/dbraw/zinc/80/44/90/1036804490.db2.gz MPDFSXLNABGXAT-GFCCVEGCSA-N -1 1 345.389 4.255 20 0 EIADMM CC(C)CCc1ccccc1[N-]S(=O)(=O)c1ccc2c(c1)COC2 ZINC000589938923 1036908855 /nfs/dbraw/zinc/90/88/55/1036908855.db2.gz IAKBXZLFYXCJMR-UHFFFAOYSA-N -1 1 345.464 4.106 20 0 EIADMM CC(C)(CC(F)(F)F)C(=O)Nc1cccc([O-])c1Br ZINC000908711042 1036921584 /nfs/dbraw/zinc/92/15/84/1036921584.db2.gz OIJILCKPNZLIBY-UHFFFAOYSA-N -1 1 340.139 4.072 20 0 EIADMM CC[C@@H](C)c1ccc(S(=O)(=O)[N-]c2cc3n[nH]cc3cc2C)cc1 ZINC000589980834 1036923826 /nfs/dbraw/zinc/92/38/26/1036923826.db2.gz PFDISTCEOMLHKX-GFCCVEGCSA-N -1 1 343.452 4.186 20 0 EIADMM O=C(Nc1csc(-c2ccccn2)n1)Nc1ccc([O-])c(Cl)c1 ZINC000487200698 1037049027 /nfs/dbraw/zinc/04/90/27/1037049027.db2.gz NTKBXIHFILPJPU-UHFFFAOYSA-N -1 1 346.799 4.208 20 0 EIADMM CC(C)C(=O)c1ccc([C@H](C)C(=O)Nc2cc([O-])c(F)cc2F)cc1 ZINC000909986570 1037224836 /nfs/dbraw/zinc/22/48/36/1037224836.db2.gz OYJLBSMSLCREHT-NSHDSACASA-N -1 1 347.361 4.251 20 0 EIADMM CCc1cc(=O)[n-]c(S[C@H](C)c2ccc(Br)cc2)n1 ZINC000488262459 1037463390 /nfs/dbraw/zinc/46/33/90/1037463390.db2.gz KZOIOXJPASPABG-SECBINFHSA-N -1 1 339.258 4.360 20 0 EIADMM Cc1c(Cl)cccc1[N-]S(=O)(=O)c1ccc(C(F)F)cc1 ZINC000570121860 1037515485 /nfs/dbraw/zinc/51/54/85/1037515485.db2.gz OMTKKQZMNIMRFK-UHFFFAOYSA-N -1 1 331.771 4.387 20 0 EIADMM C[C@@H](OCCCC[P@](=O)([O-])O)c1ccc(Cl)cc1Cl ZINC001225023122 1037650574 /nfs/dbraw/zinc/65/05/74/1037650574.db2.gz VEJCIANVEUPBEH-SECBINFHSA-N -1 1 327.144 4.029 20 0 EIADMM Cc1ccc(CCNc2ccc(-c3nc(C)c(C)c(=O)[n-]3)cn2)cc1C ZINC000664319704 1037764943 /nfs/dbraw/zinc/76/49/43/1037764943.db2.gz QJRRWBQYMIOTKI-UHFFFAOYSA-N -1 1 348.450 4.132 20 0 EIADMM Cc1cc(O[C@@H](C)C(=O)Nc2c([O-])cccc2F)ccc1C(C)C ZINC000605438419 1037786614 /nfs/dbraw/zinc/78/66/14/1037786614.db2.gz SYUTUIBRTZPORB-ZDUSSCGKSA-N -1 1 331.387 4.369 20 0 EIADMM C[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1c([O-])cccc1F ZINC000605434690 1037788006 /nfs/dbraw/zinc/78/80/06/1037788006.db2.gz BEKGULJPHZWKQB-GFCCVEGCSA-N -1 1 331.387 4.235 20 0 EIADMM CCOCc1cccc([N-]S(=O)(=O)c2c(CC)cccc2CC)c1 ZINC000605495815 1037823161 /nfs/dbraw/zinc/82/31/61/1037823161.db2.gz PBXPYCXJOZUQOM-UHFFFAOYSA-N -1 1 347.480 4.149 20 0 EIADMM O=C(NNc1cccc(C(F)(F)F)c1)c1cc2ccccc2cc1[O-] ZINC000058573490 1037866366 /nfs/dbraw/zinc/86/63/66/1037866366.db2.gz MCWCZEQRKRYOGJ-UHFFFAOYSA-N -1 1 346.308 4.321 20 0 EIADMM CC(C)(COCc1ccccc1)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000503726915 1037893437 /nfs/dbraw/zinc/89/34/37/1037893437.db2.gz IURUVLUHEKGUDP-UHFFFAOYSA-N -1 1 333.815 4.227 20 0 EIADMM Cc1cccc(C)c1[N-]S(=O)(=O)c1ccc2c(cnn2C(C)C)c1 ZINC000489755148 1038235377 /nfs/dbraw/zinc/23/53/77/1038235377.db2.gz QBJHZVVHNYYLBG-UHFFFAOYSA-N -1 1 343.452 4.035 20 0 EIADMM CC(C)(C)c1ncc(/C=C/C(=O)Nc2ccc([O-])c(Cl)c2)s1 ZINC000173379526 1038299620 /nfs/dbraw/zinc/29/96/20/1038299620.db2.gz QTKTURXDCDMNKP-FNORWQNLSA-N -1 1 336.844 4.452 20 0 EIADMM COc1cc(C(=O)N[C@H](C)c2cccc(Cl)c2)cc(Cl)c1[O-] ZINC000490321692 1038484304 /nfs/dbraw/zinc/48/43/04/1038484304.db2.gz VZLWEMBLEGUGDX-SECBINFHSA-N -1 1 340.206 4.199 20 0 EIADMM Cc1ccc(-c2nc(CC(=O)Nc3ccc(F)cc3[O-])cs2)cc1 ZINC000533970390 1038733742 /nfs/dbraw/zinc/73/37/42/1038733742.db2.gz PMSSYZJKLNISRE-UHFFFAOYSA-N -1 1 342.395 4.144 20 0 EIADMM O=C([O-])CC[C@H]1CCCCN1Cc1csc(C2CCCCC2)n1 ZINC000424257485 1038753339 /nfs/dbraw/zinc/75/33/39/1038753339.db2.gz KLUBZRJVKTULDG-MRXNPFEDSA-N -1 1 336.501 4.410 20 0 EIADMM O=C(COc1ccccc1-c1ccccc1)Nc1c([O-])cccc1F ZINC000608365581 1038805058 /nfs/dbraw/zinc/80/50/58/1038805058.db2.gz NVZCYAYTMMFVLQ-UHFFFAOYSA-N -1 1 337.350 4.216 20 0 EIADMM C[C@H]1CCCN(Cc2cc(C(F)(F)F)ccc2Cl)[C@H]1C(=O)[O-] ZINC000424417521 1038852836 /nfs/dbraw/zinc/85/28/36/1038852836.db2.gz MCDGVBAKKHBFKI-TVQRCGJNSA-N -1 1 335.753 4.044 20 0 EIADMM C[C@@H](c1cccs1)N(C)C(=O)c1cc(Br)ccc1[O-] ZINC000120209034 1039075228 /nfs/dbraw/zinc/07/52/28/1039075228.db2.gz OHNDWXFWRONEIJ-VIFPVBQESA-N -1 1 340.242 4.049 20 0 EIADMM CCOc1cc(C(=O)Nc2cccc(OC(C)C)c2)cc(Cl)c1[O-] ZINC000456106561 1039096156 /nfs/dbraw/zinc/09/61/56/1039096156.db2.gz NMOXCOQRTLSOJC-UHFFFAOYSA-N -1 1 349.814 4.484 20 0 EIADMM CCSc1cccc([N-]S(=O)(=O)c2ccc(F)c(C)c2)c1 ZINC000505315555 1039214647 /nfs/dbraw/zinc/21/46/47/1039214647.db2.gz AHUJNQGNTMPXOW-UHFFFAOYSA-N -1 1 325.430 4.047 20 0 EIADMM O=C(CSc1ncc(C(F)(F)F)cc1Cl)c1ccc([O-])cc1 ZINC000016724981 1039456096 /nfs/dbraw/zinc/45/60/96/1039456096.db2.gz CPDPNDKSJRCLNY-UHFFFAOYSA-N -1 1 347.745 4.434 20 0 EIADMM Cc1nc(-c2ccc(N3CC=C(C(C)(C)C)CC3)nc2)[n-]c(=O)c1C ZINC000534606716 1039595608 /nfs/dbraw/zinc/59/56/08/1039595608.db2.gz KUTUQMSTVBDHPD-UHFFFAOYSA-N -1 1 338.455 4.044 20 0 EIADMM CC(C)(CC(=O)Nc1ccc([O-])c(F)c1F)CC(=O)c1ccccc1 ZINC000456784719 1039603960 /nfs/dbraw/zinc/60/39/60/1039603960.db2.gz MKPGFVMZLANPJN-UHFFFAOYSA-N -1 1 347.361 4.298 20 0 EIADMM COc1ccc2c(c1)CCC[C@H]2CC(=O)Nc1ccc([O-])c(F)c1F ZINC000456795881 1039612114 /nfs/dbraw/zinc/61/21/14/1039612114.db2.gz VRPTVXJTLRYUSY-LBPRGKRZSA-N -1 1 347.361 4.128 20 0 EIADMM O=C(CCn1ccc2cc(Cl)ccc21)Nc1ccc(F)cc1[O-] ZINC000534709453 1039718335 /nfs/dbraw/zinc/71/83/35/1039718335.db2.gz RGBBJBLEKKNYNJ-UHFFFAOYSA-N -1 1 332.762 4.168 20 0 EIADMM COc1cc([N-]S(=O)(=O)c2cc(Cl)ccc2C)c(C)cc1C ZINC000478699243 1039877022 /nfs/dbraw/zinc/87/70/22/1039877022.db2.gz DZWBIMYYAWQUFO-UHFFFAOYSA-N -1 1 339.844 4.075 20 0 EIADMM CCc1cccc(CC)c1[N-]S(=O)(=O)c1ccc2ncsc2c1 ZINC000479133311 1040142729 /nfs/dbraw/zinc/14/27/29/1040142729.db2.gz LNWBLNRMNHFKQY-UHFFFAOYSA-N -1 1 346.477 4.222 20 0 EIADMM CC(C)[C@H](Cc1ccccc1)C(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC000477131988 1040249877 /nfs/dbraw/zinc/24/98/77/1040249877.db2.gz IXLPITVYJSPZOI-SFHVURJKSA-N -1 1 349.434 4.236 20 0 EIADMM CCc1onc(C)c1[N-]C(=O)c1cc(-c2ccccc2Cl)on1 ZINC000535490328 1040306762 /nfs/dbraw/zinc/30/67/62/1040306762.db2.gz FVLPCXOBERSYIB-UHFFFAOYSA-N -1 1 331.759 4.106 20 0 EIADMM C[C@H](NC(=O)c1ccc(Br)c([O-])c1)[C@@H](C)c1ccccc1 ZINC000491243114 1040330137 /nfs/dbraw/zinc/33/01/37/1040330137.db2.gz KQSDGQILAJWCCX-NEPJUHHUSA-N -1 1 348.240 4.077 20 0 EIADMM Cc1ccc(C)c(C(=O)[C@H](C)Sc2nc(C(F)F)cc(=O)[n-]2)c1 ZINC000515051117 1040450230 /nfs/dbraw/zinc/45/02/30/1040450230.db2.gz QIKZQNDZUWZWSX-JTQLQIEISA-N -1 1 338.379 4.100 20 0 EIADMM Cc1cc(Br)c([O-])c(NC(=O)C2(c3ccccc3)CC2)c1 ZINC000482735593 1040458763 /nfs/dbraw/zinc/45/87/63/1040458763.db2.gz MHQJTVHKFHXVCD-UHFFFAOYSA-N -1 1 346.224 4.133 20 0 EIADMM Cc1nccc(N2CCC(c3ccccc3C(=O)[O-])CC2)c1Cl ZINC000668168620 1040590603 /nfs/dbraw/zinc/59/06/03/1040590603.db2.gz LVLGTVOSXJTOIJ-UHFFFAOYSA-N -1 1 330.815 4.126 20 0 EIADMM CC(=O)c1cc(F)c([N-]C(=O)c2cc(F)c(Cl)cc2F)c(F)c1 ZINC000539641227 1040639326 /nfs/dbraw/zinc/63/93/26/1040639326.db2.gz LEAOFVIKXVWAKW-UHFFFAOYSA-N -1 1 345.679 4.351 20 0 EIADMM CCCc1cc(=O)[n-]c(SCc2cc(-c3ccc(F)cc3)no2)n1 ZINC000032322909 1040647568 /nfs/dbraw/zinc/64/75/68/1040647568.db2.gz OAVLHYKDZKKPOV-UHFFFAOYSA-N -1 1 345.399 4.221 20 0 EIADMM O=C([N-]c1cc(F)cc(F)c1F)c1cc(-c2ccc(F)cc2)on1 ZINC000554072633 1040762147 /nfs/dbraw/zinc/76/21/47/1040762147.db2.gz VSYXHZXJVHKKEA-UHFFFAOYSA-N -1 1 336.244 4.150 20 0 EIADMM Cc1cc(Cl)ccc1S(=O)(=O)[N-]c1cccc(OC(F)F)c1 ZINC000515632219 1040912331 /nfs/dbraw/zinc/91/23/31/1040912331.db2.gz NBOPFMHXPUDJFE-UHFFFAOYSA-N -1 1 347.770 4.051 20 0 EIADMM Cc1nc(-c2ccc(NCc3ccc(C(C)C)cc3)nc2)[n-]c(=O)c1C ZINC000462784267 1040923195 /nfs/dbraw/zinc/92/31/95/1040923195.db2.gz BLKRRIWEMROUQM-UHFFFAOYSA-N -1 1 348.450 4.018 20 0 EIADMM Cc1ccc(F)cc1S(=O)(=O)[N-]c1ccc(OC2CCCC2)cc1 ZINC000515690979 1040977010 /nfs/dbraw/zinc/97/70/10/1040977010.db2.gz JSKRTDKTXDOVIK-UHFFFAOYSA-N -1 1 349.427 4.256 20 0 EIADMM CCc1cccc(C)c1[N-]S(=O)(=O)c1ccc(F)c2ncccc12 ZINC000505793757 1041089672 /nfs/dbraw/zinc/08/96/72/1041089672.db2.gz WTFNQPUUXBCKQM-UHFFFAOYSA-N -1 1 344.411 4.046 20 0 EIADMM Cc1cc(C)c(/C=C/CN[C@@H](C)c2nc(C(=O)[O-])cs2)cc1C ZINC000904024381 1041270940 /nfs/dbraw/zinc/27/09/40/1041270940.db2.gz RKAIQOFSSXIRCJ-GJBLVYBDSA-N -1 1 330.453 4.131 20 0 EIADMM CN(Cc1ccc(F)cc1Cl)C(=O)c1ccc(Cl)cc1[O-] ZINC000436487779 1041285956 /nfs/dbraw/zinc/28/59/56/1041285956.db2.gz QOPSPZCXLFGKGQ-UHFFFAOYSA-N -1 1 328.170 4.110 20 0 EIADMM Cc1ccc(C)n1C1CCN(C(=O)c2cc3ccccc3cc2[O-])CC1 ZINC000436532893 1041314509 /nfs/dbraw/zinc/31/45/09/1041314509.db2.gz HLWWUTWEMFAROI-UHFFFAOYSA-N -1 1 348.446 4.441 20 0 EIADMM Cc1ccccc1C1CCN(C(=O)c2cc(Cl)ccc2[O-])CC1 ZINC000436554124 1041327904 /nfs/dbraw/zinc/32/79/04/1041327904.db2.gz HXPWIRAQFYBHCD-UHFFFAOYSA-N -1 1 329.827 4.374 20 0 EIADMM CCCC[C@H]1CCC[C@H]1NC(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC000436552237 1041328178 /nfs/dbraw/zinc/32/81/78/1041328178.db2.gz BLYLGJLCNVFVFH-SMDDNHRTSA-N -1 1 325.836 4.143 20 0 EIADMM O=C(c1cc(Cl)ccc1[O-])N1C[C@H](c2ccccc2)[C@@H]2CCC[C@H]21 ZINC000436552230 1041328251 /nfs/dbraw/zinc/32/82/51/1041328251.db2.gz BLOLUPPHNZXVHU-CGTJXYLNSA-N -1 1 341.838 4.454 20 0 EIADMM O=C(c1cc(F)ccc1[O-])N(CCc1ccccc1F)C1CCCC1 ZINC000436538677 1041331919 /nfs/dbraw/zinc/33/19/19/1041331919.db2.gz ISVQVDGKMVBAAJ-UHFFFAOYSA-N -1 1 345.389 4.298 20 0 EIADMM CC[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)c1cc(F)ccc1[O-] ZINC000436539263 1041333550 /nfs/dbraw/zinc/33/35/50/1041333550.db2.gz NBEDYERCYPTCIO-FUHWJXTLSA-N -1 1 327.399 4.330 20 0 EIADMM C[C@H]1[C@H](Cc2ccccc2)CCN1C(=O)c1ccc(Cl)cc1[O-] ZINC000436576275 1041341623 /nfs/dbraw/zinc/34/16/23/1041341623.db2.gz PBFUWOACWFWKHO-ZFWWWQNUSA-N -1 1 329.827 4.139 20 0 EIADMM CC(C)c1ccc(C(=O)Nc2ccc3c(c2)CCCC(=O)N3)c([O-])c1 ZINC000436570973 1041349651 /nfs/dbraw/zinc/34/96/51/1041349651.db2.gz UGGQMDHNIDUPIZ-UHFFFAOYSA-N -1 1 338.407 4.043 20 0 EIADMM COc1ccc(C2CCN(C(=O)c3ccc(Cl)cc3[O-])CC2)cc1 ZINC000436570518 1041350044 /nfs/dbraw/zinc/35/00/44/1041350044.db2.gz ABGXTAHOTUBEGT-UHFFFAOYSA-N -1 1 345.826 4.074 20 0 EIADMM CCCCOc1ccc(C(=O)Nc2cnn([C@@H](C)CC)c2C)c([O-])c1 ZINC000436593874 1041352303 /nfs/dbraw/zinc/35/23/03/1041352303.db2.gz GGHLSIWZWAXVAB-ZDUSSCGKSA-N -1 1 345.443 4.299 20 0 EIADMM C[C@H]([C@@H](C)c1ccc(Cl)cc1)N(C)C(=O)c1cc(F)ccc1[O-] ZINC000436573109 1041352850 /nfs/dbraw/zinc/35/28/50/1041352850.db2.gz GZWBCOSXEQWLAE-VXGBXAGGSA-N -1 1 335.806 4.449 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1CCc2c(F)cc(F)cc2C1 ZINC000436597298 1041353777 /nfs/dbraw/zinc/35/37/77/1041353777.db2.gz PNEFMNCEUHJCIT-UHFFFAOYSA-N -1 1 339.341 4.022 20 0 EIADMM CSc1cccc([N-]S(=O)(=O)c2cccc(Cl)c2)c1C ZINC000540293686 1041360272 /nfs/dbraw/zinc/36/02/72/1041360272.db2.gz CNJBGXCOXYNTJS-UHFFFAOYSA-N -1 1 327.858 4.171 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N(Cc1ccc(O)cc1)CC1CC1 ZINC000436601272 1041368529 /nfs/dbraw/zinc/36/85/29/1041368529.db2.gz JHIVJOHAAXGPCG-UHFFFAOYSA-N -1 1 347.414 4.303 20 0 EIADMM COc1ccc2nc(C)cc(C(=O)Nc3ccc([O-])c(Cl)c3)c2c1 ZINC000436628942 1041380082 /nfs/dbraw/zinc/38/00/82/1041380082.db2.gz HXHIDJMLWPQKMM-UHFFFAOYSA-N -1 1 342.782 4.163 20 0 EIADMM O=C(N[C@@H](c1ccco1)c1ccccc1)c1ccc(Cl)cc1[O-] ZINC000436654300 1041394568 /nfs/dbraw/zinc/39/45/68/1041394568.db2.gz IETQAPKREHZGMB-QGZVFWFLSA-N -1 1 327.767 4.158 20 0 EIADMM O=C(c1ccc([O-])cc1F)N1C[C@H](c2ccccc2)[C@H]2CCCC[C@H]21 ZINC000436683246 1041420955 /nfs/dbraw/zinc/42/09/55/1041420955.db2.gz ZBBAGZGALKPBNZ-YVWKXTFCSA-N -1 1 339.410 4.330 20 0 EIADMM O=C(c1ccc([O-])cc1F)N1C[C@H](c2ccccc2)[C@@H]2CCCC[C@H]21 ZINC000436683242 1041420975 /nfs/dbraw/zinc/42/09/75/1041420975.db2.gz ZBBAGZGALKPBNZ-ILZDJORESA-N -1 1 339.410 4.330 20 0 EIADMM COc1ccc(CCCN(C)C(=O)c2ccc3ccccc3c2[O-])cc1 ZINC000436685193 1041421214 /nfs/dbraw/zinc/42/12/14/1041421214.db2.gz AVTPIKFCMHRPMG-UHFFFAOYSA-N -1 1 349.430 4.259 20 0 EIADMM Cc1cccc(C2=CCN(C(=O)c3ccc(Cl)cc3[O-])CC2)c1 ZINC000436700326 1041431091 /nfs/dbraw/zinc/43/10/91/1041431091.db2.gz VDMLEVXIUKXPTO-UHFFFAOYSA-N -1 1 327.811 4.284 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N(CCc1cccc(F)c1)C1CC1 ZINC000436719160 1041440485 /nfs/dbraw/zinc/44/04/85/1041440485.db2.gz NYVCQULNVGVIHI-UHFFFAOYSA-N -1 1 333.790 4.032 20 0 EIADMM Cc1ccccc1[C@H]1C[C@H](C)N(C(=O)c2ccc(Cl)cc2[O-])C1 ZINC000436716448 1041440692 /nfs/dbraw/zinc/44/06/92/1041440692.db2.gz BDIUQBQOLYZMSU-KBPBESRZSA-N -1 1 329.827 4.372 20 0 EIADMM CCN(CCc1ccccc1)C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436762131 1041459733 /nfs/dbraw/zinc/45/97/33/1041459733.db2.gz BOCUCPSXGQPTJE-UHFFFAOYSA-N -1 1 337.341 4.116 20 0 EIADMM C[C@@H]1C[C@@H](c2ccccc2)CCN1C(=O)c1cc(Cl)ccc1[O-] ZINC000436749600 1041461712 /nfs/dbraw/zinc/46/17/12/1041461712.db2.gz KLRIWJIGPPNREE-HIFRSBDPSA-N -1 1 329.827 4.454 20 0 EIADMM O=C(c1ccc(C(F)(F)F)cc1[O-])N1CCC[C@@]2(CC=CCC2)C1 ZINC000436750885 1041463273 /nfs/dbraw/zinc/46/32/73/1041463273.db2.gz IEKZLGOMQKPLLW-KRWDZBQOSA-N -1 1 339.357 4.374 20 0 EIADMM [O-]c1ccc(Cc2nc(Cc3ccccc3Cl)no2)cc1Cl ZINC000904376173 1041463250 /nfs/dbraw/zinc/46/32/50/1041463250.db2.gz YQYOVYVJJZVNFZ-UHFFFAOYSA-N -1 1 335.190 4.264 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1CCC[C@H]1Cc1ccccc1 ZINC000436754975 1041466374 /nfs/dbraw/zinc/46/63/74/1041466374.db2.gz JWAPZPJZXGZVEB-SFHVURJKSA-N -1 1 331.415 4.393 20 0 EIADMM C[C@H]1CN(C(=O)c2ccc(C(F)(F)F)cc2[O-])[C@H]1c1ccccc1 ZINC000436754340 1041466521 /nfs/dbraw/zinc/46/65/21/1041466521.db2.gz YHFMAIIVQXHULH-MEDUHNTESA-N -1 1 335.325 4.244 20 0 EIADMM O=C(NCc1cnc2ccccc2c1)c1cc2ccccc2cc1[O-] ZINC000436788383 1041482238 /nfs/dbraw/zinc/48/22/38/1041482238.db2.gz YHVGMHUBSXCCGN-UHFFFAOYSA-N -1 1 328.371 4.024 20 0 EIADMM Cc1csc(Nc2ccc(NC(=O)c3ccccc3[O-])cc2)n1 ZINC000436804476 1041489547 /nfs/dbraw/zinc/48/95/47/1041489547.db2.gz BHVBIRHKIKMSLV-UHFFFAOYSA-N -1 1 325.393 4.153 20 0 EIADMM [O-]c1ccc(Cc2nc(CCCc3ccccc3)no2)cc1Cl ZINC000904459742 1041493936 /nfs/dbraw/zinc/49/39/36/1041493936.db2.gz ILKPQBMZWDWJGY-UHFFFAOYSA-N -1 1 328.799 4.195 20 0 EIADMM CCSc1cccc(F)c1[N-]C(=O)c1cc2c(C)nn(C)c2s1 ZINC000484925168 1041523086 /nfs/dbraw/zinc/52/30/86/1041523086.db2.gz JGONZNCHFYEYIY-UHFFFAOYSA-N -1 1 349.456 4.447 20 0 EIADMM O=C(c1ccccc1[O-])N1CCN(Cc2ccccc2)c2ccccc21 ZINC000436869314 1041528126 /nfs/dbraw/zinc/52/81/26/1041528126.db2.gz KRNAYPJQTQTKOO-UHFFFAOYSA-N -1 1 344.414 4.059 20 0 EIADMM CCOc1cc(-c2noc([C@@H]3CCC(F)(F)C3)n2)cc(Cl)c1[O-] ZINC000436875861 1041532379 /nfs/dbraw/zinc/53/23/79/1041532379.db2.gz FUXRSRYDUOORSB-MRVPVSSYSA-N -1 1 344.745 4.397 20 0 EIADMM COc1ccc2c(c1)[C@@H](c1nc(-c3ccc([O-])cc3Cl)no1)CC2 ZINC000436875900 1041533442 /nfs/dbraw/zinc/53/34/42/1041533442.db2.gz YYDMBTKZOKYGAH-ZDUSSCGKSA-N -1 1 342.782 4.182 20 0 EIADMM [O-]c1ccc(-c2noc(-c3ccncc3Oc3ccccc3)n2)cc1F ZINC000436876870 1041536601 /nfs/dbraw/zinc/53/66/01/1041536601.db2.gz BTOPYWZEAXGLJC-UHFFFAOYSA-N -1 1 349.321 4.436 20 0 EIADMM C[C@@H](NC(=O)c1ccc([O-])cc1F)c1cccc(Cl)c1Cl ZINC000436877613 1041537868 /nfs/dbraw/zinc/53/78/68/1041537868.db2.gz BJGBUZRTRZFWFC-MRVPVSSYSA-N -1 1 328.170 4.329 20 0 EIADMM [O-]c1ccc(-c2noc(C3CCC(C(F)(F)F)CC3)n2)c(F)c1 ZINC000436882000 1041538872 /nfs/dbraw/zinc/53/88/72/1041538872.db2.gz ZPMHQVHHBSDEHE-UHFFFAOYSA-N -1 1 330.281 4.417 20 0 EIADMM C[C@H](Oc1ccc(Cl)cc1)c1nc(-c2ccc([O-])cc2F)no1 ZINC000436880553 1041539087 /nfs/dbraw/zinc/53/90/87/1041539087.db2.gz RTEDGCFMNZPMMM-VIFPVBQESA-N -1 1 334.734 4.375 20 0 EIADMM COc1cccc(C2(c3noc(-c4ccc([O-])cc4F)n3)CCC2)c1 ZINC000436887193 1041541861 /nfs/dbraw/zinc/54/18/61/1041541861.db2.gz PXXRLILICLNBNB-UHFFFAOYSA-N -1 1 340.354 4.060 20 0 EIADMM [O-]c1ccc(F)cc1-c1nc(-c2ccc(N3CCCCC3)cc2)no1 ZINC000436890323 1041543280 /nfs/dbraw/zinc/54/32/80/1041543280.db2.gz YVYRVUPEGIZMEG-UHFFFAOYSA-N -1 1 339.370 4.239 20 0 EIADMM O=C(c1ccc([O-])cc1F)N1CCC[C@H](c2ccc(F)cc2)CC1 ZINC000436908575 1041548557 /nfs/dbraw/zinc/54/85/57/1041548557.db2.gz WAEDOUVYRQNPIV-ZDUSSCGKSA-N -1 1 331.362 4.080 20 0 EIADMM [O-]c1ccc(F)cc1-c1nc(COc2ccc3ccccc3c2)no1 ZINC000436912332 1041550517 /nfs/dbraw/zinc/55/05/17/1041550517.db2.gz SPNGSCWAHYJNCQ-UHFFFAOYSA-N -1 1 336.322 4.314 20 0 EIADMM O=C(c1cc(F)ccc1[O-])N1CC=C(c2cccc(Cl)c2)CC1 ZINC000436896415 1041551895 /nfs/dbraw/zinc/55/18/95/1041551895.db2.gz YOJJKFNOFGQBCR-UHFFFAOYSA-N -1 1 331.774 4.114 20 0 EIADMM CC(C)(C)OC1CC(CCNC(=O)c2cc3ccccc3cc2[O-])C1 ZINC000436947293 1041569765 /nfs/dbraw/zinc/56/97/65/1041569765.db2.gz GNXVDPGLKJGVTD-UHFFFAOYSA-N -1 1 341.451 4.259 20 0 EIADMM [O-]c1ccc(F)cc1-c1nc(-c2cccc(-c3cscn3)c2)no1 ZINC000436948717 1041569876 /nfs/dbraw/zinc/56/98/76/1041569876.db2.gz KLYASWXSKOHWIX-UHFFFAOYSA-N -1 1 339.351 4.372 20 0 EIADMM CCC[C@H](C)[C@H]1CCCN1C(=O)c1cc(Cl)c([O-])c(OCC)c1 ZINC000436963345 1041571796 /nfs/dbraw/zinc/57/17/96/1041571796.db2.gz CBFXQMVSRDUGHS-SWLSCSKDSA-N -1 1 339.863 4.485 20 0 EIADMM CCCOc1ccc(NC(=O)c2cc(Cl)c([O-])c(OCC)c2)cc1 ZINC000436969266 1041573095 /nfs/dbraw/zinc/57/30/95/1041573095.db2.gz YEWZZYRICFZWRO-UHFFFAOYSA-N -1 1 349.814 4.485 20 0 EIADMM CN(Cc1ccc(F)c(Cl)c1)C(=O)c1ccc(Cl)cc1[O-] ZINC000436951502 1041573805 /nfs/dbraw/zinc/57/38/05/1041573805.db2.gz SIPDQVYCOCOWCP-UHFFFAOYSA-N -1 1 328.170 4.110 20 0 EIADMM O=C(NCC1(Cc2ccccc2)CCCC1)c1ccc([O-])cc1F ZINC000436952019 1041573830 /nfs/dbraw/zinc/57/38/30/1041573830.db2.gz UHWASFAWAJCFIG-UHFFFAOYSA-N -1 1 327.399 4.064 20 0 EIADMM CCCN(C(=O)c1ccc(Cl)cc1[O-])[C@@H]1CCCc2cccnc21 ZINC000436956320 1041574941 /nfs/dbraw/zinc/57/49/41/1041574941.db2.gz QFQDNXZRZLZGHK-MRXNPFEDSA-N -1 1 344.842 4.370 20 0 EIADMM O=C(N[C@@H](CC(F)(F)F)c1ccc(F)cc1)c1c([O-])cccc1F ZINC000436986393 1041587525 /nfs/dbraw/zinc/58/75/25/1041587525.db2.gz FUJYOPRHSUCMNX-LBPRGKRZSA-N -1 1 345.267 4.094 20 0 EIADMM CCCNc1ccccc1NC(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC000436985872 1041587894 /nfs/dbraw/zinc/58/78/94/1041587894.db2.gz QCTWVCHYGNKJHF-UHFFFAOYSA-N -1 1 334.803 4.128 20 0 EIADMM COc1ccc(C(=O)N2C[C@H](c3ccccc3)c3ccccc32)c([O-])c1 ZINC000437001680 1041588252 /nfs/dbraw/zinc/58/82/52/1041588252.db2.gz KZICCINQTFHXSM-LJQANCHMSA-N -1 1 345.398 4.193 20 0 EIADMM Cc1cc([N-]S(=O)(=O)c2ccc(F)cc2C)c2cccnc2c1C ZINC000437299686 1041744038 /nfs/dbraw/zinc/74/40/38/1041744038.db2.gz ADACGGSREQUQSC-UHFFFAOYSA-N -1 1 344.411 4.100 20 0 EIADMM CCSc1nnc([N-]C(=O)c2ncsc2-c2ccccc2)s1 ZINC000438040328 1042025337 /nfs/dbraw/zinc/02/53/37/1042025337.db2.gz SOCAESBOCXEWCA-UHFFFAOYSA-N -1 1 348.478 4.026 20 0 EIADMM CCOc1cc(C(=O)N(C)c2ccc3cc[nH]c3c2)cc(Cl)c1[O-] ZINC000473585570 1042036004 /nfs/dbraw/zinc/03/60/04/1042036004.db2.gz RQWXJOPJUMWCLG-UHFFFAOYSA-N -1 1 344.798 4.202 20 0 EIADMM COc1cc(C(=O)Nc2ccc(C(C)(C)C)cc2O)cc(Cl)c1[O-] ZINC000506244335 1042197927 /nfs/dbraw/zinc/19/79/27/1042197927.db2.gz WYWDLEYJCSIXIH-UHFFFAOYSA-N -1 1 349.814 4.310 20 0 EIADMM O=S(=O)([N-]c1ccc(-c2ccccn2)cc1)c1ccc(Cl)cc1 ZINC000518022708 1042316668 /nfs/dbraw/zinc/31/66/68/1042316668.db2.gz JYSQEFHMMOHTFS-UHFFFAOYSA-N -1 1 344.823 4.203 20 0 EIADMM Cc1c(F)cccc1S(=O)(=O)[N-]c1ccc(-c2nccs2)cc1 ZINC000438796080 1042351962 /nfs/dbraw/zinc/35/19/62/1042351962.db2.gz ZQSLOAPFCRKODG-UHFFFAOYSA-N -1 1 348.424 4.058 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccccc2N2CCCCCC2)cc1 ZINC000518332140 1042473728 /nfs/dbraw/zinc/47/37/28/1042473728.db2.gz FWGGSGQUPGDOOT-UHFFFAOYSA-N -1 1 344.480 4.176 20 0 EIADMM O=S(=O)([N-]c1ccccc1CC(F)(F)F)c1ccc(Cl)cc1 ZINC000172901165 1042511276 /nfs/dbraw/zinc/51/12/76/1042511276.db2.gz JXQWEGFPQLGQNL-UHFFFAOYSA-N -1 1 349.761 4.246 20 0 EIADMM O=S(=O)([N-]c1cc(Cl)ccc1F)c1csc2ccccc21 ZINC000506568730 1042614264 /nfs/dbraw/zinc/61/42/64/1042614264.db2.gz QKWGOWRNKAFGNY-UHFFFAOYSA-N -1 1 341.816 4.495 20 0 EIADMM CC(C)c1nc2ccc([N-]S(=O)(=O)c3ccccc3)cc2s1 ZINC000520700712 1043011915 /nfs/dbraw/zinc/01/19/15/1043011915.db2.gz FKNLISUZJSIKGQ-UHFFFAOYSA-N -1 1 332.450 4.221 20 0 EIADMM Cc1ccc2ncccc2c1S(=O)(=O)[N-]c1cccc(C(F)F)c1 ZINC000673981429 1043232592 /nfs/dbraw/zinc/23/25/92/1043232592.db2.gz JYJNJPOAJRCHKD-UHFFFAOYSA-N -1 1 348.374 4.282 20 0 EIADMM Nc1cc(F)c(Br)cc1Nc1cc(F)c([O-])c(Cl)c1 ZINC001214490047 1043259765 /nfs/dbraw/zinc/25/97/65/1043259765.db2.gz ODCNKDIMWXPMIZ-UHFFFAOYSA-N -1 1 349.562 4.412 20 0 EIADMM COc1ccc(SCCCC(=O)Nc2c([O-])cccc2F)cc1 ZINC000672910852 1043499684 /nfs/dbraw/zinc/49/96/84/1043499684.db2.gz PXKKGGCMIYNMQX-UHFFFAOYSA-N -1 1 335.400 4.051 20 0 EIADMM O=C(OC[C@@H]1CC1(Cl)Cl)c1ccc(Cl)c(Cl)c1[O-] ZINC000730360616 1043503303 /nfs/dbraw/zinc/50/33/03/1043503303.db2.gz ZDNXJAVPLBASOH-YFKPBYRVSA-N -1 1 329.994 4.050 20 0 EIADMM CCc1cccc(CC)c1[N-]S(=O)(=O)c1cccc2ncccc21 ZINC000494537219 1043575464 /nfs/dbraw/zinc/57/54/64/1043575464.db2.gz QHLZRFPDQOUHAC-UHFFFAOYSA-N -1 1 340.448 4.160 20 0 EIADMM C[C@H](c1ccc(C(=O)[O-])o1)N(C)Cc1ccccc1C(F)(F)F ZINC000521257457 1043670812 /nfs/dbraw/zinc/67/08/12/1043670812.db2.gz JYTUUEOKKLSYBJ-SNVBAGLBSA-N -1 1 327.302 4.190 20 0 EIADMM CSc1cc(O)ccc1[N-]C(=O)c1cc(-c2cccs2)on1 ZINC000191187403 1043792369 /nfs/dbraw/zinc/79/23/69/1043792369.db2.gz ZEOGUOKYEFTYQF-UHFFFAOYSA-N -1 1 332.406 4.083 20 0 EIADMM CC(C)(C)OC(=O)Nc1ccc(-c2nc(C3CCC3)no2)c([O-])c1 ZINC000761650636 1043860964 /nfs/dbraw/zinc/86/09/64/1043860964.db2.gz SMWSBFLDVJSNHV-UHFFFAOYSA-N -1 1 331.372 4.057 20 0 EIADMM CCC1CCC(N(C)C(=O)c2cc(Cl)c([O-])c(OC)c2)CC1 ZINC000442853243 1043875104 /nfs/dbraw/zinc/87/51/04/1043875104.db2.gz IYZXLWBFXGWWPZ-UHFFFAOYSA-N -1 1 325.836 4.095 20 0 EIADMM CCn1ncc2ccc(NC(=O)Nc3ccc([O-])c(Cl)c3)cc21 ZINC000192209925 1043892429 /nfs/dbraw/zinc/89/24/29/1043892429.db2.gz IGFHPDDOVOPPMS-UHFFFAOYSA-N -1 1 330.775 4.059 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)Nc1ccc(-c2ccccc2)nn1 ZINC000192235253 1043896582 /nfs/dbraw/zinc/89/65/82/1043896582.db2.gz VZCVULWSQZBXTD-UHFFFAOYSA-N -1 1 340.770 4.147 20 0 EIADMM Cc1cc(C(C)(C)C)cc(C)c1S(=O)(=O)[N-]c1cccnc1C ZINC000467446108 1043896580 /nfs/dbraw/zinc/89/65/80/1043896580.db2.gz VHYBQUMATIPHAO-UHFFFAOYSA-N -1 1 332.469 4.105 20 0 EIADMM COc1cc(C(=O)N2CCC[C@H]2CCC(C)C)cc(Cl)c1[O-] ZINC000443067707 1043988607 /nfs/dbraw/zinc/98/86/07/1043988607.db2.gz UNGXGLAWWPRQHH-ZDUSSCGKSA-N -1 1 325.836 4.095 20 0 EIADMM COc1cc(C(=O)N[C@H](C)c2c(C)cccc2C)cc(Cl)c1[O-] ZINC000443112970 1044030866 /nfs/dbraw/zinc/03/08/66/1044030866.db2.gz HPCCAFQFNRVMSL-GFCCVEGCSA-N -1 1 333.815 4.162 20 0 EIADMM CSCc1cccc([N-]S(=O)(=O)c2cccc(Cl)c2C)c1 ZINC000521873314 1044045277 /nfs/dbraw/zinc/04/52/77/1044045277.db2.gz JRKOHYDDCZOGIW-UHFFFAOYSA-N -1 1 341.885 4.312 20 0 EIADMM C[C@H](c1ccccc1)N(Cc1ccccc1)C(=O)c1ncccc1[O-] ZINC000428269133 1044045573 /nfs/dbraw/zinc/04/55/73/1044045573.db2.gz HYBPMVPZKGFVDR-MRXNPFEDSA-N -1 1 332.403 4.191 20 0 EIADMM COc1cc(C(=O)N2CCC(C)(CC(C)C)CC2)cc(Cl)c1[O-] ZINC000494756637 1044067817 /nfs/dbraw/zinc/06/78/17/1044067817.db2.gz IPVBGUADIHOAOG-UHFFFAOYSA-N -1 1 339.863 4.343 20 0 EIADMM CCOc1cc(-c2nc(-c3ccccc3F)no2)cc(Cl)c1[O-] ZINC000443205292 1044092858 /nfs/dbraw/zinc/09/28/58/1044092858.db2.gz BZFOVVBPYOPCGY-UHFFFAOYSA-N -1 1 334.734 4.300 20 0 EIADMM CCOc1ccccc1-c1noc(-c2cc(Cl)c([O-])c(OC)c2)n1 ZINC000443226696 1044114430 /nfs/dbraw/zinc/11/44/30/1044114430.db2.gz QYWMDCVJTLICQY-UHFFFAOYSA-N -1 1 346.770 4.170 20 0 EIADMM CCC[C@H]1[C@@H](C)CCCN1C(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC000443278214 1044151819 /nfs/dbraw/zinc/15/18/19/1044151819.db2.gz DGKQQDKKGKYNDA-FZMZJTMJSA-N -1 1 325.836 4.095 20 0 EIADMM COc1cc(C(=O)N2CCCCCc3ccccc32)cc(Cl)c1[O-] ZINC000443299386 1044157042 /nfs/dbraw/zinc/15/70/42/1044157042.db2.gz IQLDMIBVEZCLPB-UHFFFAOYSA-N -1 1 345.826 4.427 20 0 EIADMM C[C@]1(c2ccccc2)CCCN(C(=O)c2c([O-])cccc2Cl)C1 ZINC000733367794 1044206300 /nfs/dbraw/zinc/20/63/00/1044206300.db2.gz SWXQOEGMCBYHJJ-IBGZPJMESA-N -1 1 329.827 4.240 20 0 EIADMM CCC(CC)(CC)C(=O)N1CCC(C(=O)c2ccc([O-])cc2)CC1 ZINC000675512281 1044370224 /nfs/dbraw/zinc/37/02/24/1044370224.db2.gz PGAXECUQWCKVMR-UHFFFAOYSA-N -1 1 331.456 4.030 20 0 EIADMM CCCOc1ccc([N-]S(=O)(=O)c2cccc(F)c2)cc1Cl ZINC000388961031 1044377540 /nfs/dbraw/zinc/37/75/40/1044377540.db2.gz BJVMEEHTCGKNCB-UHFFFAOYSA-N -1 1 343.807 4.069 20 0 EIADMM C[C@@H](NC(=O)c1c([O-])cccc1Cl)c1nc2ccccc2s1 ZINC000734177375 1044510673 /nfs/dbraw/zinc/51/06/73/1044510673.db2.gz IBLRHFNXOMLYHJ-SECBINFHSA-N -1 1 332.812 4.146 20 0 EIADMM CCOc1ccc(F)c([N-]C(=O)c2coc(C3CCCC3)n2)c1F ZINC000509268762 1044877323 /nfs/dbraw/zinc/87/73/23/1044877323.db2.gz HRJFENYSUWKYFG-UHFFFAOYSA-N -1 1 336.338 4.261 20 0 EIADMM C[C@H](CCNC(=O)c1ccc(C(F)(F)F)c([O-])c1)c1ccccc1 ZINC001626267298 1045014743 /nfs/dbraw/zinc/01/47/43/1045014743.db2.gz DKTZAOHWFUEGFS-GFCCVEGCSA-N -1 1 337.341 4.335 20 0 EIADMM C[C@H](c1ccc(F)c(F)c1)N1CCC(C(=O)c2ccc([O-])cc2)CC1 ZINC000125635082 1045031464 /nfs/dbraw/zinc/03/14/64/1045031464.db2.gz PGEDADRTYPMRFU-CYBMUJFWSA-N -1 1 345.389 4.326 20 0 EIADMM CSCc1ccccc1[N-]S(=O)(=O)c1cccc(SC)c1 ZINC000509383301 1045075123 /nfs/dbraw/zinc/07/51/23/1045075123.db2.gz BNPDHMKNVFTVME-UHFFFAOYSA-N -1 1 339.507 4.072 20 0 EIADMM Cc1ccccc1[N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1C ZINC000509090190 1045106127 /nfs/dbraw/zinc/10/61/27/1045106127.db2.gz QZGXZGHKMLNMMV-UHFFFAOYSA-N -1 1 329.343 4.123 20 0 EIADMM Cc1ccc(-c2ocnc2C(=O)Nc2ccc(Cl)cc2[O-])cc1 ZINC000533617001 1045640271 /nfs/dbraw/zinc/64/02/71/1045640271.db2.gz LMAAZFVLOVTNCO-UHFFFAOYSA-N -1 1 328.755 4.261 20 0 EIADMM O=C(c1c([O-])cccc1Cl)N(Cc1ccc(F)cc1F)C1CC1 ZINC000769673265 1046042638 /nfs/dbraw/zinc/04/26/38/1046042638.db2.gz XERHLOMWDLCTJX-UHFFFAOYSA-N -1 1 337.753 4.129 20 0 EIADMM CCN(C(=O)c1c([O-])cccc1Cl)[C@@H](C)Cc1ccc(OC)cc1 ZINC000769787661 1046072673 /nfs/dbraw/zinc/07/26/73/1046072673.db2.gz BPEFLCKYAADTJV-ZDUSSCGKSA-N -1 1 347.842 4.148 20 0 EIADMM C[C@@H]1CO[C@@H](c2ccccc2)[C@@H](C)N1C(=O)c1c([O-])cccc1Cl ZINC000769812873 1046079303 /nfs/dbraw/zinc/07/93/03/1046079303.db2.gz UJQODZKQSPJMEC-SNUQEOBHSA-N -1 1 345.826 4.036 20 0 EIADMM CCc1nc(C)c([C@H](C)N(C)C(=O)c2c([O-])cccc2Cl)s1 ZINC000769907183 1046094485 /nfs/dbraw/zinc/09/44/85/1046094485.db2.gz ILVRHBLUOSABCT-JTQLQIEISA-N -1 1 338.860 4.206 20 0 EIADMM CSc1cc(-c2ccc(C(F)(F)F)cc2[O-])nc(SC)n1 ZINC001243607232 1046364393 /nfs/dbraw/zinc/36/43/93/1046364393.db2.gz RZOPJLZXNXTIFY-UHFFFAOYSA-N -1 1 332.372 4.312 20 0 EIADMM O=C([O-])c1ccc(CN2CCC[C@H](Oc3ccccc3Cl)C2)cc1 ZINC000455659096 1046388066 /nfs/dbraw/zinc/38/80/66/1046388066.db2.gz ORXRNNMXBCRJMH-INIZCTEOSA-N -1 1 345.826 4.082 20 0 EIADMM CCc1cccc(S(=O)(=O)[N-]c2cccc(-c3nc(C)co3)c2)c1 ZINC000126818032 1046564110 /nfs/dbraw/zinc/56/41/10/1046564110.db2.gz JSMJRDDCVXBHNP-UHFFFAOYSA-N -1 1 342.420 4.013 20 0 EIADMM Cc1cnc(-c2cccc([N-]S(=O)(=O)c3ccc(Cl)cc3)c2)o1 ZINC000066814760 1046674393 /nfs/dbraw/zinc/67/43/93/1046674393.db2.gz HERPTZBBGHGGPX-UHFFFAOYSA-N -1 1 348.811 4.104 20 0 EIADMM COc1ccc(C(=O)Nc2ccc(N3CCCCCC3)cc2)c([O-])c1 ZINC000785596917 1046716621 /nfs/dbraw/zinc/71/66/21/1046716621.db2.gz BZRICJCQWQCBCR-UHFFFAOYSA-N -1 1 340.423 4.034 20 0 EIADMM CC(C)O[C@H](C(=O)Nc1cc(F)c([O-])cc1Cl)c1ccccc1 ZINC001157900382 1046829597 /nfs/dbraw/zinc/82/95/97/1046829597.db2.gz YCPVPVKMUIGJHE-INIZCTEOSA-N -1 1 337.778 4.290 20 0 EIADMM Cc1nc(C(C)C)[n-]c(=O)c1C(=O)NC1CCC2(CCCCC2)CC1 ZINC000787494469 1047018207 /nfs/dbraw/zinc/01/82/07/1047018207.db2.gz JTICXTMSFTYZSN-UHFFFAOYSA-N -1 1 345.487 4.237 20 0 EIADMM O=C([N-]c1ccccc1SCc1ccccc1)c1csnn1 ZINC000917955176 1047234436 /nfs/dbraw/zinc/23/44/36/1047234436.db2.gz XVVWGCFRGFHYAX-UHFFFAOYSA-N -1 1 327.434 4.083 20 0 EIADMM O=C([O-])CC[C@H]1CCCCN1Cc1ccc(F)c(C(F)(F)F)c1 ZINC000322234282 1047282980 /nfs/dbraw/zinc/28/29/80/1047282980.db2.gz JPXSZQXNRMKIIJ-GFCCVEGCSA-N -1 1 333.325 4.064 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2cccc(SC(F)F)c2)ccc1F ZINC000729835572 1047424219 /nfs/dbraw/zinc/42/42/19/1047424219.db2.gz CKOAUUNYJAPGCJ-UHFFFAOYSA-N -1 1 347.383 4.250 20 0 EIADMM Cc1sc(-c2ccco2)nc1C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000129598306 1047441812 /nfs/dbraw/zinc/44/18/12/1047441812.db2.gz AWSSJSITSKPMQG-UHFFFAOYSA-N -1 1 334.784 4.323 20 0 EIADMM C[C@H](CC(=O)Nc1nc(Cl)ccc1[O-])c1c[nH]c2ccccc21 ZINC000790048373 1047509702 /nfs/dbraw/zinc/50/97/02/1047509702.db2.gz UAFWVANPGLVQSF-SNVBAGLBSA-N -1 1 329.787 4.054 20 0 EIADMM O=C(Nc1cc(F)cc(F)c1[O-])c1ccc(F)cc1C(F)(F)F ZINC001142542707 1047601334 /nfs/dbraw/zinc/60/13/34/1047601334.db2.gz UHBYVQYCYUBNMG-UHFFFAOYSA-N -1 1 335.203 4.081 20 0 EIADMM C[C@@H]1CCCN(Cc2cc(Cl)cc(C(F)(F)F)c2)[C@@H]1C(=O)[O-] ZINC000424424871 1047766311 /nfs/dbraw/zinc/76/63/11/1047766311.db2.gz XPGICPBUMHDFCJ-RNCFNFMXSA-N -1 1 335.753 4.044 20 0 EIADMM Cc1cc2cc([N-]S(=O)(=O)c3cccc(C(C)C)c3)ccc2[nH]1 ZINC000460424675 1047778603 /nfs/dbraw/zinc/77/86/03/1047778603.db2.gz KPKQPQDTFBTXBH-UHFFFAOYSA-N -1 1 328.437 4.401 20 0 EIADMM Cc1c(COC(C)(C)C)cccc1[N-]S(=O)(=O)c1ccccc1 ZINC000476434245 1047809870 /nfs/dbraw/zinc/80/98/70/1047809870.db2.gz MRIQTJINQVJIJL-UHFFFAOYSA-N -1 1 333.453 4.111 20 0 EIADMM O=C(Cc1ccc([O-])c(Cl)c1)Nc1ccc(F)cc1OCC1CC1 ZINC001136854907 1047854955 /nfs/dbraw/zinc/85/49/55/1047854955.db2.gz ODEBIKUJBWTDOQ-UHFFFAOYSA-N -1 1 349.789 4.155 20 0 EIADMM CC[C@H](NC(=O)c1ncc2ccccc2c1[O-])C(C)(C)c1ccccc1 ZINC001136921688 1047898859 /nfs/dbraw/zinc/89/88/59/1047898859.db2.gz KTCUEEHJIHXXOF-SFHVURJKSA-N -1 1 348.446 4.427 20 0 EIADMM Cc1ccsc1-c1nsc([N-]C(=O)c2cc(C(C)(C)C)on2)n1 ZINC000131449208 1047952356 /nfs/dbraw/zinc/95/23/56/1047952356.db2.gz LVLAXOCDLCFFJL-UHFFFAOYSA-N -1 1 348.453 4.113 20 0 EIADMM Cc1cc(CNc2cc(C)cc(C[N-]C(=O)C(F)(F)F)c2)cs1 ZINC000825011392 1048010130 /nfs/dbraw/zinc/01/01/30/1048010130.db2.gz IPVRJFPPLRUVOS-UHFFFAOYSA-N -1 1 342.386 4.156 20 0 EIADMM Cc1cc(C[N-]C(=O)C(F)(F)F)cc(NCc2ccccc2C)c1 ZINC000825005777 1048010507 /nfs/dbraw/zinc/01/05/07/1048010507.db2.gz SVIPTHPFQHNSJN-UHFFFAOYSA-N -1 1 336.357 4.094 20 0 EIADMM C[C@H]1C[C@H](c2cccc(F)c2)N(C(=O)c2c([O-])cccc2Cl)C1 ZINC001137015075 1048064198 /nfs/dbraw/zinc/06/41/98/1048064198.db2.gz RURIHXOZQNBVFM-XHDPSFHLSA-N -1 1 333.790 4.408 20 0 EIADMM CCOc1cc(-c2noc(-c3cc(C)cc(C)n3)n2)cc(Cl)c1[O-] ZINC000809466471 1048363115 /nfs/dbraw/zinc/36/31/15/1048363115.db2.gz RORLUBFBCFNOCA-UHFFFAOYSA-N -1 1 345.786 4.173 20 0 EIADMM O=c1cc(C(F)F)nc(SCc2cc(Cl)nc(Cl)c2)[n-]1 ZINC000809987247 1048590371 /nfs/dbraw/zinc/59/03/71/1048590371.db2.gz SNVRAAZCZYUQEM-UHFFFAOYSA-N -1 1 338.166 4.114 20 0 EIADMM Cc1cnc(C(=O)NCCC(c2ccccc2)c2ccccc2)c([O-])c1 ZINC001135304408 1048649222 /nfs/dbraw/zinc/64/92/22/1048649222.db2.gz GCWQSFFWUVRDQE-UHFFFAOYSA-N -1 1 346.430 4.048 20 0 EIADMM CC(C)COc1cccc(CNC(=O)c2c([O-])cccc2Cl)c1 ZINC000920462738 1048678981 /nfs/dbraw/zinc/67/89/81/1048678981.db2.gz JSPYKRUDFRIOJH-UHFFFAOYSA-N -1 1 333.815 4.010 20 0 EIADMM [O-]c1cc(F)c(CN2CCC[C@H]2c2cc(F)ccc2F)c(F)c1 ZINC001144554562 1048723946 /nfs/dbraw/zinc/72/39/46/1048723946.db2.gz AFTBLDYEWBERAC-KRWDZBQOSA-N -1 1 325.305 4.286 20 0 EIADMM CCOc1ccc([C@H]2CCCN2Cc2c(F)cc([O-])cc2F)cc1 ZINC001144554795 1048724354 /nfs/dbraw/zinc/72/43/54/1048724354.db2.gz HUOYEIQDWFCLER-LJQANCHMSA-N -1 1 333.378 4.406 20 0 EIADMM CCC[C@H]1CC[C@H](C(=O)Nc2ccc(-n3ccc(=O)[n-]3)cc2)CC1 ZINC001144642762 1048777890 /nfs/dbraw/zinc/77/78/90/1048777890.db2.gz NAITVCHZMJIHJU-SHTZXODSSA-N -1 1 327.428 4.123 20 0 EIADMM Cc1ccc2cccc([N-]S(=O)(=O)/C=C/c3ccc(F)cc3)c2n1 ZINC000747612823 1048826678 /nfs/dbraw/zinc/82/66/78/1048826678.db2.gz XVXWUOIIZWZCIU-VAWYXSNFSA-N -1 1 342.395 4.095 20 0 EIADMM Cc1c(CN(C)C(=O)c2ccc(F)c([O-])c2)oc2c1cccc2C ZINC001144862439 1048870896 /nfs/dbraw/zinc/87/08/96/1048870896.db2.gz PAQAMVLUAMKVPJ-UHFFFAOYSA-N -1 1 327.355 4.167 20 0 EIADMM CCC(CC)(Cc1nc2ccccc2s1)C(=O)[N-]OCC1CC1 ZINC000817357213 1048945022 /nfs/dbraw/zinc/94/50/22/1048945022.db2.gz CUHVSLLXUZTCEY-UHFFFAOYSA-N -1 1 332.469 4.103 20 0 EIADMM O=C(c1c([O-])cnc2c(F)cccc21)N1CCC[C@H]1c1ccccc1 ZINC001135937768 1048997933 /nfs/dbraw/zinc/99/79/33/1048997933.db2.gz ZQZPPXMDHKRGIJ-INIZCTEOSA-N -1 1 336.366 4.057 20 0 EIADMM C[C@H](NC(=O)c1ccc(Cl)cc1[O-])c1ccccc1OC(F)F ZINC001135939582 1049000979 /nfs/dbraw/zinc/00/09/79/1049000979.db2.gz HNBCEHQXYQONCX-VIFPVBQESA-N -1 1 341.741 4.138 20 0 EIADMM CC(C)(CNC(=O)c1c([O-])cccc1F)c1ccc(F)cc1Cl ZINC001146696045 1049046226 /nfs/dbraw/zinc/04/62/26/1049046226.db2.gz XRLKRQQTYWMJAR-UHFFFAOYSA-N -1 1 339.769 4.031 20 0 EIADMM CSc1ccc([O-])c(C(=O)Nc2ccc(F)cc2OCC2CC2)c1 ZINC001147257157 1049117194 /nfs/dbraw/zinc/11/71/94/1049117194.db2.gz XJNGJUIFBORSQW-UHFFFAOYSA-N -1 1 347.411 4.294 20 0 EIADMM CC[C@@H](C)c1ccc([C@@H](NC(=O)c2cncc([O-])c2)C(C)C)cc1 ZINC001136136770 1049145559 /nfs/dbraw/zinc/14/55/59/1049145559.db2.gz UAWGWEUJWDELMZ-KUHUBIRLSA-N -1 1 326.440 4.428 20 0 EIADMM O=C(Nc1ccc(Nc2ccccc2)cn1)c1c(F)ccc([O-])c1F ZINC001148207980 1049278536 /nfs/dbraw/zinc/27/85/36/1049278536.db2.gz KGDWRGZUKMBLRN-UHFFFAOYSA-N -1 1 341.317 4.061 20 0 EIADMM CC[C@@H](C)c1ccc(S(=O)(=O)[N-]c2ccnc(Cl)c2C)cc1 ZINC000811836126 1049284116 /nfs/dbraw/zinc/28/41/16/1049284116.db2.gz DZACKFKZHOSZKF-LLVKDONJSA-N -1 1 338.860 4.358 20 0 EIADMM Cc1cc(=O)n(-c2ccc(C(=O)Nc3cccc(C(C)(C)C)c3)cc2)[n-]1 ZINC001148337529 1049302257 /nfs/dbraw/zinc/30/22/57/1049302257.db2.gz MULOFBMDGFAVPY-UHFFFAOYSA-N -1 1 349.434 4.349 20 0 EIADMM CC1(C)[C@@H](c2ccccc2)[C@@H]1NC(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC001148486609 1049327273 /nfs/dbraw/zinc/32/72/73/1049327273.db2.gz XJFLQSKOGIIUGE-HOTGVXAUSA-N -1 1 349.352 4.333 20 0 EIADMM CC(C)(C)[C@H]1CCCN1C(=O)c1cc(-c2ccc(C=O)o2)ccc1[O-] ZINC001148541256 1049331521 /nfs/dbraw/zinc/33/15/21/1049331521.db2.gz LDRAVVIBRSUAAS-GOSISDBHSA-N -1 1 341.407 4.115 20 0 EIADMM CCOc1cc(C(=O)Nc2cc(C)cc(C)c2O)cc(Cl)c1[O-] ZINC001170655309 1049335417 /nfs/dbraw/zinc/33/54/17/1049335417.db2.gz JFVRZLXSFOKAFN-UHFFFAOYSA-N -1 1 335.787 4.019 20 0 EIADMM COc1cc(C)c(NC(=O)c2ccc(C(F)(F)F)cc2[O-])cc1C ZINC001148799709 1049382651 /nfs/dbraw/zinc/38/26/51/1049382651.db2.gz UKNMECQBGYKPQG-UHFFFAOYSA-N -1 1 339.313 4.289 20 0 EIADMM COc1cc(NC(=O)c2cccc(-c3ccccc3)c2[O-])cc(OC)c1 ZINC001148860998 1049391408 /nfs/dbraw/zinc/39/14/08/1049391408.db2.gz GFMUOHCVFSUYON-UHFFFAOYSA-N -1 1 349.386 4.329 20 0 EIADMM O=C(Nc1c[nH]c2cccnc12)c1cccc(-c2ccccc2)c1[O-] ZINC001148861185 1049391613 /nfs/dbraw/zinc/39/16/13/1049391613.db2.gz NWOKRIFKMQULST-UHFFFAOYSA-N -1 1 329.359 4.188 20 0 EIADMM O=C([N-]c1nocc1C1CC1)c1coc(-c2ccccc2Cl)n1 ZINC001133284868 1049473050 /nfs/dbraw/zinc/47/30/50/1049473050.db2.gz RKJDKHKVHCGEMF-UHFFFAOYSA-N -1 1 329.743 4.113 20 0 EIADMM COc1cnc(C=Cc2ccc(-c3ccccc3F)s2)[n-]c1=O ZINC000821009258 1049593560 /nfs/dbraw/zinc/59/35/60/1049593560.db2.gz YFNHXTPRUWOPJD-VQHVLOKHSA-N -1 1 328.368 4.229 20 0 EIADMM Cc1c(NCc2cc(Cl)cc(Cl)c2O)cccc1C(=O)[O-] ZINC000037122702 1049660612 /nfs/dbraw/zinc/66/06/12/1049660612.db2.gz ARLDMINQOLEBRF-UHFFFAOYSA-N -1 1 326.179 4.318 20 0 EIADMM COc1ccc(C2(NC(=O)c3ccc(Cl)cc3[O-])CCCC2)cc1 ZINC001136503763 1049699635 /nfs/dbraw/zinc/69/96/35/1049699635.db2.gz YXZJIGXAPRANRJ-UHFFFAOYSA-N -1 1 345.826 4.254 20 0 EIADMM C[C@H]1CCCC[C@@H]1CNC(=O)c1cc(-c2ccc(C=O)o2)ccc1[O-] ZINC001136512333 1049704171 /nfs/dbraw/zinc/70/41/71/1049704171.db2.gz XVTRRTKCRGNCSM-DZGCQCFKSA-N -1 1 341.407 4.021 20 0 EIADMM Cc1noc(-c2ccccc2)c1[N-]C(=O)c1coc(C(C)(C)C)n1 ZINC000821893200 1049705749 /nfs/dbraw/zinc/70/57/49/1049705749.db2.gz DRTLHLGFCHLVJH-UHFFFAOYSA-N -1 1 325.368 4.188 20 0 EIADMM Cc1cc(-c2cccc(Cl)c2)ccc1NC(=O)c1cnncc1[O-] ZINC001136552793 1049738924 /nfs/dbraw/zinc/73/89/24/1049738924.db2.gz GBHISIYBNVNYQS-UHFFFAOYSA-N -1 1 339.782 4.063 20 0 EIADMM CCCc1ccc([C@@H](NC(=O)C(=O)c2ccc([O-])cc2)C(C)C)cc1 ZINC001136558838 1049742755 /nfs/dbraw/zinc/74/27/55/1049742755.db2.gz FBJUOJIJLDOUSD-IBGZPJMESA-N -1 1 339.435 4.041 20 0 EIADMM CCc1ccc(C(=O)Nc2nc3c(ccc(C)c3C)s2)c([O-])c1 ZINC001171551905 1049753689 /nfs/dbraw/zinc/75/36/89/1049753689.db2.gz STDONOJOCYWIIM-UHFFFAOYSA-N -1 1 326.421 4.433 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1ccc2c(c1)CCCCC2=O ZINC000813494484 1049788572 /nfs/dbraw/zinc/78/85/72/1049788572.db2.gz NUGAZBBPEMZLQH-UHFFFAOYSA-N -1 1 329.783 4.207 20 0 EIADMM C[C@@H](C1CC1)N(Cc1ccccc1)C(=O)c1ncc2ccccc2c1[O-] ZINC001136636596 1049802862 /nfs/dbraw/zinc/80/28/62/1049802862.db2.gz FZVDFBIKSKLFPN-HNNXBMFYSA-N -1 1 346.430 4.381 20 0 EIADMM COc1ccccc1C(C)(C)NC(=O)c1cc2ccccc2cc1[O-] ZINC001136644292 1049807655 /nfs/dbraw/zinc/80/76/55/1049807655.db2.gz PDLZOTOARYGXIL-UHFFFAOYSA-N -1 1 335.403 4.219 20 0 EIADMM Cc1ccc(Oc2cccc(NC(=O)c3ccc([O-])cn3)c2)c(C)c1 ZINC001171950758 1049821187 /nfs/dbraw/zinc/82/11/87/1049821187.db2.gz ZSXARLLPSMVVTO-UHFFFAOYSA-N -1 1 334.375 4.449 20 0 EIADMM CN(C(=O)c1c([O-])cccc1Cl)[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000813888515 1049832359 /nfs/dbraw/zinc/83/23/59/1049832359.db2.gz ICRUSAAKCMJXPI-AOOOYVTPSA-N -1 1 335.753 4.239 20 0 EIADMM O=C(N[C@@H](c1nccs1)c1ccccc1)c1cc(Cl)ccc1[O-] ZINC001136718975 1049849374 /nfs/dbraw/zinc/84/93/74/1049849374.db2.gz NACRPMFHBICKJP-OAHLLOKOSA-N -1 1 344.823 4.022 20 0 EIADMM COCCOc1ccccc1Nc1cc(Cl)cc(Cl)c1[O-] ZINC001212640237 1049854163 /nfs/dbraw/zinc/85/41/63/1049854163.db2.gz HXFKJDPDZCPSPE-UHFFFAOYSA-N -1 1 328.195 4.468 20 0 EIADMM Cc1c2ccccc2oc1[C@@H](NC(=O)c1ncc(C)cc1[O-])C(C)C ZINC001136766097 1049870375 /nfs/dbraw/zinc/87/03/75/1049870375.db2.gz DSANTPLGTWYRHF-KRWDZBQOSA-N -1 1 338.407 4.277 20 0 EIADMM CSc1cccnc1[N-]C(=O)c1cnc(CCC(F)(F)F)s1 ZINC000824003662 1049890043 /nfs/dbraw/zinc/89/00/43/1049890043.db2.gz FHPOSDGLTWSZBY-UHFFFAOYSA-N -1 1 347.387 4.007 20 0 EIADMM C[C@H](CN(C)C(=O)c1cc(-c2ccc(C=O)o2)ccc1[O-])C(C)(C)C ZINC001177240030 1050170898 /nfs/dbraw/zinc/17/08/98/1050170898.db2.gz TZVVPRVLAQDJMJ-CYBMUJFWSA-N -1 1 343.423 4.219 20 0 EIADMM O=S(=O)([N-]c1cccc(-c2ccccc2)c1)c1ccc2n[nH]cc2c1 ZINC001185989680 1050198653 /nfs/dbraw/zinc/19/86/53/1050198653.db2.gz CHSXXKYTYIOHQA-UHFFFAOYSA-N -1 1 349.415 4.031 20 0 EIADMM O=S(=O)([N-]c1ccc(-c2ccccc2)cc1)c1ccc2n[nH]cc2c1 ZINC001185988331 1050199274 /nfs/dbraw/zinc/19/92/74/1050199274.db2.gz ZKAQGDDQTVNCGP-UHFFFAOYSA-N -1 1 349.415 4.031 20 0 EIADMM Cc1ccc2cccc(-c3noc(-c4ncc(C(F)(F)F)[n-]4)n3)c2n1 ZINC001212689377 1050227468 /nfs/dbraw/zinc/22/74/68/1050227468.db2.gz AYTBGSHMOMYSBP-UHFFFAOYSA-N -1 1 345.284 4.002 20 0 EIADMM Cc1ccc2cccc(-c3noc(-c4nc(C(F)(F)F)c[n-]4)n3)c2n1 ZINC001212689377 1050227484 /nfs/dbraw/zinc/22/74/84/1050227484.db2.gz AYTBGSHMOMYSBP-UHFFFAOYSA-N -1 1 345.284 4.002 20 0 EIADMM O=C(NCc1cccc(-c2cccs2)c1)c1ccc([O-])c(F)c1 ZINC001186233623 1050265457 /nfs/dbraw/zinc/26/54/57/1050265457.db2.gz LXNOOXFMNPOUEZ-UHFFFAOYSA-N -1 1 327.380 4.190 20 0 EIADMM O=C(c1ccc([O-])cc1F)N1CCC2(CCCc3ccccc32)CC1 ZINC001186319474 1050284424 /nfs/dbraw/zinc/28/44/24/1050284424.db2.gz WKTIQJGOQYTGPX-UHFFFAOYSA-N -1 1 339.410 4.042 20 0 EIADMM CC(C)c1oncc1[N-]C(=O)c1cnc(-c2c(F)cccc2F)s1 ZINC001177847209 1050314169 /nfs/dbraw/zinc/31/41/69/1050314169.db2.gz IEVLTSSZXLRIPU-UHFFFAOYSA-N -1 1 349.362 4.452 20 0 EIADMM O=S(=O)([N-]Cc1cccc2ccccc21)c1cc(Cl)ccc1F ZINC001186705975 1050392311 /nfs/dbraw/zinc/39/23/11/1050392311.db2.gz OWURZZHATMRROI-UHFFFAOYSA-N -1 1 349.814 4.111 20 0 EIADMM COc1ccc(-c2ccc(-c3noc(-c4ccncc4[O-])n3)cc2)cc1 ZINC001212722674 1050415727 /nfs/dbraw/zinc/41/57/27/1050415727.db2.gz UQLGNTMZPIQRTC-UHFFFAOYSA-N -1 1 345.358 4.180 20 0 EIADMM O=S(=O)([N-]c1ccccc1Cl)c1cc2c(s1)CCCC2 ZINC001187173513 1050503443 /nfs/dbraw/zinc/50/34/43/1050503443.db2.gz FIMCYRZSLVVEOO-UHFFFAOYSA-N -1 1 327.858 4.081 20 0 EIADMM CCOc1ccccc1Nc1ccc(F)c(Br)c1[O-] ZINC001173850271 1050583626 /nfs/dbraw/zinc/58/36/26/1050583626.db2.gz NIYPKHZCCARDOP-UHFFFAOYSA-N -1 1 326.165 4.436 20 0 EIADMM O=C(Nc1ccc2c(c1)OCO2)Nc1cc(Cl)c(Cl)cc1[O-] ZINC001187867426 1050636233 /nfs/dbraw/zinc/63/62/33/1050636233.db2.gz JIBPMORZBVMJHB-UHFFFAOYSA-N -1 1 341.150 4.072 20 0 EIADMM CC1(C)CCCC[C@H]1[N-]S(=O)(=O)c1cc(Cl)sc1Cl ZINC001188034994 1050685984 /nfs/dbraw/zinc/68/59/84/1050685984.db2.gz PLBQAPMEVVMOGK-SECBINFHSA-N -1 1 342.313 4.302 20 0 EIADMM CC1(C)CCN(C(=O)c2cc(F)ccc2[O-])C[C@@H]1c1ccccc1 ZINC001179370645 1050684982 /nfs/dbraw/zinc/68/49/82/1050684982.db2.gz BSZARLKQJAXZFH-QGZVFWFLSA-N -1 1 327.399 4.187 20 0 EIADMM O=C(Nc1cccc(-c2cccs2)c1)c1ncc(C(F)(F)F)[n-]1 ZINC001188288477 1050732487 /nfs/dbraw/zinc/73/24/87/1050732487.db2.gz ASEMWNLOLVJCCP-UHFFFAOYSA-N -1 1 337.326 4.409 20 0 EIADMM O=C(Nc1cccc(-c2cccs2)c1)c1nc(C(F)(F)F)c[n-]1 ZINC001188288477 1050732504 /nfs/dbraw/zinc/73/25/04/1050732504.db2.gz ASEMWNLOLVJCCP-UHFFFAOYSA-N -1 1 337.326 4.409 20 0 EIADMM COc1ccc(C(C)(C)C(=O)Nc2cc(F)c([O-])cc2Cl)cc1 ZINC001179659990 1050740823 /nfs/dbraw/zinc/74/08/23/1050740823.db2.gz JXUAFPJNNBGEFM-UHFFFAOYSA-N -1 1 337.778 4.110 20 0 EIADMM COc1ccc(NC(=O)Nc2cc([O-])c(Cl)cc2F)cc1Cl ZINC001188472329 1050780121 /nfs/dbraw/zinc/78/01/21/1050780121.db2.gz FOOWXUPRZGJRHV-UHFFFAOYSA-N -1 1 345.157 4.491 20 0 EIADMM O=C(Nc1csc2cnccc12)c1ccc([O-])c(C(F)(F)F)c1 ZINC001188572659 1050793072 /nfs/dbraw/zinc/79/30/72/1050793072.db2.gz UIOTXNJWUMTARW-UHFFFAOYSA-N -1 1 338.310 4.273 20 0 EIADMM CCS[C@H]1CCCC[C@H]1NC(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC000619582733 1050824940 /nfs/dbraw/zinc/82/49/40/1050824940.db2.gz HXGAAWOXAZRUCV-OCCSQVGLSA-N -1 1 347.402 4.205 20 0 EIADMM O=C(NC1CCCC1)c1cccc(Nc2ccc(F)c(F)c2[O-])c1 ZINC001174197458 1050832878 /nfs/dbraw/zinc/83/28/78/1050832878.db2.gz GGBBOEAMZNLHMG-UHFFFAOYSA-N -1 1 332.350 4.086 20 0 EIADMM COc1cc([C@@H](C)NC(=O)c2ccc([O-])c(F)c2)cc2ccccc21 ZINC001179986357 1050842409 /nfs/dbraw/zinc/84/24/09/1050842409.db2.gz GLOUBCVLGAINPS-GFCCVEGCSA-N -1 1 339.366 4.184 20 0 EIADMM Cc1nc(SCc2c(Cl)ccc3cccnc32)[n-]c(=O)c1C ZINC001189061585 1050897726 /nfs/dbraw/zinc/89/77/26/1050897726.db2.gz QHCKJHRJVNVXSJ-UHFFFAOYSA-N -1 1 331.828 4.293 20 0 EIADMM O=C(Nc1ccc(OCc2ccccc2)cc1)Nc1ncccc1[O-] ZINC001189144584 1050914775 /nfs/dbraw/zinc/91/47/75/1050914775.db2.gz TUFUDHWUHNGHNR-UHFFFAOYSA-N -1 1 335.363 4.010 20 0 EIADMM CN(Cc1ccc([O-])c(F)c1F)[C@H](c1ccccc1)C(F)(F)F ZINC001180213105 1050917033 /nfs/dbraw/zinc/91/70/33/1050917033.db2.gz PCDHRYWVSHDZAH-OAHLLOKOSA-N -1 1 331.284 4.406 20 0 EIADMM Cc1ccc(F)cc1[N-]S(=O)(=O)c1ccc(F)c2ccccc21 ZINC001189347869 1050967924 /nfs/dbraw/zinc/96/79/24/1050967924.db2.gz KGLWRHISNOPDNI-UHFFFAOYSA-N -1 1 333.359 4.227 20 0 EIADMM Cc1cc(F)ccc1[N-]S(=O)(=O)c1ccc(F)c2ccccc21 ZINC001189349052 1050977128 /nfs/dbraw/zinc/97/71/28/1050977128.db2.gz SUZRSHGVFOORFE-UHFFFAOYSA-N -1 1 333.359 4.227 20 0 EIADMM Cc1ccc(C)c([N-]S(=O)(=O)c2ccc(F)c3ccccc32)c1 ZINC001189348381 1050977900 /nfs/dbraw/zinc/97/79/00/1050977900.db2.gz PBERDTFCHZBEQA-UHFFFAOYSA-N -1 1 329.396 4.397 20 0 EIADMM Cc1cnc(SCC(=O)c2ccc3c(c2)Cc2ccccc2-3)[n-]c1=O ZINC001189399451 1050983787 /nfs/dbraw/zinc/98/37/87/1050983787.db2.gz QHMYRLRXRYDPOW-UHFFFAOYSA-N -1 1 348.427 4.037 20 0 EIADMM [O-]c1c(Br)ccc(Cl)c1Nc1cnn(CC2CC2)c1 ZINC001174470906 1051013966 /nfs/dbraw/zinc/01/39/66/1051013966.db2.gz IHIRVARFNZDLIL-UHFFFAOYSA-N -1 1 342.624 4.158 20 0 EIADMM Cc1nc(C(=O)Nc2cccc(F)c2[O-])c(-c2ccccc2)s1 ZINC001151779393 1051024771 /nfs/dbraw/zinc/02/47/71/1051024771.db2.gz APBMHYQLVHVFTK-UHFFFAOYSA-N -1 1 328.368 4.216 20 0 EIADMM CCC(C)(C)c1ccc(S(=O)(=O)[N-]c2ccc([C@H](C)O)cc2)cc1 ZINC001190445861 1051176909 /nfs/dbraw/zinc/17/69/09/1051176909.db2.gz YCKKRLAURGRSHK-AWEZNQCLSA-N -1 1 347.480 4.228 20 0 EIADMM CCC(C)(C)c1ccc(S(=O)(=O)[N-]c2cc(OC)ccc2C)cc1 ZINC001190423101 1051180760 /nfs/dbraw/zinc/18/07/60/1051180760.db2.gz NFOITUNRMASBKP-UHFFFAOYSA-N -1 1 347.480 4.492 20 0 EIADMM O=S(=O)([N-]c1ccccc1-c1cnco1)c1ccc(C2CC2)cc1 ZINC001190499784 1051195764 /nfs/dbraw/zinc/19/57/64/1051195764.db2.gz IBEIOLIPHWMTCL-UHFFFAOYSA-N -1 1 340.404 4.020 20 0 EIADMM CC(C)Oc1cccc([N-]S(=O)(=O)c2ccc(C3CC3)cc2)c1 ZINC001190500441 1051196511 /nfs/dbraw/zinc/19/65/11/1051196511.db2.gz OKJXIBIEPHRTAX-UHFFFAOYSA-N -1 1 331.437 4.152 20 0 EIADMM CCCCc1ccc(S(=O)(=O)[N-]c2ccc3ccncc3c2)cc1 ZINC001191249601 1051393389 /nfs/dbraw/zinc/39/33/89/1051393389.db2.gz WXCOXFNPIJCFLC-UHFFFAOYSA-N -1 1 340.448 4.378 20 0 EIADMM CCCCc1ccc(S(=O)(=O)[N-]c2ccccc2C(C)(C)O)cc1 ZINC001191249129 1051411150 /nfs/dbraw/zinc/41/11/50/1051411150.db2.gz ONXGGUAGFHWGBZ-UHFFFAOYSA-N -1 1 347.480 4.057 20 0 EIADMM O=C(Nc1cccc(C(F)(F)F)c1[O-])[C@H]1C[C@H]1c1ccccc1F ZINC001182284751 1051467002 /nfs/dbraw/zinc/46/70/02/1051467002.db2.gz FPGZJVHVBQBMMO-QWRGUYRKSA-N -1 1 339.288 4.292 20 0 EIADMM C[C@@H]1CCC[C@@H](C)N1C(=O)c1ccccc1C(=O)c1ccc([O-])cc1 ZINC001191487709 1051467729 /nfs/dbraw/zinc/46/77/29/1051467729.db2.gz JNBBGKWNJJYTJW-HUUCEWRRSA-N -1 1 337.419 4.026 20 0 EIADMM O=C(c1ccncc1)c1ccc(Nc2c(F)ccc([O-])c2F)cc1 ZINC001175267801 1051503662 /nfs/dbraw/zinc/50/36/62/1051503662.db2.gz HUMMCPLDHFRBNR-UHFFFAOYSA-N -1 1 326.302 4.040 20 0 EIADMM CN(C)c1ccc(Nc2cc(Br)cc(Cl)c2[O-])cn1 ZINC001175343978 1051513333 /nfs/dbraw/zinc/51/33/33/1051513333.db2.gz LTKICNCNFNOTJE-UHFFFAOYSA-N -1 1 342.624 4.013 20 0 EIADMM CCS(=O)(=O)c1cccc(Nc2ccc(Cl)c(Cl)c2[O-])c1 ZINC001175453542 1051625140 /nfs/dbraw/zinc/62/51/40/1051625140.db2.gz JDQKQBHCVPUIQH-UHFFFAOYSA-N -1 1 346.235 4.236 20 0 EIADMM [O-]c1c(Cl)cc(Br)cc1Nc1ccc(CO)cc1 ZINC001175569920 1051673991 /nfs/dbraw/zinc/67/39/91/1051673991.db2.gz KQYQWJWCZDUSEG-UHFFFAOYSA-N -1 1 328.593 4.044 20 0 EIADMM C[C@@H]([N-]C(=O)C(F)(F)c1ccc(F)cc1)c1cc(F)cc(F)c1 ZINC001182890397 1051733154 /nfs/dbraw/zinc/73/31/54/1051733154.db2.gz BCSCZRQLEHOZAC-SECBINFHSA-N -1 1 329.268 4.073 20 0 EIADMM O=C([N-]c1cc(Cl)cc2ncoc21)c1nc(C(F)(F)F)cs1 ZINC001192458465 1051741460 /nfs/dbraw/zinc/74/14/60/1051741460.db2.gz SRBGORRCRWDAMR-UHFFFAOYSA-N -1 1 347.705 4.209 20 0 EIADMM CCN(CC)c1ccc(NC(=O)c2c(F)ccc([O-])c2F)c(C)c1 ZINC001192541576 1051763520 /nfs/dbraw/zinc/76/35/20/1051763520.db2.gz YODDCNYABOTLSE-UHFFFAOYSA-N -1 1 334.366 4.077 20 0 EIADMM O=C(NC1c2ccccc2-c2ccccc21)c1cc([O-])cc(F)c1F ZINC001192678813 1051789812 /nfs/dbraw/zinc/78/98/12/1051789812.db2.gz LEWVQBGUOMFXFI-UHFFFAOYSA-N -1 1 337.325 4.170 20 0 EIADMM O=C(Nc1c(Cl)ccc2ncccc21)c1cc([O-])cc(F)c1F ZINC001192665586 1051796590 /nfs/dbraw/zinc/79/65/90/1051796590.db2.gz ONSKDRXYWKVVBQ-UHFFFAOYSA-N -1 1 334.709 4.124 20 0 EIADMM [O-]C(c1cccc(Nc2cscn2)c1)(C(F)(F)F)C(F)(F)F ZINC001175945036 1051842693 /nfs/dbraw/zinc/84/26/93/1051842693.db2.gz ROQLRRRNJBGIAQ-UHFFFAOYSA-N -1 1 342.264 4.199 20 0 EIADMM CCc1ccc(C(C)(C)C(=O)Nc2cc(=O)n(-c3ccccc3)[n-]2)cc1 ZINC001183506546 1051857805 /nfs/dbraw/zinc/85/78/05/1051857805.db2.gz OYYNDJSAESSKAC-UHFFFAOYSA-N -1 1 349.434 4.057 20 0 EIADMM Cc1cccc(Cl)c1NC(=O)Nc1cc2ccc([O-])cc2oc1=O ZINC001183719263 1051888169 /nfs/dbraw/zinc/88/81/69/1051888169.db2.gz OLJHJIDGTJUZLD-UHFFFAOYSA-N -1 1 344.754 4.104 20 0 EIADMM CN(C)C(=O)c1ccc(F)c(Nc2ccc(Cl)c(Cl)c2[O-])c1 ZINC001176048776 1051895186 /nfs/dbraw/zinc/89/51/86/1051895186.db2.gz KPDBGOBNLUUPQP-UHFFFAOYSA-N -1 1 343.185 4.284 20 0 EIADMM CN(C)C(=O)c1cc(Nc2cc([O-])c(Cl)cc2F)ccc1Cl ZINC001176154399 1051943025 /nfs/dbraw/zinc/94/30/25/1051943025.db2.gz AOFBHPOAQDMLJV-UHFFFAOYSA-N -1 1 343.185 4.284 20 0 EIADMM Cc1cccc2ccn(CC(=O)Nc3cccc(C(F)(F)F)c3[O-])c21 ZINC001184194088 1051961523 /nfs/dbraw/zinc/96/15/23/1051961523.db2.gz UHEMWTMIBFIYQL-UHFFFAOYSA-N -1 1 348.324 4.313 20 0 EIADMM [O-]c1ccc(CNc2cccc(Oc3ccccc3)n2)c(F)c1F ZINC001184292256 1051989274 /nfs/dbraw/zinc/98/92/74/1051989274.db2.gz YILBVFWCGYZTIV-UHFFFAOYSA-N -1 1 328.318 4.470 20 0 EIADMM CSc1ccc([O-])c(C(=O)N2C[C@@H](C(C)C)Nc3ccccc32)c1 ZINC000621891711 1052005285 /nfs/dbraw/zinc/00/52/85/1052005285.db2.gz DZIQYDQUDVLHTL-INIZCTEOSA-N -1 1 342.464 4.211 20 0 EIADMM O=C(NC[C@H]1CCC=CCCC1)c1c([O-])cnc2ccc(Cl)cc21 ZINC001184452432 1052015123 /nfs/dbraw/zinc/01/51/23/1052015123.db2.gz SJHBUDBIUHWGSG-ZDUSSCGKSA-N -1 1 344.842 4.460 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc3ocnc3c2)c2ccccc12 ZINC001193856836 1052015789 /nfs/dbraw/zinc/01/57/89/1052015789.db2.gz GMRNDHBPDCBXSU-UHFFFAOYSA-N -1 1 338.388 4.090 20 0 EIADMM O=C([O-])C[C@H](NCc1ccc(-c2ccccc2F)o1)c1cccs1 ZINC000671162055 1052059905 /nfs/dbraw/zinc/05/99/05/1052059905.db2.gz JIJIBJIXMZANLG-HNNXBMFYSA-N -1 1 345.395 4.453 20 0 EIADMM CC1(C)[C@H](c2ccc(F)c(F)c2)CCN1C(=O)c1ccc(F)c([O-])c1 ZINC001176417098 1052067921 /nfs/dbraw/zinc/06/79/21/1052067921.db2.gz XSMVQUWGVNTHKU-ZDUSSCGKSA-N -1 1 349.352 4.218 20 0 EIADMM [O-]c1ccc(Cl)c(Nc2cnn(Cc3cccnc3)c2)c1Cl ZINC001176456393 1052079160 /nfs/dbraw/zinc/07/91/60/1052079160.db2.gz NHVRIIOEOXZROI-UHFFFAOYSA-N -1 1 335.194 4.082 20 0 EIADMM CCN(CC)C(=O)c1cc(Nc2cc(F)c([O-])cc2F)ccc1F ZINC001176519653 1052108410 /nfs/dbraw/zinc/10/84/10/1052108410.db2.gz IJDSHQAVLORGEU-UHFFFAOYSA-N -1 1 338.329 4.035 20 0 EIADMM CCN(CC)C(=O)c1cc(Nc2ccc(F)c(F)c2[O-])ccc1F ZINC001176521565 1052108629 /nfs/dbraw/zinc/10/86/29/1052108629.db2.gz ZAAMGRRIKQTHKO-UHFFFAOYSA-N -1 1 338.329 4.035 20 0 EIADMM Cc1c(O)cccc1[N-]S(=O)(=O)c1ccc2c(Cl)cccc2c1 ZINC001194242918 1052115651 /nfs/dbraw/zinc/11/56/51/1052115651.db2.gz LPFRJBBBRIUHHF-UHFFFAOYSA-N -1 1 347.823 4.308 20 0 EIADMM CCc1ccc([N-]S(=O)(=O)c2cccc3c(Cl)nccc32)cc1 ZINC001194455745 1052149169 /nfs/dbraw/zinc/14/91/69/1052149169.db2.gz SNYHWDMAUMJPDH-UHFFFAOYSA-N -1 1 346.839 4.251 20 0 EIADMM Cc1ccnc(Br)c1Nc1c(F)cc(F)c([O-])c1F ZINC001176663780 1052156937 /nfs/dbraw/zinc/15/69/37/1052156937.db2.gz LWUKTQPIJZHKPA-UHFFFAOYSA-N -1 1 333.107 4.019 20 0 EIADMM Cc1cccc(-c2cc(Nc3c(F)cc(F)c([O-])c3F)n(C)n2)c1 ZINC001176670567 1052157365 /nfs/dbraw/zinc/15/73/65/1052157365.db2.gz YZZTYPVCGLKATO-UHFFFAOYSA-N -1 1 333.313 4.262 20 0 EIADMM CCOC(=O)c1c(F)cc(F)cc1Nc1c(F)cc(F)c([O-])c1F ZINC001176672967 1052159463 /nfs/dbraw/zinc/15/94/63/1052159463.db2.gz QSAAJXDDUNUUQV-UHFFFAOYSA-N -1 1 347.239 4.008 20 0 EIADMM [O-]c1c(F)cc(F)c(Nc2cc(Br)ccc2O)c1F ZINC001176672473 1052160206 /nfs/dbraw/zinc/16/02/06/1052160206.db2.gz XEQPYRIXFCIZFG-UHFFFAOYSA-N -1 1 334.091 4.021 20 0 EIADMM Cc1cc([N-]S(=O)(=O)c2c(C)cccc2C)c2cccc(F)c2n1 ZINC001194609986 1052168812 /nfs/dbraw/zinc/16/88/12/1052168812.db2.gz SVDVZZAVLYOOBA-UHFFFAOYSA-N -1 1 344.411 4.100 20 0 EIADMM CC(C)(C)CC[N-]S(=O)(=O)c1c(Cl)cc(Cl)cc1Cl ZINC001185264478 1052205651 /nfs/dbraw/zinc/20/56/51/1052205651.db2.gz OZKLYSJVCWBVRG-UHFFFAOYSA-N -1 1 344.691 4.361 20 0 EIADMM O=S(=O)([N-]c1ccc(CCc2ccccc2)cc1)c1ccsc1 ZINC001185382728 1052226233 /nfs/dbraw/zinc/22/62/33/1052226233.db2.gz JJOCWQHAWQEEII-UHFFFAOYSA-N -1 1 343.473 4.334 20 0 EIADMM O=S(=O)([N-]c1ccc(Oc2cccc(F)c2)cc1)c1ccsc1 ZINC001185392229 1052227752 /nfs/dbraw/zinc/22/77/52/1052227752.db2.gz YNLBOQSBXOPFBB-UHFFFAOYSA-N -1 1 349.408 4.480 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2ccc3ncsc3c2)ccc1Cl ZINC001185485714 1052250729 /nfs/dbraw/zinc/25/07/29/1052250729.db2.gz ZHQKKUUFRRUNDM-UHFFFAOYSA-N -1 1 338.841 4.059 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2cccc(C(F)F)c2)ccc1Cl ZINC001185521345 1052255836 /nfs/dbraw/zinc/25/58/36/1052255836.db2.gz QYXRJLIUQQVVIR-UHFFFAOYSA-N -1 1 331.771 4.387 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2cccc(OC(C)C)c2)ccc1Cl ZINC001185524507 1052256032 /nfs/dbraw/zinc/25/60/32/1052256032.db2.gz GXONMDAKLNEMSH-UHFFFAOYSA-N -1 1 339.844 4.236 20 0 EIADMM O=c1[nH]c(-c2nc(-c3ccc([O-])cc3Cl)no2)cc2ccccc21 ZINC000350815652 1052769301 /nfs/dbraw/zinc/76/93/01/1052769301.db2.gz NNMIYWNINQYZIR-UHFFFAOYSA-N -1 1 339.738 4.016 20 0 EIADMM O=C([N-]c1c(F)cc(Cl)cc1F)c1occc1Br ZINC000180346389 1052795717 /nfs/dbraw/zinc/79/57/17/1052795717.db2.gz SMYRYKSNPXWYRO-UHFFFAOYSA-N -1 1 336.519 4.226 20 0 EIADMM COc1cc([N-]S(=O)(=O)c2cccc(C(F)F)c2)c(C)cc1C ZINC000794611616 1053230105 /nfs/dbraw/zinc/23/01/05/1053230105.db2.gz CPTJHWHMTWTOQY-UHFFFAOYSA-N -1 1 341.379 4.050 20 0 EIADMM CCc1ccccc1[C@H](CC(=O)[O-])NCc1ncc(C(C)C)s1 ZINC000864527632 1053307105 /nfs/dbraw/zinc/30/71/05/1053307105.db2.gz GPTVSYJGQNJCAZ-HNNXBMFYSA-N -1 1 332.469 4.135 20 0 EIADMM Cc1cccc(Cl)c1S(=O)(=O)[N-]c1ccc(OC(C)C)cc1 ZINC001195267923 1053352977 /nfs/dbraw/zinc/35/29/77/1053352977.db2.gz MGALUUUXBBIXNA-UHFFFAOYSA-N -1 1 339.844 4.236 20 0 EIADMM O=C(N[C@@H](c1ccccc1)C1CCCC1)c1cc([O-])cnc1Cl ZINC001195313196 1053375678 /nfs/dbraw/zinc/37/56/78/1053375678.db2.gz SDMWPTPYGGGVNX-INIZCTEOSA-N -1 1 330.815 4.102 20 0 EIADMM Cc1ccc([O-])c(C(=O)Nc2ccccc2-c2ccc(Cl)cn2)n1 ZINC001195330151 1053388126 /nfs/dbraw/zinc/38/81/26/1053388126.db2.gz MOEZVRMHDYGPJF-UHFFFAOYSA-N -1 1 339.782 4.063 20 0 EIADMM CCOC(=O)NC(=S)[N-]c1ccc(Cl)c(Cl)c1Cl ZINC001195486922 1053421225 /nfs/dbraw/zinc/42/12/25/1053421225.db2.gz NBTHPWGRERMJDO-UHFFFAOYSA-N -1 1 327.620 4.090 20 0 EIADMM [O-]c1cc(Cl)c(Cl)cc1NC(=S)NCc1ccccc1 ZINC001195626234 1053440861 /nfs/dbraw/zinc/44/08/61/1053440861.db2.gz DKOUWBPQYUQFNB-UHFFFAOYSA-N -1 1 327.236 4.186 20 0 EIADMM O=S(=O)([N-]c1ccc2c(c1)oc1ccccc12)c1ccc(O)cc1 ZINC001195794646 1053489045 /nfs/dbraw/zinc/48/90/45/1053489045.db2.gz DJEGMQZRIJMVFD-UHFFFAOYSA-N -1 1 339.372 4.092 20 0 EIADMM COc1ccc(C(=O)Nc2ccc3nc(C(C)C)sc3c2)c([O-])c1 ZINC001626025562 1053525552 /nfs/dbraw/zinc/52/55/52/1053525552.db2.gz DHPLOVBQTOMELR-UHFFFAOYSA-N -1 1 342.420 4.386 20 0 EIADMM CCOc1ccc(C(=O)Nc2ccc([O-])c(Cl)c2)cc1OCC ZINC000111668518 1053719134 /nfs/dbraw/zinc/71/91/34/1053719134.db2.gz KTZWWLIJKRVFEL-UHFFFAOYSA-N -1 1 335.787 4.095 20 0 EIADMM O=C(Nc1cc(F)c([O-])cc1Cl)C1(c2cccnc2)CCCC1 ZINC000885678796 1053810047 /nfs/dbraw/zinc/81/00/47/1053810047.db2.gz WGLJNTLLMOUBQE-UHFFFAOYSA-N -1 1 334.778 4.030 20 0 EIADMM CCOc1ccc(SCc2cc(=O)oc3cc([O-])ccc23)cc1 ZINC000016168516 1053821377 /nfs/dbraw/zinc/82/13/77/1053821377.db2.gz FLIPMTOTCUZIGZ-UHFFFAOYSA-N -1 1 328.389 4.190 20 0 EIADMM Cc1oc(-c2cccs2)nc1C(=O)[N-]c1nc(CC(C)C)ns1 ZINC000855706709 1053966470 /nfs/dbraw/zinc/96/64/70/1053966470.db2.gz SGNXUHDMMOFAMV-UHFFFAOYSA-N -1 1 348.453 4.014 20 0 EIADMM Cc1ccc(C(=O)Nc2cc(=O)n(-c3ccccc3)[n-]2)c(C)c1Cl ZINC001198213266 1054096351 /nfs/dbraw/zinc/09/63/51/1054096351.db2.gz DXRHICVLWCGFPS-UHFFFAOYSA-N -1 1 341.798 4.100 20 0 EIADMM CC(C)C(=O)c1ccc([C@H](C)C(=O)[N-]OCCCC(F)(F)F)cc1 ZINC000871216298 1054169857 /nfs/dbraw/zinc/16/98/57/1054169857.db2.gz VMQJJDFAOLNSIY-LBPRGKRZSA-N -1 1 345.361 4.019 20 0 EIADMM CC1CCN(c2ccc(NC(=O)c3cc(F)ccc3[O-])cc2)CC1 ZINC000857433296 1054237099 /nfs/dbraw/zinc/23/70/99/1054237099.db2.gz UUZDTSIAKPUMQH-UHFFFAOYSA-N -1 1 328.387 4.020 20 0 EIADMM Cc1c(=O)[n-]c(SC[C@@H]2CC3(CCC3)CO2)nc1-c1ccccc1 ZINC000871667381 1054243431 /nfs/dbraw/zinc/24/34/31/1054243431.db2.gz JLOHETSRCNFXER-HNNXBMFYSA-N -1 1 342.464 4.209 20 0 EIADMM O=c1cc(C(F)F)nc(SCc2cc(C(F)(F)F)co2)[n-]1 ZINC000871670920 1054245089 /nfs/dbraw/zinc/24/50/89/1054245089.db2.gz FWZACBSJHCHBAU-UHFFFAOYSA-N -1 1 326.246 4.024 20 0 EIADMM O=C(Nc1ccc(-c2nc3ccccc3[nH]2)cc1)c1ccccc1[O-] ZINC000060619938 1054716114 /nfs/dbraw/zinc/71/61/14/1054716114.db2.gz ZOLMXLQSOVFTFC-UHFFFAOYSA-N -1 1 329.359 4.188 20 0 EIADMM CC(C)c1ccc2nc(-c3ccccc3Br)[n-]c(=O)c2c1 ZINC000060797360 1054722299 /nfs/dbraw/zinc/72/22/99/1054722299.db2.gz IEJCKTCWKKMYKQ-UHFFFAOYSA-N -1 1 343.224 4.476 20 0 EIADMM Cc1ccccc1[N-]S(=O)(=O)c1cc(Cl)cc(C(F)(F)F)c1 ZINC001201343511 1054768330 /nfs/dbraw/zinc/76/83/30/1054768330.db2.gz OTIDVHUIUVEVEC-UHFFFAOYSA-N -1 1 349.761 4.468 20 0 EIADMM COc1cc(OC(F)(F)F)ccc1Nc1c([O-])cc(F)cc1F ZINC001201356086 1054769940 /nfs/dbraw/zinc/76/99/40/1054769940.db2.gz BEFPBCGNLDVFBI-UHFFFAOYSA-N -1 1 335.228 4.321 20 0 EIADMM Cc1oc(CN[C@@H](C)c2ccccc2C(F)(F)F)cc1C(=O)[O-] ZINC000902314214 1054778322 /nfs/dbraw/zinc/77/83/22/1054778322.db2.gz ZJNBWVVBVMRLBQ-VIFPVBQESA-N -1 1 327.302 4.156 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2cccc(COC(C)C)c2)cc1C ZINC000063849384 1054839084 /nfs/dbraw/zinc/83/90/84/1054839084.db2.gz MRPWASKHTSSMJA-UHFFFAOYSA-N -1 1 333.453 4.029 20 0 EIADMM CN(C)C(=O)c1cc(F)cc(Nc2cc(Cl)cc(Cl)c2[O-])c1 ZINC001201527780 1054845891 /nfs/dbraw/zinc/84/58/91/1054845891.db2.gz WBMQIMHAMYEINA-UHFFFAOYSA-N -1 1 343.185 4.284 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1csc(-c2ccccc2)n1 ZINC000109013901 1054870567 /nfs/dbraw/zinc/87/05/67/1054870567.db2.gz IHMGOAJNCSALSC-UHFFFAOYSA-N -1 1 330.796 4.421 20 0 EIADMM O=C(NCCCCOCc1ccccc1)c1cc2ccccc2cc1[O-] ZINC000064975647 1054892668 /nfs/dbraw/zinc/89/26/68/1054892668.db2.gz MWOZEGMONCJBGM-UHFFFAOYSA-N -1 1 349.430 4.272 20 0 EIADMM O=C(NCc1ccc([O-])c(Cl)c1)N(Cc1ccco1)C1CCCC1 ZINC000876393471 1054894113 /nfs/dbraw/zinc/89/41/13/1054894113.db2.gz HQVVZSFPICJPQD-UHFFFAOYSA-N -1 1 348.830 4.293 20 0 EIADMM O=C(Nc1ccc(Br)cc1)Nc1cc([O-])c(F)cc1F ZINC001202333281 1055142356 /nfs/dbraw/zinc/14/23/56/1055142356.db2.gz SPWIMYOJZNMWGN-UHFFFAOYSA-N -1 1 343.127 4.077 20 0 EIADMM C[C@@H](c1ccccc1)[N@@H+](Cc1nnc(-c2ccccc2O)o1)C1CC1 ZINC000878218901 1055211241 /nfs/dbraw/zinc/21/12/41/1055211241.db2.gz CGGNTYLSEBILQJ-AWEZNQCLSA-N -1 1 335.407 4.168 20 0 EIADMM Cc1ccc2nc(C)c(C(=O)Nc3ccc([O-])c(Cl)c3)cc2c1 ZINC000111666797 1055223662 /nfs/dbraw/zinc/22/36/62/1055223662.db2.gz QWMRTJXCURMNJP-UHFFFAOYSA-N -1 1 326.783 4.463 20 0 EIADMM CN(C(=O)c1ccc(Br)cc1[O-])C(C)(C)c1ccccc1 ZINC000671893189 1055615841 /nfs/dbraw/zinc/61/58/41/1055615841.db2.gz WPZWWNPFMJMKCA-UHFFFAOYSA-N -1 1 348.240 4.162 20 0 EIADMM C[C@H]1CN(C(=O)c2c([O-])cccc2Cl)CC[C@@H]1c1ccccc1 ZINC000743703803 1059078496 /nfs/dbraw/zinc/07/84/96/1059078496.db2.gz YPTIHBFEYRRCET-ZFWWWQNUSA-N -1 1 329.827 4.311 20 0 EIADMM O=C(Nc1ccc2c(c1)OC1(CCCCC1)O2)c1ccc([O-])cc1F ZINC000181093913 1059094585 /nfs/dbraw/zinc/09/45/85/1059094585.db2.gz YWUWBJKYKMVKNP-UHFFFAOYSA-N -1 1 343.354 4.215 20 0 EIADMM CC(C)CCc1nc(COC(=O)c2c([O-])cc(F)cc2F)cs1 ZINC000744881899 1059663769 /nfs/dbraw/zinc/66/37/69/1059663769.db2.gz ZUSLCQCFNVXMBS-UHFFFAOYSA-N -1 1 341.379 4.073 20 0 EIADMM CCOc1cc(C(=O)N2C[C@H](C)c3ccccc32)cc(Cl)c1[O-] ZINC000186624232 1060105362 /nfs/dbraw/zinc/10/53/62/1060105362.db2.gz RYBFPLGZEUWQCQ-NSHDSACASA-N -1 1 331.799 4.208 20 0 EIADMM CC(=O)c1cc(NC(=O)c2cc3sccc3c([O-])c2)ccc1F ZINC000804273217 1060326974 /nfs/dbraw/zinc/32/69/74/1060326974.db2.gz SFNIAYHVYBSORA-UHFFFAOYSA-N -1 1 329.352 4.201 20 0 EIADMM O=C(Nc1ccc(-n2ccc(=O)[n-]2)cc1)[C@@H]1CC[C@H]2CCCC[C@@H]2C1 ZINC001168913918 1060516715 /nfs/dbraw/zinc/51/67/15/1060516715.db2.gz HKUXAPDBJKUPGQ-BZUAXINKSA-N -1 1 339.439 4.123 20 0 EIADMM Cc1cc2c(cc1C)N(C(=O)c1ccc(C(F)(F)F)c([O-])c1)CC2 ZINC000804320257 1060805118 /nfs/dbraw/zinc/80/51/18/1060805118.db2.gz ZLMWCXAJRZOSON-UHFFFAOYSA-N -1 1 335.325 4.231 20 0 EIADMM Cc1ccc(NC(=O)c2cc(Br)ccc2[O-])cc1Cl ZINC000001606585 206306249 /nfs/dbraw/zinc/30/62/49/206306249.db2.gz AHMZZMYBRXHGRQ-UHFFFAOYSA-N -1 1 340.604 4.369 20 0 EIADMM Cc1ccc(C(=O)Nc2ccc(F)cc2[O-])cc1Oc1ccncc1 ZINC000532267062 1032126470 /nfs/dbraw/zinc/12/64/70/1032126470.db2.gz AMBHSGVKXSTZTM-UHFFFAOYSA-N -1 1 338.338 4.279 20 0 EIADMM COC(=O)c1c[n-]c(S[C@@H](C)c2ccc3cc(OC)ccc3c2)n1 ZINC000193543668 1032158667 /nfs/dbraw/zinc/15/86/67/1032158667.db2.gz YNUDBJYTDVGMNZ-NSHDSACASA-N -1 1 342.420 4.211 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2ccc(COC(C)C)cc2)c(C)s1 ZINC000194034901 1032161383 /nfs/dbraw/zinc/16/13/83/1032161383.db2.gz UVNIOZVJVNPLCX-UHFFFAOYSA-N -1 1 339.482 4.091 20 0 EIADMM CC(C)Oc1ncccc1COc1cc([O-])c(Cl)cc1Cl ZINC001229405955 1032173953 /nfs/dbraw/zinc/17/39/53/1032173953.db2.gz FWLSUAFOUFCULT-UHFFFAOYSA-N -1 1 328.195 4.460 20 0 EIADMM O=C(CC[C@H]1CCCCO1)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000529538913 1032428313 /nfs/dbraw/zinc/42/83/13/1032428313.db2.gz NGUUADXGFDHCHP-GFCCVEGCSA-N -1 1 333.815 4.487 20 0 EIADMM C[C@@H]1C(=O)CC[C@H]1CC(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000529538378 1032444609 /nfs/dbraw/zinc/44/46/09/1032444609.db2.gz BLFXUOJNQKYQKM-QWRGUYRKSA-N -1 1 331.799 4.143 20 0 EIADMM Cc1c(Cl)cc(Cl)cc1Nc1cc(S(C)(=O)=O)ccc1[O-] ZINC001211986485 1032577250 /nfs/dbraw/zinc/57/72/50/1032577250.db2.gz OBHBCLPUFMATDI-UHFFFAOYSA-N -1 1 346.235 4.155 20 0 EIADMM COc1ccc2c(c1)[C@@H](C(=O)Nc1ccc([O-])c(Cl)c1)CCC2 ZINC000654936389 1019029509 /nfs/dbraw/zinc/02/95/09/1019029509.db2.gz XNNQAVGGZVLDTN-AWEZNQCLSA-N -1 1 331.799 4.113 20 0 EIADMM O=S(=O)([N-]c1ccc(-c2cnc(C3CC3)o2)cc1)c1ccccc1 ZINC000026548222 1019226145 /nfs/dbraw/zinc/22/61/45/1019226145.db2.gz JAYCTXFMIFKSHP-UHFFFAOYSA-N -1 1 340.404 4.020 20 0 EIADMM CC(C)Nc1ccccc1NC(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC001167092853 1019891930 /nfs/dbraw/zinc/89/19/30/1019891930.db2.gz RKCJHDXWKBPGFS-UHFFFAOYSA-N -1 1 338.329 4.484 20 0 EIADMM CCSc1cccc(Br)c1[N-]C(=O)c1cc(C)on1 ZINC000362154455 1019969725 /nfs/dbraw/zinc/96/97/25/1019969725.db2.gz HJXVRVOWFDZVRI-UHFFFAOYSA-N -1 1 341.230 4.110 20 0 EIADMM O=C(NCCc1nc(C2CCCCC2)cs1)c1ccc([O-])cc1F ZINC000154884053 1020090909 /nfs/dbraw/zinc/09/09/09/1020090909.db2.gz IGPWXPOFCGDTKB-UHFFFAOYSA-N -1 1 348.443 4.008 20 0 EIADMM O=C(Nc1ccc2nc(C3CC3)sc2c1)c1cc(F)ccc1[O-] ZINC001625851411 1020282233 /nfs/dbraw/zinc/28/22/33/1020282233.db2.gz AXNGFTLSFBXIAX-UHFFFAOYSA-N -1 1 328.368 4.271 20 0 EIADMM CCc1c(=O)n([C@H](C)c2ccncc2)[n-]c1-c1ccc(F)cc1Cl ZINC000634626544 1020349556 /nfs/dbraw/zinc/34/95/56/1020349556.db2.gz GVQHYPGHHQAKKW-RISCZKNCSA-N -1 1 345.805 4.208 20 0 EIADMM Cc1noc(C)c1[N-]C(=O)c1ccc(-c2nc3ccccc3s2)o1 ZINC000340259093 1020694830 /nfs/dbraw/zinc/69/48/30/1020694830.db2.gz ZNFHNMMYEQIKMR-UHFFFAOYSA-N -1 1 339.376 4.413 20 0 EIADMM CSCCc1ccc([N-]S(=O)(=O)c2cc(C)sc2C)cc1 ZINC000340509429 1021172534 /nfs/dbraw/zinc/17/25/34/1021172534.db2.gz PLZOKMGUPZLEEN-UHFFFAOYSA-N -1 1 341.523 4.071 20 0 EIADMM Cc1cccc([N-]S(=O)(=O)c2cccc(OC(F)(F)F)c2)c1C ZINC000024222579 1021476663 /nfs/dbraw/zinc/47/66/63/1021476663.db2.gz CRGGQHMHGVKXMB-UHFFFAOYSA-N -1 1 345.342 4.003 20 0 EIADMM CCOc1cc(C(=O)N(CC)C2CC(C)(C)C2)cc(Cl)c1[O-] ZINC000413991695 1021586136 /nfs/dbraw/zinc/58/61/36/1021586136.db2.gz RNKIWCGYLXQHKU-UHFFFAOYSA-N -1 1 325.836 4.095 20 0 EIADMM Cc1cccc2c(CCC(=O)Nc3ccc([O-])c(Cl)c3)c[nH]c21 ZINC000173378914 1021881794 /nfs/dbraw/zinc/88/17/94/1021881794.db2.gz HKDJCZWBHQUQDW-UHFFFAOYSA-N -1 1 328.799 4.407 20 0 EIADMM O=C([O-])C[C@@H](NCc1ccccc1F)c1cccc(C(F)(F)F)c1 ZINC000340676049 1021894467 /nfs/dbraw/zinc/89/44/67/1021894467.db2.gz HVSOZPHXOYLBLS-OAHLLOKOSA-N -1 1 341.304 4.150 20 0 EIADMM CC(C)(C)c1ccc(S(=O)(=O)[N-]c2cc(F)cc(F)c2)cc1 ZINC000028781212 1021905807 /nfs/dbraw/zinc/90/58/07/1021905807.db2.gz OXDARUQHEMOJGX-UHFFFAOYSA-N -1 1 325.380 4.063 20 0 EIADMM CCSc1cccc(F)c1[N-]S(=O)(=O)Cc1ccccc1F ZINC000580399251 1021974082 /nfs/dbraw/zinc/97/40/82/1021974082.db2.gz UIABVVJKWCLPSX-UHFFFAOYSA-N -1 1 343.420 4.019 20 0 EIADMM CCCCc1ccc([N-]S(=O)(=O)c2ccc(C(C)=O)cc2)cc1 ZINC000007055352 1022023648 /nfs/dbraw/zinc/02/36/48/1022023648.db2.gz TWQNHLQOYXSNSJ-UHFFFAOYSA-N -1 1 331.437 4.033 20 0 EIADMM CC(=CC(=O)Nc1n[n-]c(C(F)(F)F)n1)c1ccccc1Cl ZINC000066629117 1022105742 /nfs/dbraw/zinc/10/57/42/1022105742.db2.gz BMDNSGKECMJWKD-SREVYHEPSA-N -1 1 330.697 4.168 20 0 EIADMM O=C([O-])c1csc(CN2CCCCC[C@H]2/C=C\c2ccccc2)n1 ZINC000580720472 1022406700 /nfs/dbraw/zinc/40/67/00/1022406700.db2.gz JTWMBCQIQBYEQJ-SNGWPZLWSA-N -1 1 342.464 4.299 20 0 EIADMM CCc1cccc(S(=O)(=O)[N-]c2ccc(-c3cnc(C)o3)cc2)c1 ZINC000176436572 1022715267 /nfs/dbraw/zinc/71/52/67/1022715267.db2.gz XERBBRAQHRHHMZ-UHFFFAOYSA-N -1 1 342.420 4.013 20 0 EIADMM CC(C)[C@@H]1CCCN(C(=O)c2ccc(Br)c([O-])c2)CC1 ZINC000228317172 1022775847 /nfs/dbraw/zinc/77/58/47/1022775847.db2.gz HRHPFPMLJSTUMB-GFCCVEGCSA-N -1 1 340.261 4.053 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@H](O)c1cc(Cl)cc(Cl)c1 ZINC000182874187 1022833382 /nfs/dbraw/zinc/83/33/82/1022833382.db2.gz KBMWWXDYKJBZPJ-CYBMUJFWSA-N -1 1 346.597 4.025 20 0 EIADMM CS[C@H]1CCCC[N@H+]([C@H](C(=O)[O-])c2ccc(Cl)cc2Cl)C1 ZINC000584637767 1023137951 /nfs/dbraw/zinc/13/79/51/1023137951.db2.gz BUZFEGLIFGBYFW-FZMZJTMJSA-N -1 1 348.295 4.337 20 0 EIADMM [O-]c1ccc(-c2nc(-c3sccc3Br)no2)c(F)c1 ZINC000723210393 1023151403 /nfs/dbraw/zinc/15/14/03/1023151403.db2.gz JOLSWNBSYNAMOV-UHFFFAOYSA-N -1 1 341.161 4.072 20 0 EIADMM O=C(c1ccc(C(F)(F)F)cc1[O-])N1CC[C@H](c2ccccc2)C1 ZINC000180461600 1023227800 /nfs/dbraw/zinc/22/78/00/1023227800.db2.gz SXGLCUBUPRLFNP-ZDUSSCGKSA-N -1 1 335.325 4.041 20 0 EIADMM CCCc1cc(=O)[n-]c(SCc2coc(-c3ccc(F)cc3)n2)n1 ZINC000025479572 1023231893 /nfs/dbraw/zinc/23/18/93/1023231893.db2.gz FZHMLIJZVNRNNK-UHFFFAOYSA-N -1 1 345.399 4.221 20 0 EIADMM C[C@H](CCSc1ccccc1)N1Cc2ccc(C(=O)[O-])cc2C1 ZINC000659790785 1023272918 /nfs/dbraw/zinc/27/29/18/1023272918.db2.gz MSLHVLCWSKEGGN-CQSZACIVSA-N -1 1 327.449 4.271 20 0 EIADMM CC1(C)C[C@]1(C)C[N-]S(=O)(=O)c1sc2ccccc2c1Cl ZINC001213561095 1023364444 /nfs/dbraw/zinc/36/44/44/1023364444.db2.gz XGIWNOZCKZPQKO-OAHLLOKOSA-N -1 1 343.901 4.269 20 0 EIADMM CC(C)=CCSC[C@H](NCc1c(F)cc(C)cc1Cl)C(=O)[O-] ZINC000417631726 1023383267 /nfs/dbraw/zinc/38/32/67/1023383267.db2.gz WEWMDRITQUSOSY-HNNXBMFYSA-N -1 1 345.867 4.030 20 0 EIADMM CCCCOc1ccc(CNCc2cc(F)c(C(=O)[O-])c(F)c2)cc1 ZINC000417636953 1023386039 /nfs/dbraw/zinc/38/60/39/1023386039.db2.gz BKEJXMOMPABAPN-UHFFFAOYSA-N -1 1 349.377 4.132 20 0 EIADMM CCOc1cc(-c2noc(/C=C\c3cscn3)n2)cc(Cl)c1[O-] ZINC000581765196 1023696789 /nfs/dbraw/zinc/69/67/89/1023696789.db2.gz IVVLGOYYMHQNNF-ARJAWSKDSA-N -1 1 349.799 4.121 20 0 EIADMM [O-]c1ccc(-c2noc(C3(c4ccccc4)CC(F)(F)C3)n2)cc1F ZINC000377797201 1023763488 /nfs/dbraw/zinc/76/34/88/1023763488.db2.gz ZLVNGDANYUQJQL-UHFFFAOYSA-N -1 1 346.308 4.297 20 0 EIADMM O=C([O-])CCCN1CCc2sccc2[C@@H]1c1ccc(Cl)cc1 ZINC000661792330 1024503552 /nfs/dbraw/zinc/50/35/52/1024503552.db2.gz SIBICCCIJIGMRB-KRWDZBQOSA-N -1 1 335.856 4.214 20 0 EIADMM CSc1ccccc1[N-]S(=O)(=O)c1ccc(Cl)cc1C ZINC000048653179 1024669029 /nfs/dbraw/zinc/66/90/29/1024669029.db2.gz GVSKNGYRSJIUHF-UHFFFAOYSA-N -1 1 327.858 4.171 20 0 EIADMM C[C@@H]1CCC[C@@H](C)N1Cc1csc(-c2cccc(C(=O)[O-])c2)n1 ZINC000652367148 1024738654 /nfs/dbraw/zinc/73/86/54/1024738654.db2.gz RYRDDPPJQXVWDI-CHWSQXEVSA-N -1 1 330.453 4.271 20 0 EIADMM C[C@@H]1CCC[C@H](C)N1Cc1csc(-c2ccc(C(=O)[O-])cc2)n1 ZINC000652367185 1024749480 /nfs/dbraw/zinc/74/94/80/1024749480.db2.gz WYUPFHOMZQKZIG-BETUJISGSA-N -1 1 330.453 4.271 20 0 EIADMM O=C([O-])CN(Cc1cc(-c2ccc(Cl)cc2)no1)C1CCCCC1 ZINC000652482663 1024849502 /nfs/dbraw/zinc/84/95/02/1024849502.db2.gz OHJULUZJFSQPHY-UHFFFAOYSA-N -1 1 348.830 4.214 20 0 EIADMM CCn1c(C(=O)Nc2ccc(-c3cc(=O)[nH][n-]3)cc2)cc2ccccc21 ZINC000341997101 1025035813 /nfs/dbraw/zinc/03/58/13/1025035813.db2.gz AVEBJPHICWXKGJ-UHFFFAOYSA-N -1 1 346.390 4.009 20 0 EIADMM CCOc1cccc(NC(=O)c2cc(Cl)c([O-])c(OCC)c2)c1 ZINC000186663249 1025069155 /nfs/dbraw/zinc/06/91/55/1025069155.db2.gz FZPOSWZRAWWKPC-UHFFFAOYSA-N -1 1 335.787 4.095 20 0 EIADMM CCc1nc(SCCO[C@H](CC)c2ccccc2)[n-]c(=O)c1C ZINC000657264056 1025460052 /nfs/dbraw/zinc/46/00/52/1025460052.db2.gz BJWONSOBAVLKQS-MRXNPFEDSA-N -1 1 332.469 4.313 20 0 EIADMM O=S(=O)([N-]c1ncccc1Cl)c1cccc(-c2ccccc2)c1 ZINC000506834520 1025843973 /nfs/dbraw/zinc/84/39/73/1025843973.db2.gz NJABQEPQONTECO-UHFFFAOYSA-N -1 1 344.823 4.203 20 0 EIADMM O=C(c1c(F)ccc([O-])c1F)N1CCC(CCc2ccccc2)CC1 ZINC000537971446 1025876902 /nfs/dbraw/zinc/87/69/02/1025876902.db2.gz PAGFXFSSZDBYRU-UHFFFAOYSA-N -1 1 345.389 4.155 20 0 EIADMM COc1ccccc1-c1cccc([N-]S(=O)(=O)c2ccccc2)c1 ZINC000110590709 1026022004 /nfs/dbraw/zinc/02/20/04/1026022004.db2.gz PTCODIVRWNMDIK-UHFFFAOYSA-N -1 1 339.416 4.163 20 0 EIADMM Cc1cccc(NC2CCN(C(=O)c3cc(Cl)ccc3[O-])CC2)c1 ZINC000157768597 1026037865 /nfs/dbraw/zinc/03/78/65/1026037865.db2.gz QAEJKIHHRRIQGC-UHFFFAOYSA-N -1 1 344.842 4.071 20 0 EIADMM Cc1nc(-c2ccccn2)sc1C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000111666009 1026313694 /nfs/dbraw/zinc/31/36/94/1026313694.db2.gz ZXDDDDSIZCZLAF-UHFFFAOYSA-N -1 1 345.811 4.125 20 0 EIADMM COc1ccc(C(=O)Nc2cc(-c3ccncc3)ccc2C)c([O-])c1 ZINC000101848627 1026348745 /nfs/dbraw/zinc/34/87/45/1026348745.db2.gz MIOLEFMPXVFHBX-UHFFFAOYSA-N -1 1 334.375 4.024 20 0 EIADMM CN(C)C(=O)c1cc(Nc2cc(Cl)c([O-])cc2Cl)ccc1F ZINC001211855648 1026405518 /nfs/dbraw/zinc/40/55/18/1026405518.db2.gz BBTWJQAOILAHGM-UHFFFAOYSA-N -1 1 343.185 4.284 20 0 EIADMM Cc1nc2ccc([N-]S(=O)(=O)c3ccc(CC(C)C)cc3)cc2o1 ZINC000582352274 1026480818 /nfs/dbraw/zinc/48/08/18/1026480818.db2.gz UFJOAOCPGFVVLN-UHFFFAOYSA-N -1 1 344.436 4.136 20 0 EIADMM O=C(c1cc(Cl)ccc1[O-])N(CCC(F)(F)F)CC(F)(F)F ZINC000279580401 1026515546 /nfs/dbraw/zinc/51/55/46/1026515546.db2.gz MZCISDRGCRLRKG-UHFFFAOYSA-N -1 1 349.658 4.003 20 0 EIADMM O=C([O-])[C@H](NCc1c(Cl)oc2ccccc21)c1cccc(F)c1 ZINC000426762266 1026530970 /nfs/dbraw/zinc/53/09/70/1026530970.db2.gz ISPQAFMTDLTVME-OAHLLOKOSA-N -1 1 333.746 4.141 20 0 EIADMM O=C([O-])C[C@@H](NCc1ccccc1F)c1cc(Cl)cc(Cl)c1 ZINC000426753612 1026540061 /nfs/dbraw/zinc/54/00/61/1026540061.db2.gz JNOAOPWESFVHOO-OAHLLOKOSA-N -1 1 342.197 4.438 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2cccc(Cl)c2)ccc1OC(C)C ZINC000511118227 1026598794 /nfs/dbraw/zinc/59/87/94/1026598794.db2.gz BBKYAQATBTXJRJ-UHFFFAOYSA-N -1 1 339.844 4.236 20 0 EIADMM CC(=O)Nc1ccc(NC(=O)c2ccc(C(C)C)cc2[O-])cc1Cl ZINC000051285445 1026624336 /nfs/dbraw/zinc/62/43/36/1026624336.db2.gz KNZLJHVZWDRMHT-UHFFFAOYSA-N -1 1 346.814 4.380 20 0 EIADMM O=C(NCc1cc2ccccc2o1)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684871305 1026634924 /nfs/dbraw/zinc/63/49/24/1026634924.db2.gz DROLKBVYIHUTFL-UHFFFAOYSA-N -1 1 335.281 4.087 20 0 EIADMM CCn1ncc2ccc(NC(=O)c3ccc(C(F)(F)F)c([O-])c3)cc21 ZINC000684871490 1026636705 /nfs/dbraw/zinc/63/67/05/1026636705.db2.gz BZVLIFLDJPJFCR-UHFFFAOYSA-N -1 1 349.312 4.033 20 0 EIADMM C[C@H]1CN(C(=O)c2ccc(C(F)(F)F)c([O-])c2)[C@@H]1c1ccccc1 ZINC000684876077 1026652709 /nfs/dbraw/zinc/65/27/09/1026652709.db2.gz PKOKXQWDUNQZTF-ZBEGNZNMSA-N -1 1 335.325 4.244 20 0 EIADMM CCOC(=O)c1cnc(C(C)=Cc2ccc(CC(C)C)cc2)[n-]c1=O ZINC000432693982 1026780758 /nfs/dbraw/zinc/78/07/58/1026780758.db2.gz FERAOGJOAZVRKT-KAMYIIQDSA-N -1 1 340.423 4.118 20 0 EIADMM CCc1cccc(S(=O)(=O)[N-]c2cccc(-c3ncco3)c2C)c1 ZINC000427292690 1026805701 /nfs/dbraw/zinc/80/57/01/1026805701.db2.gz SREVFFKIHQELEM-UHFFFAOYSA-N -1 1 342.420 4.013 20 0 EIADMM Cc1c(-c2ccccc2)sc2[nH]c(-c3ccc([O-])cn3)nc(=O)c12 ZINC000427445269 1026851406 /nfs/dbraw/zinc/85/14/06/1026851406.db2.gz ZPIDNDSYVMYTLS-UHFFFAOYSA-N -1 1 335.388 4.140 20 0 EIADMM Cc1cnc(SCc2ccc([C@H](C)C(F)(F)F)cc2)[n-]c1=O ZINC000519703002 1026951717 /nfs/dbraw/zinc/95/17/17/1026951717.db2.gz DWMFIRSMNWNHIK-JTQLQIEISA-N -1 1 328.359 4.449 20 0 EIADMM CSc1ccc(C)c([N-]S(=O)(=O)c2ccc3ncccc3c2)c1 ZINC000342783320 1026995279 /nfs/dbraw/zinc/99/52/79/1026995279.db2.gz RKIWTZFFUJYBRV-UHFFFAOYSA-N -1 1 344.461 4.066 20 0 EIADMM COC1(c2noc(-c3cc(Oc4ccccc4)ccc3[O-])n2)CCC1 ZINC000545104676 1027819879 /nfs/dbraw/zinc/81/98/79/1027819879.db2.gz REQKWMPSBQHXPX-UHFFFAOYSA-N -1 1 338.363 4.260 20 0 EIADMM O=c1[nH]c(-c2cc([O-])cc(Cl)c2)nc2cc(Cl)c(Cl)cc12 ZINC000487504022 1027948726 /nfs/dbraw/zinc/94/87/26/1027948726.db2.gz RRERUOPBPOZVOS-UHFFFAOYSA-N -1 1 341.581 4.256 20 0 EIADMM COc1ccc(C(=O)N2C[C@@H](C(C)(C)C)c3ccccc32)c([O-])c1 ZINC000443858336 1028010768 /nfs/dbraw/zinc/01/07/68/1028010768.db2.gz JZBKAJLRUXYZFP-MRXNPFEDSA-N -1 1 325.408 4.191 20 0 EIADMM CCOc1cc(C(=O)N2CCCCc3ccccc32)cc(Cl)c1[O-] ZINC000546563264 1028165144 /nfs/dbraw/zinc/16/51/44/1028165144.db2.gz HMTOYEUFZLNGAO-UHFFFAOYSA-N -1 1 345.826 4.427 20 0 EIADMM CCC(CC)C[N-]S(=O)(=O)c1c(Cl)cccc1C(F)(F)F ZINC000523569221 1028221427 /nfs/dbraw/zinc/22/14/27/1028221427.db2.gz QFWWPOAOLFWFOL-UHFFFAOYSA-N -1 1 343.798 4.073 20 0 EIADMM C[C@H](CC(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)c1cccc(F)c1 ZINC000523851415 1028420802 /nfs/dbraw/zinc/42/08/02/1028420802.db2.gz PDAZTODAGGXEEM-GFCCVEGCSA-N -1 1 339.370 4.054 20 0 EIADMM O=C(Nc1cccc(Cl)c1SCC(F)F)c1cncc([O-])c1 ZINC000346400425 1028422113 /nfs/dbraw/zinc/42/21/13/1028422113.db2.gz ZNEPFLQQUNIURX-UHFFFAOYSA-N -1 1 344.770 4.050 20 0 EIADMM CO[C@@H]1CCOc2c(NC(=O)Nc3ccc([O-])c(Cl)c3)cccc21 ZINC000448049925 1028454229 /nfs/dbraw/zinc/45/42/29/1028454229.db2.gz RIGNENHYNJNTPL-OAHLLOKOSA-N -1 1 348.786 4.160 20 0 EIADMM CCOc1cc(C(=O)NC(C)(C)c2ccccc2)cc(Cl)c1[O-] ZINC000546583414 1028511010 /nfs/dbraw/zinc/51/10/10/1028511010.db2.gz BWDDZJPFEBHQHT-UHFFFAOYSA-N -1 1 333.815 4.109 20 0 EIADMM C[C@H](N(C)Cc1csc(-c2ccc(C(=O)[O-])cc2)n1)C(C)(C)C ZINC000583327434 1028512286 /nfs/dbraw/zinc/51/22/86/1028512286.db2.gz NWAHFFVKHOSXOP-LBPRGKRZSA-N -1 1 332.469 4.375 20 0 EIADMM COc1ccc2nc(-c3cccc(-c4csc(C)n4)c3)[n-]c(=O)c2c1 ZINC000074797519 1028518561 /nfs/dbraw/zinc/51/85/61/1028518561.db2.gz SRTJTEXPTUNJPD-UHFFFAOYSA-N -1 1 349.415 4.031 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cccc(OC(F)F)c3)n2)c(Cl)c1 ZINC000445449775 1028536873 /nfs/dbraw/zinc/53/68/73/1028536873.db2.gz PJTVWCXUUKKKET-UHFFFAOYSA-N -1 1 338.697 4.364 20 0 EIADMM COc1ccc(C[C@@H](C)c2nc(-c3ccc([O-])cc3Cl)no2)cc1 ZINC000445451015 1028544249 /nfs/dbraw/zinc/54/42/49/1028544249.db2.gz ZNTYEFMYOBKHCB-LLVKDONJSA-N -1 1 344.798 4.450 20 0 EIADMM [O-]c1ccc(-c2noc(CSc3ccc(O)cc3)n2)c(Cl)c1 ZINC000445445618 1028574736 /nfs/dbraw/zinc/57/47/36/1028574736.db2.gz JQVNRVNLJIVESF-UHFFFAOYSA-N -1 1 334.784 4.094 20 0 EIADMM COc1ccccc1C1(c2nc(-c3ccc([O-])cc3Cl)no2)CC1 ZINC000445446535 1028579602 /nfs/dbraw/zinc/57/96/02/1028579602.db2.gz PIMAWTZBDOLYKH-UHFFFAOYSA-N -1 1 342.782 4.184 20 0 EIADMM Cc1ccc2nc(C)c(-c3nc(-c4ccc([O-])cc4F)no3)cc2c1 ZINC000445465585 1028584780 /nfs/dbraw/zinc/58/47/80/1028584780.db2.gz ZPMWAWKWLDXAQX-UHFFFAOYSA-N -1 1 335.338 4.413 20 0 EIADMM COc1ccc(/C(C)=C/c2nc(-c3ccc([O-])c(F)c3)no2)cc1 ZINC000445469717 1028592911 /nfs/dbraw/zinc/59/29/11/1028592911.db2.gz CCGRABVGRKDREI-PKNBQFBNSA-N -1 1 326.327 4.150 20 0 EIADMM COc1ccccc1C/C(C)=C/c1nc(-c2ccc([O-])cc2F)no1 ZINC000445453231 1028603994 /nfs/dbraw/zinc/60/39/94/1028603994.db2.gz AYGZWYTUVBFOEQ-ZRDIBKRKSA-N -1 1 340.354 4.236 20 0 EIADMM [O-]c1ccc(-c2noc([C@H]3CCC[C@@H](C(F)(F)F)C3)n2)c(F)c1 ZINC000445457939 1028613917 /nfs/dbraw/zinc/61/39/17/1028613917.db2.gz VEVWQYZFZLKXJQ-DTWKUNHWSA-N -1 1 330.281 4.417 20 0 EIADMM [O-]c1ccc(-c2noc(CC3CCC(C(F)(F)F)CC3)n2)c(F)c1 ZINC000445459693 1028615742 /nfs/dbraw/zinc/61/57/42/1028615742.db2.gz FYAPXBUHOVRZQT-UHFFFAOYSA-N -1 1 344.308 4.493 20 0 EIADMM CC(C)(C)n1nc(-c2nc(-c3ccc([O-])cc3F)no2)cc1C1CC1 ZINC000445463465 1028620505 /nfs/dbraw/zinc/62/05/05/1028620505.db2.gz OXDJMCRXTXWJIC-UHFFFAOYSA-N -1 1 342.374 4.077 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cc(F)c(F)cc3Cl)n2)cc1F ZINC000445485957 1028637259 /nfs/dbraw/zinc/63/72/59/1028637259.db2.gz GOVMRJSTUACFTG-UHFFFAOYSA-N -1 1 326.661 4.180 20 0 EIADMM [O-]c1ccc(-c2noc(Cc3ccc(C(F)(F)F)cc3)n2)cc1F ZINC000445474285 1028645754 /nfs/dbraw/zinc/64/57/54/1028645754.db2.gz PYUJNNYANCDMMT-UHFFFAOYSA-N -1 1 338.260 4.191 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1CCc2c1cc(F)cc2F ZINC000192603025 1028681652 /nfs/dbraw/zinc/68/16/52/1028681652.db2.gz ZENLEWKDICHELZ-UHFFFAOYSA-N -1 1 325.314 4.027 20 0 EIADMM CC1(C)CC[C@@H](NC(=O)c2c(F)ccc([O-])c2F)c2ccccc21 ZINC000343269472 1028840462 /nfs/dbraw/zinc/84/04/62/1028840462.db2.gz JEIKOYMLUMNADX-CQSZACIVSA-N -1 1 331.362 4.213 20 0 EIADMM O=c1nc(-c2ccc(-n3cc(Cl)cn3)c(F)c2)[n-]c2ccsc21 ZINC000447127355 1029706219 /nfs/dbraw/zinc/70/62/19/1029706219.db2.gz CMMPCLDUFDSKGZ-UHFFFAOYSA-N -1 1 346.774 4.042 20 0 EIADMM Cc1cc([C@@H](C)Nc2ccc(-c3nc(C)c(C)c(=O)[n-]3)cn2)c(C)o1 ZINC000301384829 1029721843 /nfs/dbraw/zinc/72/18/43/1029721843.db2.gz WMNKVKWAWVVCQW-CYBMUJFWSA-N -1 1 338.411 4.244 20 0 EIADMM Cc1ccc(CNc2ccc(-c3nc(C)c(C)c(=O)[n-]3)cn2)c(C)c1 ZINC000301388559 1029723664 /nfs/dbraw/zinc/72/36/64/1029723664.db2.gz YMSCWPUGRQVAJT-UHFFFAOYSA-N -1 1 334.423 4.090 20 0 EIADMM Cc1nc(-c2ccc(NCC[C@@H](C)c3ccccc3)nc2)[n-]c(=O)c1C ZINC000301420377 1029730498 /nfs/dbraw/zinc/73/04/98/1029730498.db2.gz SBTBYJPAHAXSHZ-CQSZACIVSA-N -1 1 348.450 4.467 20 0 EIADMM Cc1nc(-c2ccc(N[C@@H]3CCC[C@@H](C)[C@H]3C)nc2)[n-]c(=O)c1C ZINC000301570810 1029763274 /nfs/dbraw/zinc/76/32/74/1029763274.db2.gz WUYNWRBRKWTDSS-XHBSWPGZSA-N -1 1 326.444 4.098 20 0 EIADMM CCc1oc(C(=O)[O-])cc1CN1CC=C(c2ccc(Cl)cc2)CC1 ZINC000584416100 1029838119 /nfs/dbraw/zinc/83/81/19/1029838119.db2.gz MIVGFAVSSZTEEQ-UHFFFAOYSA-N -1 1 345.826 4.483 20 0 EIADMM COc1cc(C)cc([N-]S(=O)(=O)c2cc(Cl)ccc2C)c1C ZINC000447262771 1029949561 /nfs/dbraw/zinc/94/95/61/1029949561.db2.gz GIFWOYLKANZCRL-UHFFFAOYSA-N -1 1 339.844 4.075 20 0 EIADMM CN(Cc1cccc(Cl)c1)C(=O)c1ccc2ccccc2c1[O-] ZINC000321230903 1030216468 /nfs/dbraw/zinc/21/64/68/1030216468.db2.gz BNUNIWOXBBTFAS-UHFFFAOYSA-N -1 1 325.795 4.471 20 0 EIADMM Cc1ccc(C)c(S(=O)(=O)[N-]c2ccccc2C(C)(F)F)c1 ZINC000451090921 1030232081 /nfs/dbraw/zinc/23/20/81/1030232081.db2.gz VILFXDBZFNJLMJ-UHFFFAOYSA-N -1 1 325.380 4.216 20 0 EIADMM Cc1nc(-c2ccc([N-]S(=O)(=O)c3ccccc3C)cc2)cs1 ZINC000321257765 1030235729 /nfs/dbraw/zinc/23/57/29/1030235729.db2.gz PRBMELZBWGOHIT-UHFFFAOYSA-N -1 1 344.461 4.228 20 0 EIADMM CN(Cc1ccc(Cl)cc1Cl)C(=O)c1c(F)ccc([O-])c1F ZINC000685408839 1030291731 /nfs/dbraw/zinc/29/17/31/1030291731.db2.gz ZWOFSSGLYAPSTR-UHFFFAOYSA-N -1 1 346.160 4.249 20 0 EIADMM CCOc1cc(C(=O)N[C@@H](C)c2cc(C)oc2C)cc(Cl)c1[O-] ZINC000186714060 1030305843 /nfs/dbraw/zinc/30/58/43/1030305843.db2.gz YRRGTRXKJHTUJF-JTQLQIEISA-N -1 1 337.803 4.145 20 0 EIADMM Cc1ccccc1S(=O)(=O)[N-]c1ccc2oc(C(C)C)nc2c1 ZINC000321485576 1030379910 /nfs/dbraw/zinc/37/99/10/1030379910.db2.gz FORNAQOXXANRJX-UHFFFAOYSA-N -1 1 330.409 4.060 20 0 EIADMM CN(Cc1ccc(Cl)cc1)C(=O)c1ccc2ccccc2c1[O-] ZINC000321621256 1030482851 /nfs/dbraw/zinc/48/28/51/1030482851.db2.gz UKTTUZWKCATBSL-UHFFFAOYSA-N -1 1 325.795 4.471 20 0 EIADMM O=C(Nc1cccc(-c2cc[nH]n2)c1)Nc1ccc([O-])c(Cl)c1 ZINC000192268226 1030682692 /nfs/dbraw/zinc/68/26/92/1030682692.db2.gz KKBMTZCDUGZRHZ-UHFFFAOYSA-N -1 1 328.759 4.080 20 0 EIADMM O=S(=O)([N-][C@@H]1CCc2c1cccc2Cl)c1cc2ccccc2o1 ZINC000530770618 1030700833 /nfs/dbraw/zinc/70/08/33/1030700833.db2.gz MZHVVSMAQDZWLI-OAHLLOKOSA-N -1 1 347.823 4.052 20 0 EIADMM COc1ccc(CC[C@H](C)NC(=O)c2ccc3ccccc3c2[O-])cc1 ZINC001625961526 1030766843 /nfs/dbraw/zinc/76/68/43/1030766843.db2.gz RFDUYCCDUJKSAP-HNNXBMFYSA-N -1 1 349.430 4.305 20 0 EIADMM CC(C)c1nnc([N-]C(=O)c2csc(-c3cccs3)n2)s1 ZINC000025323982 1030867255 /nfs/dbraw/zinc/86/72/55/1030867255.db2.gz DRSRPCAGFVHFBJ-UHFFFAOYSA-N -1 1 336.467 4.099 20 0 EIADMM O=C(Nc1ccc(F)cc1[O-])[C@H]1C[C@H]1c1ccccc1C(F)(F)F ZINC000532621092 1031430466 /nfs/dbraw/zinc/43/04/66/1031430466.db2.gz VWBLZKJYTWQEEV-RYUDHWBXSA-N -1 1 339.288 4.292 20 0 EIADMM O=C(CCc1ccc(OC(F)(F)F)cc1)Nc1ccc(F)cc1[O-] ZINC000532621956 1031436521 /nfs/dbraw/zinc/43/65/21/1031436521.db2.gz MWUXKMDDZWBTLW-UHFFFAOYSA-N -1 1 343.276 4.001 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2cccc(C(F)(F)F)c2)c(C)c1 ZINC000005598784 1031592639 /nfs/dbraw/zinc/59/26/39/1031592639.db2.gz AYXRPKJWQGWQAO-UHFFFAOYSA-N -1 1 329.343 4.123 20 0 EIADMM CC(C)(C)CCC1(O)CC(c2nc(-c3ccc([O-])cc3F)no2)C1 ZINC000453174719 1031647777 /nfs/dbraw/zinc/64/77/77/1031647777.db2.gz JXLKVFBBBRZFDM-UHFFFAOYSA-N -1 1 334.391 4.016 20 0 EIADMM CC(C)(C)CCC1(O)CC(c2nc(-c3ccc([O-])c(F)c3)no2)C1 ZINC000453174678 1031650247 /nfs/dbraw/zinc/65/02/47/1031650247.db2.gz JQHWQNIOQKMXKH-UHFFFAOYSA-N -1 1 334.391 4.016 20 0 EIADMM COC(=O)c1ccc(OC)c(Nc2ccc(Cl)c(Cl)c2[O-])c1 ZINC001213248308 1031723696 /nfs/dbraw/zinc/72/36/96/1031723696.db2.gz UFCCCGTYWBREJV-UHFFFAOYSA-N -1 1 342.178 4.238 20 0 EIADMM [O-]c1cccc(CN[C@H]2CCc3cc(F)c(F)c(F)c32)c1Cl ZINC000449589226 1031863723 /nfs/dbraw/zinc/86/37/23/1031863723.db2.gz SANAHOSCUBIZQY-NSHDSACASA-N -1 1 327.733 4.240 20 0 EIADMM O=C(Nc1ccc(F)cc1[O-])c1ccc(Sc2ccccn2)cc1 ZINC000532012877 1031976096 /nfs/dbraw/zinc/97/60/96/1031976096.db2.gz QDBQZMSNKLSVSO-UHFFFAOYSA-N -1 1 340.379 4.330 20 0 EIADMM [O-]c1cccc(CN2CCO[C@H](c3cccc(Cl)c3)C2)c1Cl ZINC000512595098 1033460835 /nfs/dbraw/zinc/46/08/35/1033460835.db2.gz JLVTZKSTLPMXAX-INIZCTEOSA-N -1 1 338.234 4.273 20 0 EIADMM Cc1ccc(Cl)cc1[N-]S(=O)(=O)c1ccc(C(F)F)cc1 ZINC000571066816 1033843993 /nfs/dbraw/zinc/84/39/93/1033843993.db2.gz JJZOHQWRTJBLQD-UHFFFAOYSA-N -1 1 331.771 4.387 20 0 EIADMM CCOc1cc2c(cc1NCc1cccc([O-])c1Cl)O[C@@H](C)C2 ZINC000645166632 1033951378 /nfs/dbraw/zinc/95/13/78/1033951378.db2.gz NBQCJGNLDBUNPD-NSHDSACASA-N -1 1 333.815 4.380 20 0 EIADMM COC[C@H](NCc1cccc([O-])c1Cl)c1cccc(Cl)c1 ZINC000645181834 1033991333 /nfs/dbraw/zinc/99/13/33/1033991333.db2.gz UOQPVXRTHTVHIK-AWEZNQCLSA-N -1 1 326.223 4.176 20 0 EIADMM Cc1cc(OC(C)C)ccc1Nc1cc2ccc([O-])cc2oc1=O ZINC001211812458 1034074535 /nfs/dbraw/zinc/07/45/35/1034074535.db2.gz BLHWNTJUILBNIK-UHFFFAOYSA-N -1 1 325.364 4.338 20 0 EIADMM CCC(=O)c1cccc([N-]S(=O)(=O)c2ccc3ccccc3c2)c1 ZINC000433615121 1034840123 /nfs/dbraw/zinc/84/01/23/1034840123.db2.gz HTWGMOJRMQFOLO-UHFFFAOYSA-N -1 1 339.416 4.233 20 0 EIADMM [O-]c1cccc(CN(CCC(F)(F)F)CC(F)(F)F)c1Cl ZINC000513330701 1034883956 /nfs/dbraw/zinc/88/39/56/1034883956.db2.gz ZIFAZRFLYURZIK-UHFFFAOYSA-N -1 1 335.675 4.362 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2cccc(Cl)c2)cc1OC(F)F ZINC000513373458 1034903050 /nfs/dbraw/zinc/90/30/50/1034903050.db2.gz RHSIHAULMYUPEZ-UHFFFAOYSA-N -1 1 347.770 4.051 20 0 EIADMM CCOc1cc(C(=O)Nc2cc(OC)c(C)cc2C)cc(Cl)c1[O-] ZINC000280240096 1035212436 /nfs/dbraw/zinc/21/24/36/1035212436.db2.gz ZRWATIIYLSYIPS-UHFFFAOYSA-N -1 1 349.814 4.322 20 0 EIADMM CCc1onc(-c2ccccc2)c1C(=O)[N-]c1nnc(C(C)C)s1 ZINC000280614692 1035309084 /nfs/dbraw/zinc/30/90/84/1035309084.db2.gz PBDAKXMQYMAIOJ-UHFFFAOYSA-N -1 1 342.424 4.131 20 0 EIADMM CCc1sc(C(=O)Nc2ccc(F)cc2[O-])cc1Br ZINC000490653087 1035594075 /nfs/dbraw/zinc/59/40/75/1035594075.db2.gz PDOVSEXKAWOVTB-UHFFFAOYSA-N -1 1 344.205 4.170 20 0 EIADMM CCOc1cc(-c2noc([C@H](CC(C)C)OC)n2)cc(Cl)c1[O-] ZINC000420491381 1035641693 /nfs/dbraw/zinc/64/16/93/1035641693.db2.gz GXLBXQWTSACFIM-ZDUSSCGKSA-N -1 1 340.807 4.228 20 0 EIADMM CN(C(=O)c1ccc(O)cc1[O-])c1ccc(Oc2ccccc2)cc1 ZINC000195388594 1035834214 /nfs/dbraw/zinc/83/42/14/1035834214.db2.gz HCLKXUHWBLWUGW-UHFFFAOYSA-N -1 1 335.359 4.167 20 0 EIADMM O=S(=O)([N-]c1cccc(F)c1F)c1ccc(Cl)cc1Cl ZINC000485390964 1035856226 /nfs/dbraw/zinc/85/62/26/1035856226.db2.gz SMAZVNRZGVABDG-UHFFFAOYSA-N -1 1 338.162 4.072 20 0 EIADMM Cc1c(=O)[n-]c(SCc2ccnc(Cl)c2)nc1-c1ccccc1 ZINC000163928941 1035881368 /nfs/dbraw/zinc/88/13/68/1035881368.db2.gz LUBLWRHMWXXBTG-UHFFFAOYSA-N -1 1 343.839 4.086 20 0 EIADMM O=S(=O)([N-]Cc1cccc2ccccc21)c1cc2ccccc2o1 ZINC000571368233 1036045413 /nfs/dbraw/zinc/04/54/13/1036045413.db2.gz JETSMCBRRJQTCQ-UHFFFAOYSA-N -1 1 337.400 4.065 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc(C(=O)C3CCC3)cc2)cc1C ZINC000486086879 1036475569 /nfs/dbraw/zinc/47/55/69/1036475569.db2.gz DTHJMSRRVYDRAZ-UHFFFAOYSA-N -1 1 343.448 4.087 20 0 EIADMM CO[C@@H](C)c1cccc([N-]S(=O)(=O)c2ccc(C(C)(C)C)cc2)c1 ZINC000588833823 1036542666 /nfs/dbraw/zinc/54/26/66/1036542666.db2.gz SHFOBTWEWKQYCT-AWEZNQCLSA-N -1 1 347.480 4.492 20 0 EIADMM CCCc1ccc(S(=O)(=O)[N-]c2cccc([C@H](C)OC)c2)cc1 ZINC000588833411 1036563537 /nfs/dbraw/zinc/56/35/37/1036563537.db2.gz MPLTYPAQYVCAKY-AWEZNQCLSA-N -1 1 333.453 4.147 20 0 EIADMM O=S(=O)([N-]c1cc(Cl)ccc1Cl)c1cccc(F)c1F ZINC000502751780 1036618984 /nfs/dbraw/zinc/61/89/84/1036618984.db2.gz WLGJQBUBZZKQFV-UHFFFAOYSA-N -1 1 338.162 4.072 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1CCC[C@H](CC(F)(F)F)C1 ZINC000421945126 1036863749 /nfs/dbraw/zinc/86/37/49/1036863749.db2.gz QTGHIKNLPSMGIN-GFCCVEGCSA-N -1 1 337.341 4.350 20 0 EIADMM CC(=O)CCCCCCC(=O)Nc1cccc([O-])c1Br ZINC000908710126 1036920794 /nfs/dbraw/zinc/92/07/94/1036920794.db2.gz XSUFAANMSWXQTI-UHFFFAOYSA-N -1 1 342.233 4.023 20 0 EIADMM O=C(Nc1cccc([O-])c1Br)[C@@H]1CCCC[C@H]1C1CC1 ZINC000908706383 1036921137 /nfs/dbraw/zinc/92/11/37/1036921137.db2.gz AJWKQGXHYHBTGO-NWDGAFQWSA-N -1 1 338.245 4.310 20 0 EIADMM CN(Cc1ccc(F)cc1)Cn1c(CCC2CCCC2)n[n-]c1=S ZINC000058204897 1037584877 /nfs/dbraw/zinc/58/48/77/1037584877.db2.gz AHSGLFFAZSVESY-UHFFFAOYSA-N -1 1 348.491 4.292 20 0 EIADMM COc1cc([N-]S(=O)(=O)c2cccc(Cl)c2C)c(C)cc1C ZINC000478709754 1037596027 /nfs/dbraw/zinc/59/60/27/1037596027.db2.gz LZOPVHXHSZHNNJ-UHFFFAOYSA-N -1 1 339.844 4.075 20 0 EIADMM O=C(C[C@@H](c1ccccc1)C(F)(F)F)Nc1c([O-])cccc1F ZINC000605437014 1037787423 /nfs/dbraw/zinc/78/74/23/1037787423.db2.gz NYFGFXXIMZZNNI-NSHDSACASA-N -1 1 327.277 4.206 20 0 EIADMM Cc1cc([N-]S(=O)(=O)c2cccc(Cl)c2)ccc1OC(C)C ZINC000607616821 1038239754 /nfs/dbraw/zinc/23/97/54/1038239754.db2.gz SIHDAJUBKITUFQ-UHFFFAOYSA-N -1 1 339.844 4.236 20 0 EIADMM CC[C@@]1(C)CCCN(Cn2c(Cc3cccs3)n[n-]c2=S)C1 ZINC000173421744 1038323082 /nfs/dbraw/zinc/32/30/82/1038323082.db2.gz FYEHDFITHORKBA-INIZCTEOSA-N -1 1 336.530 4.063 20 0 EIADMM CCc1nc(SC[C@@H](OC)c2ccc(Cl)cc2)[n-]c(=O)c1C ZINC000574703967 1038327675 /nfs/dbraw/zinc/32/76/75/1038327675.db2.gz JQDBRXWNZJHFHT-CQSZACIVSA-N -1 1 338.860 4.186 20 0 EIADMM Cc1csc2nc(-c3ccc(Br)cc3F)[n-]c(=O)c12 ZINC000504508838 1038391192 /nfs/dbraw/zinc/39/11/92/1038391192.db2.gz YVUQKIMIRLRSGI-UHFFFAOYSA-N -1 1 339.189 4.274 20 0 EIADMM C[C@@H](C(=O)Nc1c([O-])cccc1F)c1ccccc1C(F)(F)F ZINC000608366748 1038804001 /nfs/dbraw/zinc/80/40/01/1038804001.db2.gz XLQITPPEQFMZSS-SECBINFHSA-N -1 1 327.277 4.292 20 0 EIADMM O=C(Nc1c([O-])cccc1F)c1c[nH]c2ccc(Br)cc21 ZINC000608366865 1038804384 /nfs/dbraw/zinc/80/43/84/1038804384.db2.gz PCPHZJMEXHZNDB-UHFFFAOYSA-N -1 1 349.159 4.027 20 0 EIADMM Cc1cc(C(=O)Nc2c([O-])cccc2F)ccc1NC(=O)CC(C)C ZINC000608366752 1038804468 /nfs/dbraw/zinc/80/44/68/1038804468.db2.gz XPDFNUMHKNWBMV-UHFFFAOYSA-N -1 1 344.386 4.077 20 0 EIADMM O=C(CCCCc1nc2ccccc2s1)Nc1c([O-])cccc1F ZINC000608367037 1038804482 /nfs/dbraw/zinc/80/44/82/1038804482.db2.gz RXKSBDOYSHLFEB-UHFFFAOYSA-N -1 1 344.411 4.493 20 0 EIADMM Cc1cc(F)ccc1-c1ccc(CN2CCC[C@H](C)[C@@H]2C(=O)[O-])o1 ZINC000424413529 1038849198 /nfs/dbraw/zinc/84/91/98/1038849198.db2.gz FQTUDYDBSPEOMI-KPZWWZAWSA-N -1 1 331.387 4.079 20 0 EIADMM Cc1cc(F)ccc1-c1ccc(CN2CCC[C@@H](C)[C@H]2C(=O)[O-])o1 ZINC000424413536 1038851310 /nfs/dbraw/zinc/85/13/10/1038851310.db2.gz FQTUDYDBSPEOMI-XIKOKIGWSA-N -1 1 331.387 4.079 20 0 EIADMM C[C@H]1CCCN(Cc2cc(C(F)(F)F)ccc2Cl)[C@@H]1C(=O)[O-] ZINC000424417522 1038853138 /nfs/dbraw/zinc/85/31/38/1038853138.db2.gz MCDGVBAKKHBFKI-ZANVPECISA-N -1 1 335.753 4.044 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2ccccc2-c2ccccc2)cc1O ZINC000462102029 1038908943 /nfs/dbraw/zinc/90/89/43/1038908943.db2.gz NDFYNPAHNWOJHF-UHFFFAOYSA-N -1 1 339.416 4.168 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N1CCCCC[C@@H]1c1ccncc1 ZINC000120913870 1039236310 /nfs/dbraw/zinc/23/63/10/1039236310.db2.gz UFJFPHQAYXYHNF-MRXNPFEDSA-N -1 1 330.815 4.198 20 0 EIADMM C[C@@H](C(=O)Nc1cc(Cl)c([O-])c2ccccc12)C(=O)OC(C)(C)C ZINC000600136107 1039313130 /nfs/dbraw/zinc/31/31/30/1039313130.db2.gz PKSHGXUOJXODCL-JTQLQIEISA-N -1 1 349.814 4.115 20 0 EIADMM COc1cc(C(=O)N2CC3(CCC3)[C@@H]2c2ccco2)cc(Cl)c1[O-] ZINC000456582195 1039481384 /nfs/dbraw/zinc/48/13/84/1039481384.db2.gz ZEFXYUDJTLXRPH-INIZCTEOSA-N -1 1 347.798 4.015 20 0 EIADMM CC(C)c1cccc(O[C@H](C)C(=O)Nc2ccc([O-])c(F)c2F)c1 ZINC000456792177 1039607540 /nfs/dbraw/zinc/60/75/40/1039607540.db2.gz HAOJJDPGKAYZRV-LLVKDONJSA-N -1 1 335.350 4.200 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1cnc(Cc2ccccc2)s1 ZINC000122280107 1039638124 /nfs/dbraw/zinc/63/81/24/1039638124.db2.gz RNFSEOPJWAYARK-UHFFFAOYSA-N -1 1 344.823 4.345 20 0 EIADMM COc1cccc([C@H]2C[C@H](N(C)C(=O)c3ccc(Cl)cc3[O-])C2)c1 ZINC000456919333 1039747615 /nfs/dbraw/zinc/74/76/15/1039747615.db2.gz HDWPZKBRWCWDII-CTYIDZIISA-N -1 1 345.826 4.072 20 0 EIADMM C[C@@]1(c2ccccc2)CCCN(C(=O)c2c(F)ccc([O-])c2F)CC1 ZINC000552833125 1039827312 /nfs/dbraw/zinc/82/73/12/1039827312.db2.gz DEXREGXSBLZFAY-HXUWFJFHSA-N -1 1 345.389 4.254 20 0 EIADMM COc1cc(C(=O)N2CC3(CCCC3)[C@@H]2C(C)C)cc(Cl)c1[O-] ZINC000457157928 1039858588 /nfs/dbraw/zinc/85/85/88/1039858588.db2.gz FBZDRKMQBJIFEA-INIZCTEOSA-N -1 1 337.847 4.095 20 0 EIADMM C[C@@H](OCc1ccccc1)c1nc(-c2ccc([O-])cc2Cl)no1 ZINC000445449716 1039882926 /nfs/dbraw/zinc/88/29/26/1039882926.db2.gz PDMZXQIPCPNNKL-LLVKDONJSA-N -1 1 330.771 4.373 20 0 EIADMM CC(=O)c1ccc([N-]S(=O)(=O)c2ccc(C(C)C)cc2)cc1C ZINC000535345822 1040208475 /nfs/dbraw/zinc/20/84/75/1040208475.db2.gz RYEYNSIUKXKCPI-UHFFFAOYSA-N -1 1 331.437 4.122 20 0 EIADMM Cc1ccccc1S(=O)(=O)[N-]c1ccccc1N1CCCCCC1 ZINC000553668111 1040405151 /nfs/dbraw/zinc/40/51/51/1040405151.db2.gz NAQNVMXWPGPSLG-UHFFFAOYSA-N -1 1 344.480 4.176 20 0 EIADMM CCCCS[C@@H](C)C(=O)Nc1cc(C)cc(Br)c1[O-] ZINC000482679613 1040418696 /nfs/dbraw/zinc/41/86/96/1040418696.db2.gz YCUGASGMZHQTQJ-JTQLQIEISA-N -1 1 346.290 4.323 20 0 EIADMM CSc1ccc(S(=O)(=O)[N-]c2ccc3occ(C)c3c2)cc1 ZINC000479525068 1040425276 /nfs/dbraw/zinc/42/52/76/1040425276.db2.gz CUKLVUJUPBFSTA-UHFFFAOYSA-N -1 1 333.434 4.264 20 0 EIADMM O=C(c1c(F)ccc([O-])c1F)N1CCC[C@@H](c2ccccc2)CC1 ZINC000539447558 1040449537 /nfs/dbraw/zinc/44/95/37/1040449537.db2.gz YTWHSPQCIOCCET-CQSZACIVSA-N -1 1 331.362 4.080 20 0 EIADMM C[C@H](CC(C)(C)c1ccccc1)NC(=O)c1c(F)ccc([O-])c1F ZINC000539447365 1040449889 /nfs/dbraw/zinc/44/98/89/1040449889.db2.gz WBDLTXLLYOYJMJ-GFCCVEGCSA-N -1 1 333.378 4.157 20 0 EIADMM CO[C@H](C)c1cccc([N-]S(=O)(=O)c2cccc3ccccc32)c1 ZINC000084460854 1040559165 /nfs/dbraw/zinc/55/91/65/1040559165.db2.gz PSBMTTJUNNWFNA-CQSZACIVSA-N -1 1 341.432 4.348 20 0 EIADMM [O-]c1ccc(-c2noc(-c3ccc(Oc4cccnc4)cc3)n2)c(F)c1 ZINC000445457964 1040813199 /nfs/dbraw/zinc/81/31/99/1040813199.db2.gz PLQHGEYOZURYMR-UHFFFAOYSA-N -1 1 349.321 4.436 20 0 EIADMM COc1ccc2c(c1)CCCN(C(=O)c1ccc3ccccc3c1[O-])C2 ZINC000539889877 1040860111 /nfs/dbraw/zinc/86/01/11/1040860111.db2.gz PISVACLABPKUHJ-UHFFFAOYSA-N -1 1 347.414 4.143 20 0 EIADMM CCOC(=O)c1cnc(C(C)=Cc2ccc(C(C)C)cc2)[n-]c1=O ZINC000470298585 1040888532 /nfs/dbraw/zinc/88/85/32/1040888532.db2.gz SPBGUBFORUBUSO-RAXLEYEMSA-N -1 1 326.396 4.043 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2cccc(C(C)(F)F)c2)c(C)s1 ZINC000436169916 1040922351 /nfs/dbraw/zinc/92/23/51/1040922351.db2.gz IILHBVWNYFRTDG-UHFFFAOYSA-N -1 1 331.409 4.277 20 0 EIADMM CC[C@H](C)c1ccc(S(=O)(=O)[N-]c2ccc3nc(C)oc3c2)cc1 ZINC000554360750 1041039378 /nfs/dbraw/zinc/03/93/78/1041039378.db2.gz OVHMFEOSXKSBAM-LBPRGKRZSA-N -1 1 344.436 4.451 20 0 EIADMM O=S(=O)([N-]c1cccc(Cl)c1)c1ccc(CC(F)(F)F)cc1 ZINC000480226685 1041098205 /nfs/dbraw/zinc/09/82/05/1041098205.db2.gz OMPJVYAOSNBTBU-UHFFFAOYSA-N -1 1 349.761 4.246 20 0 EIADMM CC[C@H]1CCCC[C@H]1Nc1ccc(-c2nc(C)c(C)c(=O)[n-]2)cn1 ZINC000462929695 1041111381 /nfs/dbraw/zinc/11/13/81/1041111381.db2.gz ODWQVUOLZTUWJT-GOEBONIOSA-N -1 1 326.444 4.242 20 0 EIADMM O=S(=O)([N-]c1ccc(Cl)cc1)c1ccc(CC(F)(F)F)cc1 ZINC000480235371 1041114093 /nfs/dbraw/zinc/11/40/93/1041114093.db2.gz YDNBZXDPBJYEOM-UHFFFAOYSA-N -1 1 349.761 4.246 20 0 EIADMM O=C(Nc1ccc(F)cc1OCCC(F)(F)F)c1ccccc1[O-] ZINC000436511100 1041296685 /nfs/dbraw/zinc/29/66/85/1041296685.db2.gz KDHNYYZRIARERA-UHFFFAOYSA-N -1 1 343.276 4.115 20 0 EIADMM O=C([O-])C[C@H](NCc1ccc(C(F)(F)F)s1)c1ccccc1F ZINC000904046223 1041300262 /nfs/dbraw/zinc/30/02/62/1041300262.db2.gz XTEPJONFSIKNJF-LBPRGKRZSA-N -1 1 347.333 4.212 20 0 EIADMM O=C([O-])C[C@@H](NCc1ccc(C(F)(F)F)s1)c1ccccc1F ZINC000904046222 1041301474 /nfs/dbraw/zinc/30/14/74/1041301474.db2.gz XTEPJONFSIKNJF-GFCCVEGCSA-N -1 1 347.333 4.212 20 0 EIADMM CCOc1cc(-c2noc(-c3sccc3F)n2)cc(Cl)c1[O-] ZINC000436521668 1041303928 /nfs/dbraw/zinc/30/39/28/1041303928.db2.gz OAXDZAKYPVGNOW-UHFFFAOYSA-N -1 1 340.763 4.362 20 0 EIADMM Cc1ccccc1[N-]S(=O)(=O)c1ccc2c(c1)Cc1ccccc1-2 ZINC000001673285 1041314129 /nfs/dbraw/zinc/31/41/29/1041314129.db2.gz XBTFXRALAKZYIZ-UHFFFAOYSA-N -1 1 335.428 4.367 20 0 EIADMM C[C@H]1C[C@H](c2ccc(F)cc2)CN1C(=O)c1ccc(Cl)cc1[O-] ZINC000436536504 1041321003 /nfs/dbraw/zinc/32/10/03/1041321003.db2.gz MOARQGDRSDEJOV-AAEUAGOBSA-N -1 1 333.790 4.203 20 0 EIADMM CN(C(=O)c1cc2ccccc2cc1[O-])[C@H]1CCc2ccccc2C1 ZINC000436548188 1041323545 /nfs/dbraw/zinc/32/35/45/1041323545.db2.gz PSJNSZKXWUHCHQ-IBGZPJMESA-N -1 1 331.415 4.175 20 0 EIADMM C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1ccc2ccccc2c1[O-] ZINC000436548283 1041324900 /nfs/dbraw/zinc/32/49/00/1041324900.db2.gz QFFKADNVULYHJK-XHDPSFHLSA-N -1 1 337.341 4.348 20 0 EIADMM O=C(Nc1nc2c(s1)CSCC2)c1cc2ccccc2cc1[O-] ZINC000436553137 1041327307 /nfs/dbraw/zinc/32/73/07/1041327307.db2.gz BPUFNNQJVMOVAO-UHFFFAOYSA-N -1 1 342.445 4.044 20 0 EIADMM Cc1csc(C2(NC(=O)c3cc4ccccc4cc3[O-])CCC2)n1 ZINC000436551035 1041329338 /nfs/dbraw/zinc/32/93/38/1041329338.db2.gz WFARDAFGFJBQEO-UHFFFAOYSA-N -1 1 338.432 4.120 20 0 EIADMM O=C(NC1(c2nccs2)CCCC1)c1cc2ccccc2cc1[O-] ZINC000436543928 1041335472 /nfs/dbraw/zinc/33/54/72/1041335472.db2.gz HKUDOBAKADWQAL-UHFFFAOYSA-N -1 1 338.432 4.201 20 0 EIADMM O=C(NC1(c2nccs2)CCCC1)c1ccc2ccccc2c1[O-] ZINC000436545321 1041338894 /nfs/dbraw/zinc/33/88/94/1041338894.db2.gz LYAUGGPYDFUNAH-UHFFFAOYSA-N -1 1 338.432 4.201 20 0 EIADMM O=C(Nc1ccc(-c2cnco2)cc1)c1cc2ccccc2cc1[O-] ZINC000436566983 1041346297 /nfs/dbraw/zinc/34/62/97/1041346297.db2.gz WJBRIKYHOFRWLC-UHFFFAOYSA-N -1 1 330.343 4.453 20 0 EIADMM Cn1cccc1[C@@H]1CCCCN1C(=O)c1ccc2ccccc2c1[O-] ZINC000436578426 1041358937 /nfs/dbraw/zinc/35/89/37/1041358937.db2.gz WSZOPSSKCZQCMO-IBGZPJMESA-N -1 1 334.419 4.251 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1CC[C@H](c2ccc(F)cc2)C1 ZINC000436582618 1041361693 /nfs/dbraw/zinc/36/16/93/1041361693.db2.gz DXAODXLSIFGBCV-KRWDZBQOSA-N -1 1 335.378 4.314 20 0 EIADMM CC[C@@H]1CN(C(=O)c2cc(F)ccc2[O-])CC[C@H]1c1ccccc1 ZINC000436587170 1041363179 /nfs/dbraw/zinc/36/31/79/1041363179.db2.gz ODIMUCOCEKTUOM-RHSMWYFYSA-N -1 1 327.399 4.187 20 0 EIADMM COc1cc(F)c(NC(=O)c2cc3ccccc3cc2[O-])cc1F ZINC000436590531 1041365360 /nfs/dbraw/zinc/36/53/60/1041365360.db2.gz ZLYCYSBLLYZICM-UHFFFAOYSA-N -1 1 329.302 4.085 20 0 EIADMM C[C@H]([C@H]1Cc2ccccc2O1)N(C)C(=O)c1cc2ccccc2cc1[O-] ZINC000436609213 1041371184 /nfs/dbraw/zinc/37/11/84/1041371184.db2.gz VRHAVKUAADJBFI-SPLOXXLWSA-N -1 1 347.414 4.010 20 0 EIADMM CCC(C)(C)[C@H]1CCCN1C(=O)c1ccc(Br)cc1[O-] ZINC000436611229 1041373287 /nfs/dbraw/zinc/37/32/87/1041373287.db2.gz ZGBJKAJYEZRWJL-CQSZACIVSA-N -1 1 340.261 4.196 20 0 EIADMM O=C(c1cc(Cl)ccc1[O-])N1CCC(Cc2cccc(F)c2)CC1 ZINC000436710552 1041437538 /nfs/dbraw/zinc/43/75/38/1041437538.db2.gz VWOWKAFQBGNINU-UHFFFAOYSA-N -1 1 347.817 4.280 20 0 EIADMM CCOc1cc(NC(=O)c2cc(Cl)c([O-])c(OC)c2)ccc1C ZINC000436713510 1041439521 /nfs/dbraw/zinc/43/95/21/1041439521.db2.gz BVMYQYAOHFUDAF-UHFFFAOYSA-N -1 1 335.787 4.014 20 0 EIADMM Cc1ccccc1[C@@H]1C[C@@H](C)N(C(=O)c2ccc(Cl)cc2[O-])C1 ZINC000436716452 1041440950 /nfs/dbraw/zinc/44/09/50/1041440950.db2.gz BDIUQBQOLYZMSU-ZIAGYGMSSA-N -1 1 329.827 4.372 20 0 EIADMM CN(CCCOc1ccccc1)C(=O)c1ccc2ccccc2c1[O-] ZINC000436758756 1041456489 /nfs/dbraw/zinc/45/64/89/1041456489.db2.gz OOAANXZTMRHGKH-UHFFFAOYSA-N -1 1 335.403 4.087 20 0 EIADMM C[C@@H]1C[C@@H]1c1ccc(CN(C(=O)c2cc(F)ccc2[O-])C2CC2)o1 ZINC000436760133 1041457717 /nfs/dbraw/zinc/45/77/17/1041457717.db2.gz MOHUDANGMQTSGW-ABAIWWIYSA-N -1 1 329.371 4.053 20 0 EIADMM C[C@@H](c1c(F)cccc1F)N(C)C(=O)c1ccc(Cl)cc1[O-] ZINC000436760057 1041457906 /nfs/dbraw/zinc/45/79/06/1041457906.db2.gz LEVIVKPJOQWTHB-VIFPVBQESA-N -1 1 325.742 4.157 20 0 EIADMM C[C@H]1C[C@H]1c1ccc(CN(C(=O)c2cc(F)ccc2[O-])C2CC2)o1 ZINC000436760136 1041458073 /nfs/dbraw/zinc/45/80/73/1041458073.db2.gz MOHUDANGMQTSGW-XHDPSFHLSA-N -1 1 329.371 4.053 20 0 EIADMM CN(CCCc1ccccc1)C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436762822 1041459593 /nfs/dbraw/zinc/45/95/93/1041459593.db2.gz HUXDXSIJEUSQIV-UHFFFAOYSA-N -1 1 337.341 4.116 20 0 EIADMM O=C(c1ccc(C(F)(F)F)cc1[O-])N1CCC(c2ccccc2)CC1 ZINC000436762203 1041459608 /nfs/dbraw/zinc/45/96/08/1041459608.db2.gz CUUNJVNKRWKYNM-UHFFFAOYSA-N -1 1 349.352 4.431 20 0 EIADMM C[C@@H](Oc1ccccc1NC(=O)c1cc(F)ccc1[O-])C(F)(F)F ZINC000436746986 1041459701 /nfs/dbraw/zinc/45/97/01/1041459701.db2.gz JFSIYIATAOMEDQ-SECBINFHSA-N -1 1 343.276 4.113 20 0 EIADMM O=C(Nc1cccc(-c2cnco2)c1)c1ccc(C(F)(F)F)cc1[O-] ZINC000436762492 1041459900 /nfs/dbraw/zinc/45/99/00/1041459900.db2.gz FLFFIQFIEZSXIH-UHFFFAOYSA-N -1 1 348.280 4.318 20 0 EIADMM O=C(c1ccc(C(F)(F)F)cc1[O-])N1CCc2c1cccc2Cl ZINC000436753477 1041465585 /nfs/dbraw/zinc/46/55/85/1041465585.db2.gz VGRCYLPCCGVKPT-UHFFFAOYSA-N -1 1 341.716 4.267 20 0 EIADMM O=C(c1ccc(C(F)(F)F)cc1[O-])N1CCCC12CCCCC2 ZINC000436764545 1041473862 /nfs/dbraw/zinc/47/38/62/1041473862.db2.gz RYIQCFQMYPALJU-UHFFFAOYSA-N -1 1 327.346 4.350 20 0 EIADMM CCN(C(=O)c1ccc(C(F)(F)F)cc1[O-])c1ccccc1OC ZINC000436790826 1041483888 /nfs/dbraw/zinc/48/38/88/1041483888.db2.gz ISIOLMMBNDZVHT-UHFFFAOYSA-N -1 1 339.313 4.086 20 0 EIADMM CC[C@@H](C)[C@H](C)N(C(=O)c1ccc(C(F)(F)F)cc1[O-])C1CC1 ZINC000436819074 1041487409 /nfs/dbraw/zinc/48/74/09/1041487409.db2.gz MOSVTGWQDDEACC-MNOVXSKESA-N -1 1 329.362 4.450 20 0 EIADMM CCOc1c(Cl)cc(NC(=O)c2ccc([O-])cc2F)cc1Cl ZINC000436818459 1041487577 /nfs/dbraw/zinc/48/75/77/1041487577.db2.gz VESXHBSPWFABTH-UHFFFAOYSA-N -1 1 344.169 4.489 20 0 EIADMM O=C(c1ccc(C(F)(F)F)cc1[O-])N(CC1CC1)c1ccccc1 ZINC000436803997 1041489601 /nfs/dbraw/zinc/48/96/01/1041489601.db2.gz AEVPZZXTFOSIRN-UHFFFAOYSA-N -1 1 335.325 4.468 20 0 EIADMM Cc1ccccc1OCCCN(C)C(=O)c1ccc2ccccc2c1[O-] ZINC000436809795 1041491125 /nfs/dbraw/zinc/49/11/25/1041491125.db2.gz VBFAFTTXCHDLKB-UHFFFAOYSA-N -1 1 349.430 4.395 20 0 EIADMM C[C@@H](NC(=O)c1cc(Cl)ccc1[O-])c1nc(C(C)(C)C)cs1 ZINC000436816218 1041492870 /nfs/dbraw/zinc/49/28/70/1041492870.db2.gz CXHWMGZQDMAOBN-SECBINFHSA-N -1 1 338.860 4.291 20 0 EIADMM Cn1ncc(NC(=O)c2ccc3ccccc3c2[O-])c1-c1ccccc1 ZINC000436812387 1041494312 /nfs/dbraw/zinc/49/43/12/1041494312.db2.gz WYCCHHHVMYZTPK-UHFFFAOYSA-N -1 1 343.386 4.198 20 0 EIADMM Cc1cccc([C@H]2CCN(C(=O)c3ccc(C(F)(F)F)cc3[O-])C2)c1 ZINC000436834522 1041498544 /nfs/dbraw/zinc/49/85/44/1041498544.db2.gz PSKAVGNVKAATAD-AWEZNQCLSA-N -1 1 349.352 4.349 20 0 EIADMM CO[C@H]1CCOc2c(NC(=O)c3ccc4ccccc4c3[O-])cccc21 ZINC000436819442 1041502150 /nfs/dbraw/zinc/50/21/50/1041502150.db2.gz NNGDBWMALCOCGR-SFHVURJKSA-N -1 1 349.386 4.268 20 0 EIADMM C[C@H]1C[C@H]1c1ccc(CN(C(=O)c2ccc([O-])cc2F)C2CC2)o1 ZINC000436864060 1041524066 /nfs/dbraw/zinc/52/40/66/1041524066.db2.gz XDVUGNMKZUZPOG-MEDUHNTESA-N -1 1 329.371 4.053 20 0 EIADMM [O-]c1ccc(-c2noc(C(F)(F)Cc3ccccc3)n2)c(Cl)c1 ZINC000436874635 1041532581 /nfs/dbraw/zinc/53/25/81/1041532581.db2.gz ULWPKKNWGDCRIP-UHFFFAOYSA-N -1 1 336.725 4.430 20 0 EIADMM CCOc1cc(-c2noc(-c3ccoc3CC)n2)cc(Cl)c1[O-] ZINC000436876070 1041533199 /nfs/dbraw/zinc/53/31/99/1041533199.db2.gz ZVNNDHGLTZLRLN-UHFFFAOYSA-N -1 1 334.759 4.317 20 0 EIADMM [O-]c1ccc(Cc2nc(-c3nccc4ccccc43)no2)cc1Cl ZINC000904591360 1041534937 /nfs/dbraw/zinc/53/49/37/1041534937.db2.gz WBQAJAYZUKHHNK-UHFFFAOYSA-N -1 1 337.766 4.235 20 0 EIADMM CCCOc1cc(OC)ccc1-c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000436877744 1041536272 /nfs/dbraw/zinc/53/62/72/1041536272.db2.gz HGFQKZZSVNJBDH-UHFFFAOYSA-N -1 1 344.342 4.046 20 0 EIADMM CCOc1cc(-c2noc([C@@H](OC)[C@@H](C)CC)n2)cc(Cl)c1[O-] ZINC000436876380 1041536621 /nfs/dbraw/zinc/53/66/21/1041536621.db2.gz IDMOKTMYNOVNBZ-XPTSAGLGSA-N -1 1 340.807 4.228 20 0 EIADMM O=C(N[C@@H](c1ccc(F)cc1)C1CCCC1)c1ccc([O-])cc1F ZINC000436879105 1041537599 /nfs/dbraw/zinc/53/75/99/1041537599.db2.gz IWKICKYBASEGTP-GOSISDBHSA-N -1 1 331.362 4.332 20 0 EIADMM CC[C@H]1CN(C(=O)c2c(F)ccc([O-])c2F)CC[C@H]1c1ccccc1 ZINC000540586802 1041557287 /nfs/dbraw/zinc/55/72/87/1041557287.db2.gz RKQWIZAJPDNIPB-DZGCQCFKSA-N -1 1 345.389 4.326 20 0 EIADMM CC[C@@H](C)[C@H](C)N(C(=O)c1cc(Br)ccc1[O-])C1CC1 ZINC000436927257 1041562515 /nfs/dbraw/zinc/56/25/15/1041562515.db2.gz QPJALSXHRUSBSS-MNOVXSKESA-N -1 1 340.261 4.194 20 0 EIADMM Cc1ccccc1C1=CCN(C(=O)c2ccc(C(F)(F)F)cc2[O-])C1 ZINC000436960990 1041577044 /nfs/dbraw/zinc/57/70/44/1041577044.db2.gz LIIXIRKZOXGQRX-UHFFFAOYSA-N -1 1 347.336 4.259 20 0 EIADMM CCCCOc1ccc(C(=O)N2CC3(CC3)c3ccccc32)c([O-])c1 ZINC000436992560 1041585136 /nfs/dbraw/zinc/58/51/36/1041585136.db2.gz XBGCQDDVOYUTBS-UHFFFAOYSA-N -1 1 337.419 4.263 20 0 EIADMM CC[C@H]1CCCN(Cc2csc(-c3ccc(C(=O)[O-])cc3)n2)C1 ZINC000516656945 1041693404 /nfs/dbraw/zinc/69/34/04/1041693404.db2.gz RJQZPXUHBICOLD-ZDUSSCGKSA-N -1 1 330.453 4.130 20 0 EIADMM Cc1ccc(C)c(S(=O)(=O)[N-]c2cc(C)c(C)c3ncccc23)c1 ZINC000437323563 1041755106 /nfs/dbraw/zinc/75/51/06/1041755106.db2.gz BZWANFMIUNDYHW-UHFFFAOYSA-N -1 1 340.448 4.269 20 0 EIADMM O=c1nc(COc2ccc(F)cc2)[n-]c2sc3ccccc3c21 ZINC000541162059 1041831375 /nfs/dbraw/zinc/83/13/75/1041831375.db2.gz LPBBWBFQVQEOIV-UHFFFAOYSA-N -1 1 326.352 4.268 20 0 EIADMM Cc1cccc(S(=O)(=O)[N-]c2ccc(C(=O)C(C)(C)C)cc2)c1 ZINC000426009042 1042177416 /nfs/dbraw/zinc/17/74/16/1042177416.db2.gz VKSQMIPSDSRGSX-UHFFFAOYSA-N -1 1 331.437 4.025 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2cccc(CC(F)(F)F)c2)cc1F ZINC000438770001 1042340967 /nfs/dbraw/zinc/34/09/67/1042340967.db2.gz YNBRMSNYWGNVHZ-UHFFFAOYSA-N -1 1 347.333 4.040 20 0 EIADMM O=C(Nc1cccc(Oc2ccccc2)c1)C(=O)c1ccc([O-])cc1 ZINC000438777844 1042345762 /nfs/dbraw/zinc/34/57/62/1042345762.db2.gz KWYMGJYDGAKSDD-UHFFFAOYSA-N -1 1 333.343 4.006 20 0 EIADMM Cc1c(F)cccc1S(=O)(=O)[N-]c1ccc(OC(C)(C)C)cc1 ZINC000438776298 1042345780 /nfs/dbraw/zinc/34/57/80/1042345780.db2.gz VBECJDYIZPUARD-UHFFFAOYSA-N -1 1 337.416 4.112 20 0 EIADMM CC(C)Cc1ccc(S(=O)(=O)[N-]c2ccc3scnc3c2)cc1 ZINC000509545667 1042366626 /nfs/dbraw/zinc/36/66/26/1042366626.db2.gz WRVDIIZPWNQPDO-UHFFFAOYSA-N -1 1 346.477 4.296 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2ccc(F)cc2C(F)(F)F)cc1C ZINC000303234402 1042373642 /nfs/dbraw/zinc/37/36/42/1042373642.db2.gz ZQGRLEOUXYILCO-UHFFFAOYSA-N -1 1 347.333 4.262 20 0 EIADMM O=S(=O)([N-]c1ccccc1N1CCCCCC1)c1cccc(F)c1 ZINC000518332199 1042474033 /nfs/dbraw/zinc/47/40/33/1042474033.db2.gz JLGPVXVQWJPVPK-UHFFFAOYSA-N -1 1 348.443 4.007 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2ccccc2CC(F)(F)F)ccc1F ZINC000172901030 1042511089 /nfs/dbraw/zinc/51/10/89/1042511089.db2.gz QEGVWNCGESUYDT-UHFFFAOYSA-N -1 1 347.333 4.040 20 0 EIADMM C[C@H]1C[C@H](c2ccc(F)cc2)CN1C(=O)c1cc(Cl)ccc1[O-] ZINC000303893845 1042526524 /nfs/dbraw/zinc/52/65/24/1042526524.db2.gz SBXDBSALTBGJAI-AAEUAGOBSA-N -1 1 333.790 4.203 20 0 EIADMM COc1cc(C(=O)Nc2ccccc2NC2CCC2)cc(Cl)c1[O-] ZINC000652788348 1042848080 /nfs/dbraw/zinc/84/80/80/1042848080.db2.gz VTXRVGFMUUFYOG-UHFFFAOYSA-N -1 1 346.814 4.271 20 0 EIADMM CSc1ccc([O-])c(-c2nc(C(C)(C)c3ccc(C)cn3)no2)c1 ZINC000665085123 1042855198 /nfs/dbraw/zinc/85/51/98/1042855198.db2.gz VJXLBVRPUHGVQE-UHFFFAOYSA-N -1 1 341.436 4.193 20 0 EIADMM Cc1cccc(C)c1[N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1 ZINC000007409079 1042937378 /nfs/dbraw/zinc/93/73/78/1042937378.db2.gz BZJBTHWAQYUBAG-UHFFFAOYSA-N -1 1 329.343 4.123 20 0 EIADMM Cc1cc(Br)c([O-])c(NC(=O)[C@H](C)c2cccs2)c1 ZINC000182909201 1043035312 /nfs/dbraw/zinc/03/53/12/1043035312.db2.gz ZGFHIUUVIPLWPY-SECBINFHSA-N -1 1 340.242 4.267 20 0 EIADMM Cc1cc(Br)c([O-])c(NC(=O)[C@@H](C)c2cccs2)c1 ZINC000182909178 1043035446 /nfs/dbraw/zinc/03/54/46/1043035446.db2.gz ZGFHIUUVIPLWPY-VIFPVBQESA-N -1 1 340.242 4.267 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2cccc(SC(F)F)c2)cc1 ZINC000727363528 1043208766 /nfs/dbraw/zinc/20/87/66/1043208766.db2.gz VPTBCDVUPWSSME-UHFFFAOYSA-N -1 1 329.393 4.111 20 0 EIADMM Cc1ccc(C)c(S(=O)(=O)[N-]c2cccc(SC(F)F)c2)c1 ZINC000727363441 1043208915 /nfs/dbraw/zinc/20/89/15/1043208915.db2.gz PBKLLZQVOPETDV-UHFFFAOYSA-N -1 1 343.420 4.419 20 0 EIADMM O=S(=O)([N-]c1cccc(SC(F)F)c1)c1ccc(Cl)cc1 ZINC000727362549 1043210225 /nfs/dbraw/zinc/21/02/25/1043210225.db2.gz AOAXQYDFRVJONX-UHFFFAOYSA-N -1 1 349.811 4.456 20 0 EIADMM O=C(c1c([O-])cccc1Cl)N1CCC[C@@H](c2ccccc2)CC1 ZINC000727489520 1043231733 /nfs/dbraw/zinc/23/17/33/1043231733.db2.gz YKOZOLBZZDACDW-OAHLLOKOSA-N -1 1 329.827 4.456 20 0 EIADMM CCOc1cc(-c2nc([C@H]3Cc4ccccc43)no2)cc(Cl)c1[O-] ZINC000525956528 1043236448 /nfs/dbraw/zinc/23/64/48/1043236448.db2.gz BOGKPNUUBNKBCL-ZDUSSCGKSA-N -1 1 342.782 4.182 20 0 EIADMM CCOc1cc(C(=O)Nc2cc(C)cc(OC)c2C)cc(Cl)c1[O-] ZINC000428060219 1043304806 /nfs/dbraw/zinc/30/48/06/1043304806.db2.gz SOFZVUZTOLNFMM-UHFFFAOYSA-N -1 1 349.814 4.322 20 0 EIADMM COCc1cc(-c2nc3scc(C4CCCCC4)c3c(=O)[n-]2)no1 ZINC000672772995 1043393677 /nfs/dbraw/zinc/39/36/77/1043393677.db2.gz OVGHSFBUYIOCDV-UHFFFAOYSA-N -1 1 345.424 4.246 20 0 EIADMM CSc1cc(O)ccc1[N-]C(=O)c1cc(-c2ccc(C)cc2)no1 ZINC000191174745 1043790006 /nfs/dbraw/zinc/79/00/06/1043790006.db2.gz SGZCNJNADMLNAZ-UHFFFAOYSA-N -1 1 340.404 4.330 20 0 EIADMM CC[C@@H](NC(=O)c1cc(Cl)c([O-])c(OC)c1)C1CCCCC1 ZINC000682376884 1043811148 /nfs/dbraw/zinc/81/11/48/1043811148.db2.gz ZRGPABFBPDLKPB-CQSZACIVSA-N -1 1 325.836 4.143 20 0 EIADMM CC(C)c1cnc(N2CCC(C(=O)c3ccc([O-])cc3)CC2)s1 ZINC000682463954 1043820436 /nfs/dbraw/zinc/82/04/36/1043820436.db2.gz BGJDAJAZYYYLPU-UHFFFAOYSA-N -1 1 330.453 4.071 20 0 EIADMM CC[C@@H]([N-]S(=O)(=O)c1cc(Cl)sc1Cl)C(C)(C)C ZINC000521557907 1043836616 /nfs/dbraw/zinc/83/66/16/1043836616.db2.gz YJFGRIRDMCUUCK-MRVPVSSYSA-N -1 1 330.302 4.158 20 0 EIADMM Cc1cccc(CC2CN(C(=O)c3cc4ccccc4cc3[O-])C2)c1 ZINC000674746486 1043860543 /nfs/dbraw/zinc/86/05/43/1043860543.db2.gz PFYAVNLMIYPVDI-UHFFFAOYSA-N -1 1 331.415 4.169 20 0 EIADMM C[C@@H]1CO[C@@H](c2ccccc2)[C@H](C)N1C(=O)c1cc(Cl)ccc1[O-] ZINC000732017013 1043870544 /nfs/dbraw/zinc/87/05/44/1043870544.db2.gz LDHHRTGYWBFVII-FHSNZYRGSA-N -1 1 345.826 4.036 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)Nc1cc2c(cc1Cl)OCO2 ZINC000192186793 1043890683 /nfs/dbraw/zinc/89/06/83/1043890683.db2.gz GVAJJFIVYDICFZ-UHFFFAOYSA-N -1 1 341.150 4.072 20 0 EIADMM O=C(Nc1ccc(-c2ncco2)cc1)Nc1ccc([O-])c(Cl)c1 ZINC000192245548 1043896415 /nfs/dbraw/zinc/89/64/15/1043896415.db2.gz NSJUGXFWWJNKLW-UHFFFAOYSA-N -1 1 329.743 4.345 20 0 EIADMM COc1cc(C(=O)N(C)c2cccc(SC)c2)cc(Cl)c1[O-] ZINC000442951014 1043899812 /nfs/dbraw/zinc/89/98/12/1043899812.db2.gz GEVIQDUCHDRHHB-UHFFFAOYSA-N -1 1 337.828 4.053 20 0 EIADMM COc1cc(C(=O)N[C@@H]2c3ccccc3CC[C@@H]2C)cc(Cl)c1[O-] ZINC000443059158 1043980171 /nfs/dbraw/zinc/98/01/71/1043980171.db2.gz BNSOHMLNQHQPCH-GTNSWQLSSA-N -1 1 345.826 4.108 20 0 EIADMM CCOc1cc(-c2nc(-c3cccc(F)c3)no2)cc(Cl)c1[O-] ZINC000443107042 1044020525 /nfs/dbraw/zinc/02/05/25/1044020525.db2.gz ZEGVZEIIZXVUMU-UHFFFAOYSA-N -1 1 334.734 4.300 20 0 EIADMM COc1cc(C(=O)Nc2cccc(SC)c2C)cc(Cl)c1[O-] ZINC000443119983 1044035769 /nfs/dbraw/zinc/03/57/69/1044035769.db2.gz UGFQIVFZEYBKAI-UHFFFAOYSA-N -1 1 337.828 4.337 20 0 EIADMM Cc1noc(C(C)C)c1C(=O)[N-]c1nc(-c2ccc(F)cc2)ns1 ZINC000732942518 1044047235 /nfs/dbraw/zinc/04/72/35/1044047235.db2.gz LMTXHRDEQPCPRK-UHFFFAOYSA-N -1 1 346.387 4.016 20 0 EIADMM [O-]c1ccc(-c2noc(-c3ccc(Oc4ccccc4)cn3)n2)cc1F ZINC000522033776 1044175437 /nfs/dbraw/zinc/17/54/37/1044175437.db2.gz KGIYKBXDVQPXEY-UHFFFAOYSA-N -1 1 349.321 4.436 20 0 EIADMM COc1cccc(CSc2nc(C)c(C3CC3)c(=O)[n-]2)c1Cl ZINC000631022907 1044270641 /nfs/dbraw/zinc/27/06/41/1044270641.db2.gz DAPBRKYQNQYEPV-UHFFFAOYSA-N -1 1 336.844 4.322 20 0 EIADMM Cc1nc(S[C@@H](C(=O)C2CC2)c2ccccc2)[n-]c(=O)c1C1CC1 ZINC000631023077 1044282373 /nfs/dbraw/zinc/28/23/73/1044282373.db2.gz GTWVZZAUFMDIHQ-QGZVFWFLSA-N -1 1 340.448 4.181 20 0 EIADMM Cc1ccc(NC(=O)C(C)(C)C)cc1NC(=O)c1cc(F)ccc1[O-] ZINC000094131578 1044528407 /nfs/dbraw/zinc/52/84/07/1044528407.db2.gz WEPSHMINIPDUQR-UHFFFAOYSA-N -1 1 344.386 4.077 20 0 EIADMM C[C@@H](C[N-]S(=O)(=O)c1cc(Cl)sc1Cl)C(C)(C)C ZINC000734498314 1044584804 /nfs/dbraw/zinc/58/48/04/1044584804.db2.gz GXOPDZLLFGEJFX-ZETCQYMHSA-N -1 1 330.302 4.015 20 0 EIADMM CCCN(C(=O)c1ncc(C)cc1[O-])[C@H](C)c1cc2ccccc2o1 ZINC000495138524 1044711688 /nfs/dbraw/zinc/71/16/88/1044711688.db2.gz NWXGFKGYTMTDML-CQSZACIVSA-N -1 1 338.407 4.455 20 0 EIADMM O=S(=O)(C=Cc1ccc(F)cc1)[N-]c1cc(C2CCCCC2)[nH]n1 ZINC000761841393 1044768230 /nfs/dbraw/zinc/76/82/30/1044768230.db2.gz SLADDEGREMMCSM-KHPPLWFESA-N -1 1 349.431 4.009 20 0 EIADMM Cc1ccccc1[C@H]1C[C@H](C)N(C(=O)c2c([O-])cccc2Cl)C1 ZINC000738543775 1045065423 /nfs/dbraw/zinc/06/54/23/1045065423.db2.gz KKFJZGYKMAUKGK-KBPBESRZSA-N -1 1 329.827 4.372 20 0 EIADMM CSc1cccc(S(=O)(=O)[N-]c2cccc(SC)c2C)c1 ZINC000509390387 1045086604 /nfs/dbraw/zinc/08/66/04/1045086604.db2.gz HVJYQELTPGULJE-UHFFFAOYSA-N -1 1 339.507 4.240 20 0 EIADMM O=c1nc(-c2ccc[nH]2)[n-]c2cc(-c3ccccc3Cl)sc21 ZINC000762441293 1045243268 /nfs/dbraw/zinc/24/32/68/1045243268.db2.gz KMMWQVCOISQKJA-UHFFFAOYSA-N -1 1 327.796 4.300 20 0 EIADMM Nc1ccc(-c2nc(C(c3ccccc3)c3ccccc3)no2)c([O-])c1 ZINC000915787403 1045464451 /nfs/dbraw/zinc/46/44/51/1045464451.db2.gz AXKADBSTDCDGHY-UHFFFAOYSA-N -1 1 343.386 4.205 20 0 EIADMM COCc1ccccc1[N-]S(=O)(=O)c1c(C)c(C)c(C)c(C)c1C ZINC000055595295 1045709740 /nfs/dbraw/zinc/70/97/40/1045709740.db2.gz BHSHCSMAEYSKCF-UHFFFAOYSA-N -1 1 347.480 4.176 20 0 EIADMM Cc1ccc([C@H]2CCCN2Cc2nc(=O)c3sccc3[n-]2)cc1C ZINC000067984787 1045745931 /nfs/dbraw/zinc/74/59/31/1045745931.db2.gz WNLWUUVJECVLFB-MRXNPFEDSA-N -1 1 339.464 4.351 20 0 EIADMM Cc1ccc(C[N@H+](C)Cc2cc(=O)oc3cc([O-])c(Cl)cc23)cc1 ZINC000915878365 1045759149 /nfs/dbraw/zinc/75/91/49/1045759149.db2.gz PQVVWPFLEHRGIF-UHFFFAOYSA-N -1 1 343.810 4.092 20 0 EIADMM Cc1ccc([C@@H]2CCCCN2C(=O)c2nc3ccccc3c(=O)[n-]2)cc1 ZINC000075488578 1045828913 /nfs/dbraw/zinc/82/89/13/1045828913.db2.gz SJXOCTVVDRJANT-SFHVURJKSA-N -1 1 347.418 4.011 20 0 EIADMM O=S(=O)(/C=C/c1cccc(Cl)c1)[N-]c1cccc2cccnc21 ZINC000768860809 1045856655 /nfs/dbraw/zinc/85/66/55/1045856655.db2.gz DOOAEDLUNLRJPH-PKNBQFBNSA-N -1 1 344.823 4.301 20 0 EIADMM CCCOc1ccc([N-]S(=O)(=O)c2cc(C)sc2C)c(C)c1 ZINC000614884001 1045920167 /nfs/dbraw/zinc/92/01/67/1045920167.db2.gz ZNGNTBZCNNLLFQ-UHFFFAOYSA-N -1 1 339.482 4.263 20 0 EIADMM Cc1cc(Cl)ccc1C1=CCN(C(=O)c2ccc([O-])c(F)c2)CC1 ZINC001170335876 1046005387 /nfs/dbraw/zinc/00/53/87/1046005387.db2.gz SNFHUYFOCLGPOM-UHFFFAOYSA-N -1 1 345.801 4.423 20 0 EIADMM CC(=O)Nc1cc(NC(=O)c2ccc(C(C)C)cc2[O-])c(F)cc1F ZINC000769734226 1046045180 /nfs/dbraw/zinc/04/51/80/1046045180.db2.gz GVDYXRHPJILRTN-UHFFFAOYSA-N -1 1 348.349 4.005 20 0 EIADMM CC(=O)c1cc(Cl)cc(CN(C)Cc2nc3ccccc3o2)c1[O-] ZINC000154002789 1046046599 /nfs/dbraw/zinc/04/65/99/1046046599.db2.gz RMGKTCIHZPYKTG-UHFFFAOYSA-N -1 1 344.798 4.021 20 0 EIADMM C[C@H]1CCCC[C@]1(C)[N-]S(=O)(=O)c1cc(Cl)sc1Cl ZINC001212077130 1046059959 /nfs/dbraw/zinc/05/99/59/1046059959.db2.gz GUZRYMOVVUQBLU-UFBFGSQYSA-N -1 1 342.313 4.302 20 0 EIADMM O=C(Nc1ccnn1C1CCCCC1)Nc1ccc([O-])c(Cl)c1 ZINC000792761881 1046062056 /nfs/dbraw/zinc/06/20/56/1046062056.db2.gz CKKWBRHYORRAEB-UHFFFAOYSA-N -1 1 334.807 4.391 20 0 EIADMM CC(C)(C)Oc1c(F)cc(NC(=O)c2ccc([O-])cc2F)cc1F ZINC000123756553 1046196143 /nfs/dbraw/zinc/19/61/43/1046196143.db2.gz HROAAWFUNDKJPR-UHFFFAOYSA-N -1 1 339.313 4.239 20 0 EIADMM O=C(c1nc2ccccc2c(=O)[n-]1)N1CCCCC[C@@H]1c1ccccc1 ZINC000079408907 1046225791 /nfs/dbraw/zinc/22/57/91/1046225791.db2.gz WWLHILYHCIADMU-GOSISDBHSA-N -1 1 347.418 4.093 20 0 EIADMM C[C@@H]1[C@H](C(=O)[O-])CCCN1Cc1cc(Cl)cc(C(F)(F)F)c1 ZINC000263070739 1046247651 /nfs/dbraw/zinc/24/76/51/1046247651.db2.gz PHNWGTOGDCNCDZ-NOZJJQNGSA-N -1 1 335.753 4.044 20 0 EIADMM O=c1ccnc(C=Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[n-]1 ZINC000771861707 1046504881 /nfs/dbraw/zinc/50/48/81/1046504881.db2.gz WOZXNRHVPLYEEW-UPHRSURJSA-N -1 1 334.219 4.390 20 0 EIADMM Cc1ccc(-c2noc([N-][C@H]3CCCc4cn(C(C)C)nc43)n2)cc1 ZINC000785845572 1046764224 /nfs/dbraw/zinc/76/42/24/1046764224.db2.gz SRIHUYGQRVCZIW-INIZCTEOSA-N -1 1 337.427 4.312 20 0 EIADMM C[C@H](CNC(=O)c1ccc2ccccc2c1[O-])c1nc2ccccc2o1 ZINC000746563735 1046776083 /nfs/dbraw/zinc/77/60/83/1046776083.db2.gz NMUGSBVUNVYPQM-CYBMUJFWSA-N -1 1 346.386 4.220 20 0 EIADMM COc1cc(C(C)=O)ccc1SC[C@@H](C)C(=O)c1ccc([O-])cc1 ZINC000917347245 1046850148 /nfs/dbraw/zinc/85/01/48/1046850148.db2.gz OZUBIHVFPOWICV-GFCCVEGCSA-N -1 1 344.432 4.215 20 0 EIADMM O=S(=O)([N-]c1cccc(COc2ccccc2)c1)c1ccccc1 ZINC000917764123 1047129160 /nfs/dbraw/zinc/12/91/60/1047129160.db2.gz XVWALUMTVSJXNN-UHFFFAOYSA-N -1 1 339.416 4.066 20 0 EIADMM COc1cc(C(=O)N[C@H](C)Cc2cc(C)cc(C)c2)cc(Cl)c1[O-] ZINC000460208823 1047165501 /nfs/dbraw/zinc/16/55/01/1047165501.db2.gz HMZUROUPXGMFGL-CYBMUJFWSA-N -1 1 347.842 4.032 20 0 EIADMM CC(C)c1cnc(-c2ccc(NC(=O)c3ccc(O)cc3[O-])cc2)o1 ZINC000116699567 1047344401 /nfs/dbraw/zinc/34/44/01/1047344401.db2.gz MZVHFFCJSBAPDD-UHFFFAOYSA-N -1 1 338.363 4.129 20 0 EIADMM Cc1nc(C(C)C)[n-]c(=O)c1C(=O)N1CCC(C2CCCCC2)CC1 ZINC000747360304 1047374897 /nfs/dbraw/zinc/37/48/97/1047374897.db2.gz RTYDXCDSSGCBFJ-UHFFFAOYSA-N -1 1 345.487 4.047 20 0 EIADMM CSc1c(F)cccc1[N-]C(=O)c1coc(-c2ccccc2)n1 ZINC001130857755 1047417475 /nfs/dbraw/zinc/41/74/75/1047417475.db2.gz KAMRWZNIHJBNDZ-UHFFFAOYSA-N -1 1 328.368 4.455 20 0 EIADMM O=C(C[C@H](c1ccccc1)C(F)(F)F)Nc1nc(Cl)ccc1[O-] ZINC000789930511 1047485827 /nfs/dbraw/zinc/48/58/27/1047485827.db2.gz TXQYRGYFCJRHOC-SNVBAGLBSA-N -1 1 344.720 4.115 20 0 EIADMM Cc1cc(CN[C@H](CC(=O)[O-])c2cccc(C(F)(F)F)c2)c(C)o1 ZINC000789902916 1047490965 /nfs/dbraw/zinc/49/09/65/1047490965.db2.gz CYWXIAYYMKEUBZ-OAHLLOKOSA-N -1 1 341.329 4.221 20 0 EIADMM CSc1ccc(/C=C\C(=O)Nc2cc(F)cc(F)c2[O-])s1 ZINC001142545903 1047587981 /nfs/dbraw/zinc/58/79/81/1047587981.db2.gz LYJUFMIGPYMGEI-RQOWECAXSA-N -1 1 327.377 4.106 20 0 EIADMM CSc1ccc(/C=C/C(=O)Nc2cc(F)cc(F)c2[O-])s1 ZINC001142545901 1047591404 /nfs/dbraw/zinc/59/14/04/1047591404.db2.gz LYJUFMIGPYMGEI-DUXPYHPUSA-N -1 1 327.377 4.106 20 0 EIADMM CC(C)N(Cc1ccccc1)C(=O)c1ccc(Br)cc1[O-] ZINC000044490386 1047647064 /nfs/dbraw/zinc/64/70/64/1047647064.db2.gz LXYGRBFTWUWXAW-UHFFFAOYSA-N -1 1 348.240 4.206 20 0 EIADMM COc1c(C)ccc([N-]S(=O)(=O)c2ccccc2C(C)(C)C)c1C ZINC000460411400 1047777640 /nfs/dbraw/zinc/77/76/40/1047777640.db2.gz IVAFZUBSBYCKDD-UHFFFAOYSA-N -1 1 347.480 4.410 20 0 EIADMM Cc1cc(F)c(C(=O)[N-]c2nc(-c3cccs3)ns2)c(F)c1 ZINC001127495626 1047845305 /nfs/dbraw/zinc/84/53/05/1047845305.db2.gz SPHSCYXLLGPDCB-UHFFFAOYSA-N -1 1 337.376 4.106 20 0 EIADMM O=C(N[C@@H]1CCC[C@@H]1Cc1ccccc1)c1c([O-])cccc1Cl ZINC001136901137 1047889827 /nfs/dbraw/zinc/88/98/27/1047889827.db2.gz DPTQMMYOEDNUHV-GDBMZVCRSA-N -1 1 329.827 4.187 20 0 EIADMM CSc1ccc([O-])c(C(=O)Nc2ccc(CC(F)(F)F)cc2)c1 ZINC001136924322 1047901415 /nfs/dbraw/zinc/90/14/15/1047901415.db2.gz VVLDPRMDLGULBO-UHFFFAOYSA-N -1 1 341.354 4.471 20 0 EIADMM CCC(CC)CN(CC)C(=O)c1cc(Br)ccc1[O-] ZINC000221962612 1048009130 /nfs/dbraw/zinc/00/91/30/1048009130.db2.gz CAGYKXNAGSNXJU-UHFFFAOYSA-N -1 1 328.250 4.053 20 0 EIADMM CC(=O)c1csc(C(=O)[N-]c2nc(-c3sccc3C)ns2)c1 ZINC000131685605 1048100421 /nfs/dbraw/zinc/10/04/21/1048100421.db2.gz VBYBDNKQTCJPJT-UHFFFAOYSA-N -1 1 349.462 4.091 20 0 EIADMM CC(C)(C)C(=O)c1ccc(NC(=O)Cc2ccc([O-])c(Cl)c2)cc1 ZINC001137044370 1048102489 /nfs/dbraw/zinc/10/24/89/1048102489.db2.gz CWBOSZKGHPSBKX-UHFFFAOYSA-N -1 1 345.826 4.456 20 0 EIADMM O=C(Nc1c([O-])cc(Br)cc1Cl)C1(F)CCCC1 ZINC000843884390 1048137649 /nfs/dbraw/zinc/13/76/49/1048137649.db2.gz BMRDPEHOOZUEON-UHFFFAOYSA-N -1 1 336.588 4.029 20 0 EIADMM C[C@@H]1CN(c2ccc(NCc3cccc([O-])c3Cl)cc2)C[C@H](C)O1 ZINC000815130389 1048341352 /nfs/dbraw/zinc/34/13/52/1048341352.db2.gz FGXDOUPZLWJWJY-OKILXGFUSA-N -1 1 346.858 4.271 20 0 EIADMM [O-]c1cccc(CNc2ccc(O[C@H]3CCCC[C@@H]3O)cc2)c1Cl ZINC000815128733 1048342396 /nfs/dbraw/zinc/34/23/96/1048342396.db2.gz LHISCJVPKZSFPI-WMZOPIPTSA-N -1 1 347.842 4.340 20 0 EIADMM CC(=O)Nc1cc(Cl)ccc1NC(=O)c1ccc(C(C)C)cc1[O-] ZINC001143980848 1048343258 /nfs/dbraw/zinc/34/32/58/1048343258.db2.gz KNYNTZRWQYDFOE-UHFFFAOYSA-N -1 1 346.814 4.380 20 0 EIADMM CC(C)(Cc1ccccc1Cl)NC(=O)c1ccc(Cl)cc1[O-] ZINC001144143769 1048449018 /nfs/dbraw/zinc/44/90/18/1048449018.db2.gz POYPYHIVZWMBTB-UHFFFAOYSA-N -1 1 338.234 4.450 20 0 EIADMM O=C(NCc1cccc(Cl)c1Cl)c1c([O-])cccc1Cl ZINC000920444577 1048674656 /nfs/dbraw/zinc/67/46/56/1048674656.db2.gz HZZQFQPCHNMDOX-UHFFFAOYSA-N -1 1 330.598 4.282 20 0 EIADMM COc1ccccc1C1CCN(Cc2c(F)cc([O-])cc2F)CC1 ZINC001144559930 1048727060 /nfs/dbraw/zinc/72/70/60/1048727060.db2.gz RZPAHRKNVULLPZ-UHFFFAOYSA-N -1 1 333.378 4.059 20 0 EIADMM O=C(N[C@@H](c1ccc(F)cc1)C1CCC1)c1c([O-])cccc1Cl ZINC001144622922 1048758558 /nfs/dbraw/zinc/75/85/58/1048758558.db2.gz IQOOSTDYNJOWQU-QGZVFWFLSA-N -1 1 333.790 4.456 20 0 EIADMM O=C(Nc1nc(Cl)ccc1[O-])c1cc(Cl)c(F)cc1Cl ZINC000816426567 1048801877 /nfs/dbraw/zinc/80/18/77/1048801877.db2.gz NNGBIPXAYHLPHH-UHFFFAOYSA-N -1 1 335.549 4.139 20 0 EIADMM O=C([N-]Cc1ccc(F)c(F)c1)C(F)(F)c1cccc(Cl)c1 ZINC000921004383 1048835634 /nfs/dbraw/zinc/83/56/34/1048835634.db2.gz UCXWUHZWLXAJHZ-UHFFFAOYSA-N -1 1 331.696 4.026 20 0 EIADMM O=C([O-])c1ccc(CN2CCC(Oc3ccccc3)CC2)cc1Cl ZINC000846236650 1048845204 /nfs/dbraw/zinc/84/52/04/1048845204.db2.gz VTTYKOLWRNTUAY-UHFFFAOYSA-N -1 1 345.826 4.082 20 0 EIADMM CC[C@H](C)CO[N-]C(=O)[C@@H](C)c1cccc(C(=O)c2ccccc2)c1 ZINC000816980024 1048884918 /nfs/dbraw/zinc/88/49/18/1048884918.db2.gz CYFRCWYOHKUMLG-HOTGVXAUSA-N -1 1 339.435 4.115 20 0 EIADMM COc1ccccc1-c1cc(C(=O)[N-]c2cc(F)cc(F)c2F)no1 ZINC000817087729 1048897402 /nfs/dbraw/zinc/89/74/02/1048897402.db2.gz SXFDYSKHXTWLLT-UHFFFAOYSA-N -1 1 348.280 4.020 20 0 EIADMM O=C([N-][C@@H](c1ccccc1)C(F)F)C(F)(F)c1ccccc1F ZINC000817223504 1048909735 /nfs/dbraw/zinc/90/97/35/1048909735.db2.gz UTUUOGUPOYCUKI-ZDUSSCGKSA-N -1 1 329.268 4.040 20 0 EIADMM Cc1ccccc1C[C@@H]1CCCN1C(=O)Cc1ccc([O-])c(Cl)c1 ZINC001147074721 1049086599 /nfs/dbraw/zinc/08/65/99/1049086599.db2.gz XQSFGGDNNMZYNM-KRWDZBQOSA-N -1 1 343.854 4.130 20 0 EIADMM O=C(c1ncc2ccccc2c1[O-])N1CCCCC[C@H]1c1ccco1 ZINC001147162943 1049093387 /nfs/dbraw/zinc/09/33/87/1049093387.db2.gz GPUSONNFECZICX-INIZCTEOSA-N -1 1 336.391 4.291 20 0 EIADMM O=C(NCc1c(Cl)oc2ccccc21)c1cc(Cl)ccc1[O-] ZINC001147359857 1049136177 /nfs/dbraw/zinc/13/61/77/1049136177.db2.gz YWCYJWHTGOTKGG-UHFFFAOYSA-N -1 1 336.174 4.375 20 0 EIADMM O=C(NCC1(c2cccc(Cl)c2)CC1)c1ccc(Cl)cc1[O-] ZINC001147390374 1049142654 /nfs/dbraw/zinc/14/26/54/1049142654.db2.gz KOTFWQIRRUGZQX-UHFFFAOYSA-N -1 1 336.218 4.161 20 0 EIADMM CN(Cc1ccc(Cl)cc1Cl)C(=O)c1cccc([O-])c1F ZINC001136155204 1049190988 /nfs/dbraw/zinc/19/09/88/1049190988.db2.gz GRENLZAJIZVESN-UHFFFAOYSA-N -1 1 328.170 4.110 20 0 EIADMM CCc1ccc(C(=O)Nc2n[nH]cc2-c2ccc(Cl)cc2)c([O-])c1 ZINC001148034974 1049260420 /nfs/dbraw/zinc/26/04/20/1049260420.db2.gz NTEHTGACTLXRLW-UHFFFAOYSA-N -1 1 341.798 4.250 20 0 EIADMM Cc1cc(C)c(C)c(S(=O)(=O)[N-]c2ccnc(Cl)c2C)c1C ZINC000811836012 1049285221 /nfs/dbraw/zinc/28/52/21/1049285221.db2.gz ZXHJCGQSSBDCLV-UHFFFAOYSA-N -1 1 338.860 4.078 20 0 EIADMM CC(C)Oc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2[O-])cc1 ZINC001148400208 1049310759 /nfs/dbraw/zinc/31/07/59/1049310759.db2.gz UDAWHRFZPVBQSW-UHFFFAOYSA-N -1 1 339.313 4.451 20 0 EIADMM CCCOc1ccc(Cl)cc1NC(=O)c1ccc(OC)cc1[O-] ZINC001136301530 1049427495 /nfs/dbraw/zinc/42/74/95/1049427495.db2.gz GBGBRXGWHLQADM-UHFFFAOYSA-N -1 1 335.787 4.095 20 0 EIADMM CSc1ccc([O-])c(C(=O)Nc2ccc(N(C)C(C)C)c(F)c2)c1 ZINC001136333604 1049488388 /nfs/dbraw/zinc/48/83/88/1049488388.db2.gz IPCSQVKMUXVVBS-UHFFFAOYSA-N -1 1 348.443 4.350 20 0 EIADMM O=C(N[C@@H]1CCC[C@@H]1c1ccccc1)c1ccc2ccc(O)cc2c1[O-] ZINC001171364436 1049514638 /nfs/dbraw/zinc/51/46/38/1049514638.db2.gz NAEGCBLWFRIMCA-YLJYHZDGSA-N -1 1 347.414 4.317 20 0 EIADMM CCC(CC)c1nnc([N-]C(=O)c2csc(-c3ccco3)n2)s1 ZINC000029550384 1049519066 /nfs/dbraw/zinc/51/90/66/1049519066.db2.gz CVSNPCXNSDMIOV-UHFFFAOYSA-N -1 1 348.453 4.411 20 0 EIADMM CC1(C)CN(C(=O)c2ncc3ccccc3c2[O-])[C@H]1c1ccccc1 ZINC001136400946 1049585858 /nfs/dbraw/zinc/58/58/58/1049585858.db2.gz FSDSOFLLABJWEQ-IBGZPJMESA-N -1 1 332.403 4.164 20 0 EIADMM COc1ccc(C2(NC(=O)c3c([O-])cccc3Cl)CCCC2)cc1 ZINC001136503015 1049699597 /nfs/dbraw/zinc/69/95/97/1049699597.db2.gz ABGRQYDXXAUEGT-UHFFFAOYSA-N -1 1 345.826 4.254 20 0 EIADMM O=C(Nc1nc(C2CCCCC2)cs1)c1c(F)ccc([O-])c1F ZINC001171517756 1049746229 /nfs/dbraw/zinc/74/62/29/1049746229.db2.gz PFVMTQRARSDSNI-UHFFFAOYSA-N -1 1 338.379 4.427 20 0 EIADMM O=C(/C=C\c1csc(C(F)(F)F)c1)Nc1cccc(F)c1[O-] ZINC001171637118 1049778666 /nfs/dbraw/zinc/77/86/66/1049778666.db2.gz KMMUGJXOLQBNIR-PLNGDYQASA-N -1 1 331.290 4.264 20 0 EIADMM O=C([N-]c1cc(-c2ccccc2)on1)c1cc(-c2cccs2)on1 ZINC000081737425 1049787604 /nfs/dbraw/zinc/78/76/04/1049787604.db2.gz QZXMRSCRASUEPI-UHFFFAOYSA-N -1 1 337.360 4.310 20 0 EIADMM C[C@H](C1CC1)N(Cc1ccccc1)C(=O)c1ncc2ccccc2c1[O-] ZINC001136636597 1049803286 /nfs/dbraw/zinc/80/32/86/1049803286.db2.gz FZVDFBIKSKLFPN-OAHLLOKOSA-N -1 1 346.430 4.381 20 0 EIADMM CSCc1ccccc1[N-]S(=O)(=O)c1cccc(C(F)F)c1 ZINC000780401498 1049831527 /nfs/dbraw/zinc/83/15/27/1049831527.db2.gz HQFDQIHYVPDFLO-UHFFFAOYSA-N -1 1 343.420 4.288 20 0 EIADMM CCCCC[C@@H](CC)C(=O)N[N-]C(=O)c1c(Cl)cccc1Cl ZINC000180309956 1049876855 /nfs/dbraw/zinc/87/68/55/1049876855.db2.gz AKDSQAJXDYROCC-LLVKDONJSA-N -1 1 345.270 4.361 20 0 EIADMM CCOc1cc(C(=O)N2[C@H](C)C[C@@H]3CCCC[C@H]32)cc(Cl)c1[O-] ZINC000248853442 1050080960 /nfs/dbraw/zinc/08/09/60/1050080960.db2.gz BYTHZKBAGAOGIN-TYNCELHUSA-N -1 1 337.847 4.238 20 0 EIADMM CC(C)[C@H](Sc1nc(C(F)F)cc(=O)[n-]1)C(=O)c1ccccc1 ZINC000564391563 1050088538 /nfs/dbraw/zinc/08/85/38/1050088538.db2.gz HACCKQJLKVMTIK-AWEZNQCLSA-N -1 1 338.379 4.119 20 0 EIADMM C[C@H]([N-]C(=O)C(F)(F)c1ccccn1)c1ccccc1C(F)(F)F ZINC001177302997 1050180551 /nfs/dbraw/zinc/18/05/51/1050180551.db2.gz MSLZKYZHDSHFGX-JTQLQIEISA-N -1 1 344.283 4.070 20 0 EIADMM CC(C)(C)c1ccc(-c2noc(-c3ncc(C(F)(F)F)[n-]3)n2)cc1 ZINC001212690112 1050228974 /nfs/dbraw/zinc/22/89/74/1050228974.db2.gz YNFPCSVQHSAECR-UHFFFAOYSA-N -1 1 336.317 4.443 20 0 EIADMM CC(C)(C)c1ccc(-c2noc(-c3nc(C(F)(F)F)c[n-]3)n2)cc1 ZINC001212690112 1050228984 /nfs/dbraw/zinc/22/89/84/1050228984.db2.gz YNFPCSVQHSAECR-UHFFFAOYSA-N -1 1 336.317 4.443 20 0 EIADMM CC(=O)c1ccc(F)c([N-]S(=O)(=O)c2csc3ccccc32)c1 ZINC001186495915 1050337461 /nfs/dbraw/zinc/33/74/61/1050337461.db2.gz WIICHKZJKQUIIS-UHFFFAOYSA-N -1 1 349.408 4.044 20 0 EIADMM CN1CCN(c2cccc(Nc3ccc(Cl)cc3[S-])c2)CC1 ZINC001212714665 1050363279 /nfs/dbraw/zinc/36/32/79/1050363279.db2.gz JPGANRBVUYBYIB-UHFFFAOYSA-N -1 1 333.888 4.124 20 0 EIADMM [O-]c1cnccc1-c1nc(-c2ccc(Cl)cc2C(F)(F)F)no1 ZINC001212721528 1050434609 /nfs/dbraw/zinc/43/46/09/1050434609.db2.gz VKUORMOLELWQAF-UHFFFAOYSA-N -1 1 341.676 4.176 20 0 EIADMM [O-]c1cnccc1-c1nc(-c2ccc(C(F)(F)F)c(Cl)c2)no1 ZINC001212721570 1050437319 /nfs/dbraw/zinc/43/73/19/1050437319.db2.gz XAEYOYRIFAMJEU-UHFFFAOYSA-N -1 1 341.676 4.176 20 0 EIADMM Cc1c(Cl)cc(Nc2ccc(C(=O)N(C)C)cc2)c([O-])c1Cl ZINC001174007502 1050677172 /nfs/dbraw/zinc/67/71/72/1050677172.db2.gz XBOXJPCKKJKIIY-UHFFFAOYSA-N -1 1 339.222 4.453 20 0 EIADMM [O-]c1c(Br)ccc(Cl)c1Nc1ccc2c(c1)CCO2 ZINC001174013325 1050680337 /nfs/dbraw/zinc/68/03/37/1050680337.db2.gz HNJYJLKSWUNABI-UHFFFAOYSA-N -1 1 340.604 4.487 20 0 EIADMM CSc1cc(C)nc(SC)c1[N-]C(=O)c1cc(C)cc(C)n1 ZINC001188135365 1050707713 /nfs/dbraw/zinc/70/77/13/1050707713.db2.gz ISKMOTMKDQXOKE-UHFFFAOYSA-N -1 1 333.482 4.098 20 0 EIADMM CCCc1cc(=O)[n-]c(SCc2cc(C)nc3ccccc23)n1 ZINC001188154487 1050708080 /nfs/dbraw/zinc/70/80/80/1050708080.db2.gz MGHBTIGSWLHZMF-UHFFFAOYSA-N -1 1 325.437 4.284 20 0 EIADMM CC(C)(C)c1ccc(C(=O)Nc2cc(=O)n(-c3ccccc3)[n-]2)s1 ZINC001188246262 1050724375 /nfs/dbraw/zinc/72/43/75/1050724375.db2.gz ZJKLNAPTLBKDHY-UHFFFAOYSA-N -1 1 341.436 4.189 20 0 EIADMM O=C(Nc1ccc(-n2ccc(=O)[n-]2)cc1)Nc1ccc2ccccc2c1 ZINC001188615993 1050806319 /nfs/dbraw/zinc/80/63/19/1050806319.db2.gz NMPHSGKVWCMOMU-UHFFFAOYSA-N -1 1 344.374 4.375 20 0 EIADMM O=S(=O)([N-]C/C=C\c1ccccc1)c1cc(Cl)sc1Cl ZINC001188634102 1050818420 /nfs/dbraw/zinc/81/84/20/1050818420.db2.gz OGCDDDUIVCNRIU-DAXSKMNVSA-N -1 1 348.276 4.047 20 0 EIADMM CCS[C@@H]1CCCC[C@@H]1NC(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC000619582731 1050825673 /nfs/dbraw/zinc/82/56/73/1050825673.db2.gz HXGAAWOXAZRUCV-GXTWGEPZSA-N -1 1 347.402 4.205 20 0 EIADMM COc1ccc(F)c(Nc2ccc(F)c(Br)c2[O-])c1 ZINC001174210508 1050845001 /nfs/dbraw/zinc/84/50/01/1050845001.db2.gz AEONVLRSYNUJLB-UHFFFAOYSA-N -1 1 330.128 4.185 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@@H](O)c1cc(Cl)cc(Cl)c1 ZINC000182874211 1050859124 /nfs/dbraw/zinc/85/91/24/1050859124.db2.gz KBMWWXDYKJBZPJ-ZDUSSCGKSA-N -1 1 346.597 4.025 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1ccccc1OC(F)(F)F ZINC000182874352 1050862596 /nfs/dbraw/zinc/86/25/96/1050862596.db2.gz BNGKDXFJPRWHDF-UHFFFAOYSA-N -1 1 331.677 4.197 20 0 EIADMM CC(C)C[C@H](NCc1ccc(-c2nc3ccccc3s2)o1)C(=O)[O-] ZINC000261928830 1050873855 /nfs/dbraw/zinc/87/38/55/1050873855.db2.gz SPCTUXFDVNIATK-AWEZNQCLSA-N -1 1 344.436 4.145 20 0 EIADMM Cc1cccnc1[C@@H](NC(=O)c1ccc(Cl)cc1[O-])C(C)(C)C ZINC001180183662 1050895011 /nfs/dbraw/zinc/89/50/11/1050895011.db2.gz FPLMRIMZRVELJF-MRXNPFEDSA-N -1 1 332.831 4.266 20 0 EIADMM CN(Cc1ccc([O-])c(F)c1F)[C@@H](c1ccccc1)C(F)(F)F ZINC001180213104 1050915094 /nfs/dbraw/zinc/91/50/94/1050915094.db2.gz PCDHRYWVSHDZAH-HNNXBMFYSA-N -1 1 331.284 4.406 20 0 EIADMM COC(=O)c1c[n-]c(SCc2c(C)ccc3cc(C)ccc32)n1 ZINC001189166099 1050916563 /nfs/dbraw/zinc/91/65/63/1050916563.db2.gz JLBHSAOTPPPLFA-UHFFFAOYSA-N -1 1 326.421 4.259 20 0 EIADMM CCCCOc1ccc(NC(=O)Nc2cc([O-])c(F)cc2F)cc1 ZINC001189314945 1050959693 /nfs/dbraw/zinc/95/96/93/1050959693.db2.gz FDIHWGZEZGCHAB-UHFFFAOYSA-N -1 1 336.338 4.493 20 0 EIADMM O=S(=O)([N-]c1ccc2c(c1)N=NC2)c1ccc(F)c2ccccc21 ZINC001189394876 1050982683 /nfs/dbraw/zinc/98/26/83/1050982683.db2.gz VQGXMCKRTQNOHN-UHFFFAOYSA-N -1 1 341.367 4.377 20 0 EIADMM Cc1cnc(SCc2coc(-c3cccc(Cl)c3)n2)[n-]c1=O ZINC001189399522 1050984085 /nfs/dbraw/zinc/98/40/85/1050984085.db2.gz TWKLCKDBFAGDFD-UHFFFAOYSA-N -1 1 333.800 4.091 20 0 EIADMM O=S(=O)(Cc1cccc(F)c1F)[N-]c1ccccc1-c1ccco1 ZINC001189463088 1050995850 /nfs/dbraw/zinc/99/58/50/1050995850.db2.gz DWDQOSKGQVNMRS-UHFFFAOYSA-N -1 1 349.358 4.167 20 0 EIADMM O=S(=O)(Cc1cccc(F)c1F)[N-]c1cccc2sccc21 ZINC001189456218 1050997047 /nfs/dbraw/zinc/99/70/47/1050997047.db2.gz SJDVRYZPINTWHT-UHFFFAOYSA-N -1 1 339.388 4.121 20 0 EIADMM [O-]c1c(Cl)cc(Br)cc1Nc1cnn(CC2CC2)c1 ZINC001174470509 1051013524 /nfs/dbraw/zinc/01/35/24/1051013524.db2.gz CYGONICSSBSRJN-UHFFFAOYSA-N -1 1 342.624 4.158 20 0 EIADMM [O-]c1ccc(Cl)c(Nc2cnn([C@@H]3CCCCO3)c2)c1Cl ZINC001174613241 1051110319 /nfs/dbraw/zinc/11/03/19/1051110319.db2.gz WJNNGOCBNAULMX-LBPRGKRZSA-N -1 1 328.199 4.338 20 0 EIADMM O=c1cc(-c2ccccc2)nc(SCCOCC2CCCC2)[n-]1 ZINC001190209553 1051136083 /nfs/dbraw/zinc/13/60/83/1051136083.db2.gz GQWJHFODSWPXCV-UHFFFAOYSA-N -1 1 330.453 4.148 20 0 EIADMM CC(C)Oc1ccc(Nc2ccc(F)c(Br)c2[O-])cn1 ZINC001174764424 1051162988 /nfs/dbraw/zinc/16/29/88/1051162988.db2.gz CVRWJQDDDGGEHM-UHFFFAOYSA-N -1 1 341.180 4.220 20 0 EIADMM CCOc1cc(C(=O)NCCCCCCSC)cc(Cl)c1[O-] ZINC000183554315 1051166801 /nfs/dbraw/zinc/16/68/01/1051166801.db2.gz KJCBIBZFHCSVGK-UHFFFAOYSA-N -1 1 345.892 4.098 20 0 EIADMM CCC(C)(C)c1ccc(S(=O)(=O)[N-]c2ccnc(Cl)c2)cc1 ZINC001190424308 1051181510 /nfs/dbraw/zinc/18/15/10/1051181510.db2.gz YIOSXISUWXWJBV-UHFFFAOYSA-N -1 1 338.860 4.223 20 0 EIADMM O=S(=O)([N-]c1cccc2ccc(O)cc21)c1ccc(C2CC2)cc1 ZINC001190499767 1051193646 /nfs/dbraw/zinc/19/36/46/1051193646.db2.gz HFJXJYDYXZVKIA-UHFFFAOYSA-N -1 1 339.416 4.224 20 0 EIADMM O=S(=O)([N-]c1cc(F)cc(Cl)c1)c1ccc(C2CC2)cc1 ZINC001190501035 1051196190 /nfs/dbraw/zinc/19/61/90/1051196190.db2.gz VAFWBPVNCLXPBS-UHFFFAOYSA-N -1 1 325.792 4.157 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2ccc(C3CC3)cc2)c2cccnc12 ZINC001190500997 1051196217 /nfs/dbraw/zinc/19/62/17/1051196217.db2.gz UEVMHCBRSKZKQZ-UHFFFAOYSA-N -1 1 338.432 4.221 20 0 EIADMM O=c1oc2cc([O-])ccc2cc1Nc1ccc(Oc2cccnc2)cc1 ZINC001174848622 1051212436 /nfs/dbraw/zinc/21/24/36/1051212436.db2.gz GBFNYJVQKJBYGF-UHFFFAOYSA-N -1 1 346.342 4.430 20 0 EIADMM O=C(Nc1ccc(OC(F)(F)F)cc1)Nc1ccc([O-])c(F)c1F ZINC001190737446 1051267636 /nfs/dbraw/zinc/26/76/36/1051267636.db2.gz LWGIWFNBIYOLBZ-UHFFFAOYSA-N -1 1 348.227 4.213 20 0 EIADMM O=S(=O)([N-]Cc1ccc2sccc2c1)c1sccc1Cl ZINC001190992136 1051318888 /nfs/dbraw/zinc/31/88/88/1051318888.db2.gz UIDQLDNCTVILHG-UHFFFAOYSA-N -1 1 343.882 4.095 20 0 EIADMM COc1cc(C(=O)N[C@H]2C[C@@H](C)c3ccccc32)cc(Cl)c1[O-] ZINC001191156414 1051367976 /nfs/dbraw/zinc/36/79/76/1051367976.db2.gz YMMWSEXVLICRFD-BMIGLBTASA-N -1 1 331.799 4.033 20 0 EIADMM CCCCN(Cc1ccccc1)C(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC001191143354 1051378871 /nfs/dbraw/zinc/37/88/71/1051378871.db2.gz IYWUXMRNKNJMIL-UHFFFAOYSA-N -1 1 347.842 4.497 20 0 EIADMM CCCCc1ccc(S(=O)(=O)[N-]c2cccc(C(C)=O)c2C)cc1 ZINC001191253844 1051395585 /nfs/dbraw/zinc/39/55/85/1051395585.db2.gz PMUMGHWJZUJFAE-UHFFFAOYSA-N -1 1 345.464 4.341 20 0 EIADMM O=C(NCCCC1CCCC1)c1c([O-])cnc2ccc(Cl)cc21 ZINC001182092359 1051398089 /nfs/dbraw/zinc/39/80/89/1051398089.db2.gz TVBUAHRZACKNAP-UHFFFAOYSA-N -1 1 332.831 4.294 20 0 EIADMM COc1ccc2cccc(CC(=O)Nc3ccc([O-])c(Cl)c3)c2c1 ZINC000155538271 1051429329 /nfs/dbraw/zinc/42/93/29/1051429329.db2.gz WBPOOLHCGSNZIO-UHFFFAOYSA-N -1 1 341.794 4.389 20 0 EIADMM COc1ccc(-c2ccccc2)cc1[N-]S(=O)(=O)CC1CCCC1 ZINC001191480803 1051465287 /nfs/dbraw/zinc/46/52/87/1051465287.db2.gz FAINWZWNRUFUTA-UHFFFAOYSA-N -1 1 345.464 4.294 20 0 EIADMM CCC(CC)Oc1ccccc1[N-]S(=O)(=O)CC1CCCC1 ZINC001191536077 1051478347 /nfs/dbraw/zinc/47/83/47/1051478347.db2.gz WMONGXGUOFHDMX-UHFFFAOYSA-N -1 1 325.474 4.186 20 0 EIADMM CSc1cc(C)ccc1NCc1ncc(Br)cc1[O-] ZINC001182407980 1051535933 /nfs/dbraw/zinc/53/59/33/1051535933.db2.gz AZVZIWCODKCNCQ-UHFFFAOYSA-N -1 1 339.258 4.192 20 0 EIADMM Oc1ccccc1-c1cc([N-]c2c(F)c(F)c(F)c(F)c2F)on1 ZINC001175383990 1051564644 /nfs/dbraw/zinc/56/46/44/1051564644.db2.gz DCVJLFTYSUZLDR-UHFFFAOYSA-N -1 1 342.223 4.486 20 0 EIADMM Cc1cc(C)c(S(=O)(=O)[N-]c2ccc(-c3ncco3)cc2)c(C)c1 ZINC000157708983 1051666279 /nfs/dbraw/zinc/66/62/79/1051666279.db2.gz XXKYZSFHAPRMFF-UHFFFAOYSA-N -1 1 342.420 4.068 20 0 EIADMM O=C(N[C@@H](c1ccccc1)C1CCCC1)c1c(F)ccc([O-])c1F ZINC001192551267 1051755963 /nfs/dbraw/zinc/75/59/63/1051755963.db2.gz DJXKHUHGCROXEC-SFHVURJKSA-N -1 1 331.362 4.332 20 0 EIADMM O=C(c1c(F)ccc([O-])c1F)N1CCC[C@H]1c1cc2ccccc2[nH]1 ZINC001192535543 1051762949 /nfs/dbraw/zinc/76/29/49/1051762949.db2.gz IFUUJTBNQXKSDY-HNNXBMFYSA-N -1 1 342.345 4.129 20 0 EIADMM CCCc1nc2ccc(NC(=O)c3c(F)ccc([O-])c3F)cc2o1 ZINC001192539703 1051763129 /nfs/dbraw/zinc/76/31/29/1051763129.db2.gz HTNOTSXXMIEPCB-UHFFFAOYSA-N -1 1 332.306 4.016 20 0 EIADMM O=C(Nc1ccc2sc(Cl)nc2c1)c1c(F)ccc([O-])c1F ZINC001192539806 1051763402 /nfs/dbraw/zinc/76/34/02/1051763402.db2.gz JTNKFRODYYPYMK-UHFFFAOYSA-N -1 1 340.738 4.186 20 0 EIADMM Cc1nc2cc(NC(=O)c3c(F)ccc([O-])c3F)c(C)cc2s1 ZINC001192539998 1051763433 /nfs/dbraw/zinc/76/34/33/1051763433.db2.gz PKAXDNMFRPFGBZ-UHFFFAOYSA-N -1 1 334.347 4.149 20 0 EIADMM C[C@H](Cc1ccccc1)n1cccc1C(=O)Nc1ccc(F)cc1[O-] ZINC001183054801 1051778110 /nfs/dbraw/zinc/77/81/10/1051778110.db2.gz UJDOVJZVMFJDAT-CQSZACIVSA-N -1 1 338.382 4.389 20 0 EIADMM O=C(Nc1ncc(-c2ccccc2)s1)c1cc([O-])cc(F)c1F ZINC001192651342 1051780976 /nfs/dbraw/zinc/78/09/76/1051780976.db2.gz GQWRGBSFFZUSIF-UHFFFAOYSA-N -1 1 332.331 4.046 20 0 EIADMM C[C@@H](Cc1ccccc1)n1cccc1C(=O)Nc1c([O-])cccc1F ZINC000773524948 1051796918 /nfs/dbraw/zinc/79/69/18/1051796918.db2.gz WZXOYYGKIYBMMG-AWEZNQCLSA-N -1 1 338.382 4.389 20 0 EIADMM O=C(Nc1n[nH]c(-c2ccc([O-])c(Cl)c2)n1)C1CCCCCCC1 ZINC001183250289 1051815731 /nfs/dbraw/zinc/81/57/31/1051815731.db2.gz CGJOHQGEHQSWJJ-UHFFFAOYSA-N -1 1 348.834 4.130 20 0 EIADMM O=C(Nc1nc(-c2ccc([O-])c(Cl)c2)n[nH]1)C1CCCCCCC1 ZINC001183250289 1051815739 /nfs/dbraw/zinc/81/57/39/1051815739.db2.gz CGJOHQGEHQSWJJ-UHFFFAOYSA-N -1 1 348.834 4.130 20 0 EIADMM O=C(Nc1ccc([C@@H](F)C(F)(F)F)cc1)c1ccc([O-])cc1F ZINC001175874971 1051831922 /nfs/dbraw/zinc/83/19/22/1051831922.db2.gz YJTZYUZDLXTDED-CYBMUJFWSA-N -1 1 331.240 4.357 20 0 EIADMM [O-]c1cc(Br)cnc1CNc1ccc(F)c(C(F)F)c1 ZINC001183419198 1051839619 /nfs/dbraw/zinc/83/96/19/1051839619.db2.gz JADWOGHBCOBUGX-UHFFFAOYSA-N -1 1 347.134 4.239 20 0 EIADMM O=C(Nc1nc(-c2ccccc2)co1)c1ccc2ccccc2c1[O-] ZINC001183432785 1051843358 /nfs/dbraw/zinc/84/33/58/1051843358.db2.gz PHXYFKBXGWROAS-UHFFFAOYSA-N -1 1 330.343 4.453 20 0 EIADMM [O-]c1ccc(Cl)c(Nc2cccc(N3CCOCC3)c2)c1Cl ZINC001176018524 1051875914 /nfs/dbraw/zinc/87/59/14/1051875914.db2.gz ZLAYODXXASCBDJ-UHFFFAOYSA-N -1 1 339.222 4.279 20 0 EIADMM O=C([N-]CCCS[C@H]1CCc2c1cccc2Cl)C(F)(F)F ZINC000774679156 1051895362 /nfs/dbraw/zinc/89/53/62/1051895362.db2.gz DBDOCNKVTLICFM-LBPRGKRZSA-N -1 1 337.794 4.129 20 0 EIADMM COc1ccc([N-]S(=O)(=O)c2ccc(C)c3ccccc32)cc1F ZINC001193824615 1052004176 /nfs/dbraw/zinc/00/41/76/1052004176.db2.gz MILQOHYGOSEWCW-UHFFFAOYSA-N -1 1 345.395 4.097 20 0 EIADMM CCN(CC)C(=O)c1cc(F)cc(Nc2c([O-])cc(F)cc2F)c1 ZINC001176298357 1052005527 /nfs/dbraw/zinc/00/55/27/1052005527.db2.gz ULWNEQJSJHLYIR-UHFFFAOYSA-N -1 1 338.329 4.035 20 0 EIADMM CCN(CC)C(=O)c1cc(F)cc(Nc2cc(F)c([O-])cc2F)c1 ZINC001176304017 1052008691 /nfs/dbraw/zinc/00/86/91/1052008691.db2.gz KNHLWYBKMUDCMC-UHFFFAOYSA-N -1 1 338.329 4.035 20 0 EIADMM [O-]c1c(Cl)nccc1Nc1cccc2c1cnn2[C@H]1CCCCO1 ZINC001176315144 1052019122 /nfs/dbraw/zinc/01/91/22/1052019122.db2.gz REZPHFBXRONRID-OAHLLOKOSA-N -1 1 344.802 4.233 20 0 EIADMM COCc1cccc([N-]S(=O)(=O)c2ccc(C)c3ccccc32)c1 ZINC001193863152 1052019069 /nfs/dbraw/zinc/01/90/69/1052019069.db2.gz IMOZSLXVRXMCHL-UHFFFAOYSA-N -1 1 341.432 4.095 20 0 EIADMM CSc1nc(NC(=O)Nc2c(C)cccc2C(C)(C)C)cc(=O)[n-]1 ZINC001184583450 1052049169 /nfs/dbraw/zinc/04/91/69/1052049169.db2.gz YCAWZNVEHSMRGJ-UHFFFAOYSA-N -1 1 346.456 4.154 20 0 EIADMM O=C([O-])C[C@H](NCc1ccc(-c2ccccc2)o1)c1cccs1 ZINC000671162003 1052057906 /nfs/dbraw/zinc/05/79/06/1052057906.db2.gz DXKOHEZPCHHJDM-HNNXBMFYSA-N -1 1 327.405 4.314 20 0 EIADMM COc1cccc([N-]S(=O)(=O)c2ccc3c(Cl)cccc3c2)c1 ZINC001194216493 1052108114 /nfs/dbraw/zinc/10/81/14/1052108114.db2.gz ZXPRVFHWKBMVSE-UHFFFAOYSA-N -1 1 347.823 4.303 20 0 EIADMM COc1cc(Nc2c(F)cc(F)c([O-])c2F)c(Cl)c(OC)c1 ZINC001176670393 1052157861 /nfs/dbraw/zinc/15/78/61/1052157861.db2.gz GHXFDKCLNFUCJS-UHFFFAOYSA-N -1 1 333.693 4.224 20 0 EIADMM [O-]c1c(F)cc(F)c(Nc2nc(F)c(F)c(Cl)c2F)c1F ZINC001176670459 1052158277 /nfs/dbraw/zinc/15/82/77/1052158277.db2.gz VHTUKKRHEYUSCX-UHFFFAOYSA-N -1 1 328.599 4.019 20 0 EIADMM CCOC(=O)c1cc(Nc2c(F)cc(F)c([O-])c2F)ccc1Cl ZINC001176673114 1052159411 /nfs/dbraw/zinc/15/94/11/1052159411.db2.gz PLECFYOXQXCMAK-UHFFFAOYSA-N -1 1 345.704 4.383 20 0 EIADMM CCOC(=O)c1cccc(Nc2c(F)cc(F)c([O-])c2F)c1C ZINC001176671934 1052160002 /nfs/dbraw/zinc/16/00/02/1052160002.db2.gz AMUNBRCOYYIVPU-UHFFFAOYSA-N -1 1 325.286 4.038 20 0 EIADMM [O-]c1c(F)cc(F)c(Nc2nc3ccccc3nc2Cl)c1F ZINC001176663136 1052172759 /nfs/dbraw/zinc/17/27/59/1052172759.db2.gz BYPTUNQSMZMDDJ-UHFFFAOYSA-N -1 1 325.677 4.150 20 0 EIADMM COc1cc([N-]S(=O)(=O)c2c(C)cccc2C)cc2ccccc21 ZINC001194643243 1052185768 /nfs/dbraw/zinc/18/57/68/1052185768.db2.gz RMTXBPYVQPIIDN-UHFFFAOYSA-N -1 1 341.432 4.266 20 0 EIADMM Cc1cc(C)c([N-]S(=O)(=O)c2ccc(-c3cnco3)cc2)c(C)c1 ZINC001185227083 1052198454 /nfs/dbraw/zinc/19/84/54/1052198454.db2.gz GQUNKRAENZDIFJ-UHFFFAOYSA-N -1 1 342.420 4.068 20 0 EIADMM O=S(=O)([N-]c1cccc(C2CC2)c1)c1ccc(-c2cnco2)cc1 ZINC001185230216 1052199680 /nfs/dbraw/zinc/19/96/80/1052199680.db2.gz WRSOMXIDSYPRAK-UHFFFAOYSA-N -1 1 340.404 4.020 20 0 EIADMM O=C(NCc1ccc(C(F)(F)F)s1)c1c([O-])cccc1Cl ZINC001176910520 1052209228 /nfs/dbraw/zinc/20/92/28/1052209228.db2.gz RZJHDLPNGPXOHN-UHFFFAOYSA-N -1 1 335.734 4.056 20 0 EIADMM CCc1ccc(C(=O)N(CC(C)C)c2ccc(OC)cc2)c([O-])c1 ZINC000622334941 1052212717 /nfs/dbraw/zinc/21/27/17/1052212717.db2.gz IRMPQPMVQSPKGO-UHFFFAOYSA-N -1 1 327.424 4.266 20 0 EIADMM CC(C)(C)C[C@@H]1CCCN1C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000622337009 1052214782 /nfs/dbraw/zinc/21/47/82/1052214782.db2.gz JRKOJYUIUFPFDQ-LBPRGKRZSA-N -1 1 329.362 4.452 20 0 EIADMM O=C(NCc1ccc([O-])c(Cl)c1)c1nc2ccccc2cc1Cl ZINC001176993598 1052215143 /nfs/dbraw/zinc/21/51/43/1052215143.db2.gz FYTOJGITCZIMHD-UHFFFAOYSA-N -1 1 347.201 4.177 20 0 EIADMM O=S(=O)([N-]c1cccc(O)c1Cl)c1cc2ccccc2s1 ZINC001185459370 1052243490 /nfs/dbraw/zinc/24/34/90/1052243490.db2.gz FQWMPWHPVKPKKI-UHFFFAOYSA-N -1 1 339.825 4.061 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2cccc3ccc(O)cc32)ccc1Cl ZINC001185524213 1052255465 /nfs/dbraw/zinc/25/54/65/1052255465.db2.gz DTRJGLPZCNVEII-UHFFFAOYSA-N -1 1 347.823 4.308 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2cc(F)c(C)c(F)c2)ccc1Cl ZINC001185530279 1052257957 /nfs/dbraw/zinc/25/79/57/1052257957.db2.gz WZHLYVASJXPGRN-UHFFFAOYSA-N -1 1 331.771 4.036 20 0 EIADMM COc1ccc(CNC(=O)Nc2cc(Cl)c(Cl)cc2[O-])cc1 ZINC001185546360 1052265740 /nfs/dbraw/zinc/26/57/40/1052265740.db2.gz OMFBUJPXMMKJKX-UHFFFAOYSA-N -1 1 341.194 4.029 20 0 EIADMM Cc1ccc(CN(C)C(=O)c2ccc(C(F)(F)F)cc2[O-])cc1C ZINC000622671211 1052383343 /nfs/dbraw/zinc/38/33/43/1052383343.db2.gz DLHOGZGSRQQJJV-UHFFFAOYSA-N -1 1 337.341 4.300 20 0 EIADMM CCC(C)(C)CC(=O)N1CCC[C@@H](c2n[n-]c(=S)n2C(C)C)C1 ZINC000073093120 1052698463 /nfs/dbraw/zinc/69/84/63/1052698463.db2.gz AYWRNNGXSHOJSC-CYBMUJFWSA-N -1 1 338.521 4.054 20 0 EIADMM C[C@H](c1cccc2ccccc21)N(C)C(=O)c1cc([O-])cnc1Cl ZINC001195309279 1053375402 /nfs/dbraw/zinc/37/54/02/1053375402.db2.gz QGCADGNMPAAAOT-GFCCVEGCSA-N -1 1 340.810 4.427 20 0 EIADMM CCOC(=O)NC(=S)[N-]c1ccc(Oc2cccc(F)c2)cc1 ZINC001195490036 1053421978 /nfs/dbraw/zinc/42/19/78/1053421978.db2.gz AUYKKLVSGOQZBS-UHFFFAOYSA-N -1 1 334.372 4.061 20 0 EIADMM CCCc1nc(C)c([N-]S(=O)(=O)C2=Cc3ccccc3CC2)s1 ZINC000776744747 1053819753 /nfs/dbraw/zinc/81/97/53/1053819753.db2.gz UJNXXQYLVNWKFI-UHFFFAOYSA-N -1 1 348.493 4.133 20 0 EIADMM O=C(Nc1nc(-c2ccc[nH]2)cs1)c1cc2ccccc2cc1[O-] ZINC000029351633 1054003503 /nfs/dbraw/zinc/00/35/03/1054003503.db2.gz HSFALEQKIXXUGU-UHFFFAOYSA-N -1 1 335.388 4.249 20 0 EIADMM C[C@@H](OC(=O)Cc1ccc([O-])c(Cl)c1)c1ncc(C(C)(C)C)o1 ZINC000869736982 1054028626 /nfs/dbraw/zinc/02/86/26/1054028626.db2.gz XQGGJIVWZSICTB-SNVBAGLBSA-N -1 1 337.803 4.178 20 0 EIADMM [O-]c1cc(F)ccc1NC(=S)Nc1ccccc1OC(F)(F)F ZINC001198163194 1054087971 /nfs/dbraw/zinc/08/79/71/1054087971.db2.gz NDNUOHFQBOWHMZ-UHFFFAOYSA-N -1 1 346.305 4.239 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1CCC[C@@H](OC2CCC2)CC1 ZINC000871333510 1054199555 /nfs/dbraw/zinc/19/95/55/1054199555.db2.gz JXMLTOWXUGHUJL-GOSISDBHSA-N -1 1 339.435 4.109 20 0 EIADMM Cc1ccc2nc(-c3cccc(NC(=O)C(C)C)c3)[n-]c(=O)c2c1C ZINC000871602113 1054225262 /nfs/dbraw/zinc/22/52/62/1054225262.db2.gz VOFGTOVZFJMZRR-UHFFFAOYSA-N -1 1 335.407 4.214 20 0 EIADMM O=S(=O)([N-]c1ccc2ccc(O)cc2c1)c1ccc2occc2c1 ZINC001198861830 1054288535 /nfs/dbraw/zinc/28/85/35/1054288535.db2.gz LJGDYELNCVVEEE-UHFFFAOYSA-N -1 1 339.372 4.092 20 0 EIADMM CC(C)c1ncsc1NC(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000857526764 1054298212 /nfs/dbraw/zinc/29/82/12/1054298212.db2.gz IFMXQGGSYUCMJH-UHFFFAOYSA-N -1 1 330.331 4.243 20 0 EIADMM Cc1cc(Br)c([O-])c(NC(=O)C2C[C@H](C)C[C@@H](C)C2)c1 ZINC001152518510 1054317023 /nfs/dbraw/zinc/31/70/23/1054317023.db2.gz SJIZJBXJLNZSKV-NXEZZACHSA-N -1 1 340.261 4.474 20 0 EIADMM CC(C)n1cc2c(n1)[C@@H]([N-]c1nc(-c3ccc(F)cc3)no1)CCC2 ZINC000858475642 1054496889 /nfs/dbraw/zinc/49/68/89/1054496889.db2.gz DQUZHRUXAKBYIX-HNNXBMFYSA-N -1 1 341.390 4.143 20 0 EIADMM Nc1nonc1[N-]c1ccc2cc(OCc3ccccc3)ccc2c1 ZINC001201233173 1054724507 /nfs/dbraw/zinc/72/45/07/1054724507.db2.gz YRMLBBVCKVELLR-UHFFFAOYSA-N -1 1 332.363 4.128 20 0 EIADMM Cc1ccc(NC(=O)Cc2ccc([O-])c(Cl)c2)cc1N1CCCC1 ZINC000874942921 1054744853 /nfs/dbraw/zinc/74/48/53/1054744853.db2.gz XCDDUPJBFDJLLP-UHFFFAOYSA-N -1 1 344.842 4.135 20 0 EIADMM COc1cc(OC(F)(F)F)ccc1Nc1cc(F)c([O-])cc1F ZINC001201359920 1054758716 /nfs/dbraw/zinc/75/87/16/1054758716.db2.gz CUPVFDHZUVAJMM-UHFFFAOYSA-N -1 1 335.228 4.321 20 0 EIADMM [O-]c1c(Cl)cc(Cl)cc1Nc1cnn(Cc2ccccn2)c1 ZINC001201419682 1054792235 /nfs/dbraw/zinc/79/22/35/1054792235.db2.gz NBIHATMHPKRVOO-UHFFFAOYSA-N -1 1 335.194 4.082 20 0 EIADMM Cc1ccc([C@@H](C)N(C)C(=O)NCc2ccc([O-])c(Cl)c2)cc1 ZINC000876392633 1054892592 /nfs/dbraw/zinc/89/25/92/1054892592.db2.gz ACMCFYIUQTVWLK-CYBMUJFWSA-N -1 1 332.831 4.257 20 0 EIADMM CC(C)c1csc2[n-]c([C@@H]3COc4ccccc4O3)nc(=O)c12 ZINC000429552570 1055130692 /nfs/dbraw/zinc/13/06/92/1055130692.db2.gz YJPWFKXRIIZVQM-ZDUSSCGKSA-N -1 1 328.393 4.033 20 0 EIADMM O=C(c1cc(Cl)ccc1[O-])N1CC(Cc2ccc(Cl)cc2)C1 ZINC001137128509 1055189948 /nfs/dbraw/zinc/18/99/48/1055189948.db2.gz OXUMMXKONNKAMX-UHFFFAOYSA-N -1 1 336.218 4.014 20 0 EIADMM CCCCCc1nnc([N-]C(=O)c2coc(-c3ccccc3)n2)s1 ZINC000303848172 1056323474 /nfs/dbraw/zinc/32/34/74/1056323474.db2.gz MZKQKTKKYGFWAC-UHFFFAOYSA-N -1 1 342.424 4.178 20 0 EIADMM C/C=C\C[C@@H]1CCCN(c2ccc(-c3nc(C)c(C)c(=O)[n-]3)cn2)C1 ZINC000624778139 1056504736 /nfs/dbraw/zinc/50/47/36/1056504736.db2.gz KCVXLRZRJJJVFG-YIEVGGLXSA-N -1 1 338.455 4.044 20 0 EIADMM CSc1ccccc1[N-]S(=O)(=O)c1ccc(F)c(Cl)c1 ZINC000007056645 1056763215 /nfs/dbraw/zinc/76/32/15/1056763215.db2.gz NRXYKHXXSLINMI-UHFFFAOYSA-N -1 1 331.821 4.002 20 0 EIADMM Cc1ccc(/C=C/S(=O)(=O)[N-]c2cc(Cl)c(Cl)cn2)cc1 ZINC000743048446 1058849239 /nfs/dbraw/zinc/84/92/39/1058849239.db2.gz PLTNLMSQMGPQTB-VOTSOKGWSA-N -1 1 343.235 4.109 20 0 EIADMM C[C@@H]1CN(C(=O)c2c([O-])cccc2Cl)CC[C@H]1c1ccccc1 ZINC000743703802 1059079283 /nfs/dbraw/zinc/07/92/83/1059079283.db2.gz YPTIHBFEYRRCET-UKRRQHHQSA-N -1 1 329.827 4.311 20 0 EIADMM CC(=O)c1ccc([O-])c(CCOC(=O)C[C@H](C)c2ccc(F)cc2)c1 ZINC000745022501 1059702594 /nfs/dbraw/zinc/70/25/94/1059702594.db2.gz MHBLVRPWHUJETO-ZDUSSCGKSA-N -1 1 344.382 4.013 20 0 EIADMM CCCOc1ccc(NC(=O)Cc2ccc([O-])c(Cl)c2)cc1F ZINC001169561463 1060857569 /nfs/dbraw/zinc/85/75/69/1060857569.db2.gz SFIUBIOMXIGBAC-UHFFFAOYSA-N -1 1 337.778 4.155 20 0 EIADMM O=C(c1c([O-])cccc1Cl)N1C[C@H](c2ccccc2)[C@@H]2CCC[C@H]21 ZINC000804347612 1061135502 /nfs/dbraw/zinc/13/55/02/1061135502.db2.gz IBJLWCKHRYCJNJ-ZMSDIMECSA-N -1 1 341.838 4.454 20 0 EIADMM O=C(Nc1ccc(Cl)cc1[O-])Nc1ccccc1Br ZINC000028380349 202170094 /nfs/dbraw/zinc/17/00/94/202170094.db2.gz WJRWPWNJOYEARK-UHFFFAOYSA-N -1 1 341.592 4.452 20 0 EIADMM O=C(Cc1coc(-c2ccc(Cl)cc2)n1)Nc1ccc(F)cc1[O-] ZINC000532266681 1032125799 /nfs/dbraw/zinc/12/57/99/1032125799.db2.gz QBTAYARMXXBIRH-UHFFFAOYSA-N -1 1 346.745 4.021 20 0 EIADMM CC(C)CC1(C(=O)N2CCC(C(=O)c3ccc([O-])cc3)CC2)CCC1 ZINC000120297307 1032201708 /nfs/dbraw/zinc/20/17/08/1032201708.db2.gz RASIIEMWAUBHQG-UHFFFAOYSA-N -1 1 343.467 4.030 20 0 EIADMM C[C@@H]1C(=O)CC[C@@H]1CC(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000529538379 1032443404 /nfs/dbraw/zinc/44/34/04/1032443404.db2.gz BLFXUOJNQKYQKM-WDEREUQCSA-N -1 1 331.799 4.143 20 0 EIADMM C[C@@H]1CC[C@@H](CCC(=O)Nc2cc(Cl)c([O-])c3ccccc23)O1 ZINC000529538527 1032444219 /nfs/dbraw/zinc/44/42/19/1032444219.db2.gz CSAGCNDPAQOOLC-NEPJUHHUSA-N -1 1 333.815 4.485 20 0 EIADMM Cc1ccc(NCc2cccc([O-])c2Cl)cc1NC(=O)N(C)C ZINC000339384921 1018829664 /nfs/dbraw/zinc/82/96/64/1018829664.db2.gz LAYFNEBRCBJDJU-UHFFFAOYSA-N -1 1 333.819 4.060 20 0 EIADMM C[N@@H+](Cc1nnc(-c2ccccc2O)o1)Cc1cccc2ccccc21 ZINC001167049563 1018863642 /nfs/dbraw/zinc/86/36/42/1018863642.db2.gz PVBQFOYBFUDVBI-UHFFFAOYSA-N -1 1 345.402 4.227 20 0 EIADMM C[C@@H](c1ccccc1Cl)N(C)CCOc1cccc(C(=O)[O-])c1 ZINC000320462784 1018896061 /nfs/dbraw/zinc/89/60/61/1018896061.db2.gz PGOFEFBPLWVCAC-ZDUSSCGKSA-N -1 1 333.815 4.110 20 0 EIADMM CC(C)c1ccc([C@@H](CC(=O)[O-])NCc2nc3c(s2)CCC3)cc1 ZINC000683172178 1019090437 /nfs/dbraw/zinc/09/04/37/1019090437.db2.gz ALPLIYMHBJYJHZ-MRXNPFEDSA-N -1 1 344.480 4.061 20 0 EIADMM COc1ccc(-c2noc(-c3ccc4ccccc4c3[O-])n2)cc1OC ZINC000109037371 1019362618 /nfs/dbraw/zinc/36/26/18/1019362618.db2.gz FAALIACOCYOHIU-UHFFFAOYSA-N -1 1 348.358 4.280 20 0 EIADMM O=S(=O)([N-]c1cc(Cl)ccc1Cl)c1ccc(F)cc1F ZINC000007402166 1020038765 /nfs/dbraw/zinc/03/87/65/1020038765.db2.gz XPRNPUJCGCEKFQ-UHFFFAOYSA-N -1 1 338.162 4.072 20 0 EIADMM Cc1ccc(C)c(S(=O)(=O)[N-]c2ccc3cnn(C(C)C)c3c2)c1 ZINC000509536013 1032883910 /nfs/dbraw/zinc/88/39/10/1032883910.db2.gz HISODNWXOXDQTB-UHFFFAOYSA-N -1 1 343.452 4.035 20 0 EIADMM CCCN(C(=O)c1ncc2ccccc2c1[O-])[C@H]1CCc2ccccc21 ZINC001625845243 1020269653 /nfs/dbraw/zinc/26/96/53/1020269653.db2.gz KTDRFJOUCMPUAA-IBGZPJMESA-N -1 1 346.430 4.480 20 0 EIADMM CC(C)CCc1nc(CN2CCC[C@@H](C(C)(C)C(=O)[O-])C2)cs1 ZINC000652499795 1020536909 /nfs/dbraw/zinc/53/69/09/1020536909.db2.gz MOIJSUWSIZLKJU-CQSZACIVSA-N -1 1 338.517 4.055 20 0 EIADMM O=C(c1c([O-])cccc1Cl)N(Cc1ccccc1F)CC1CC1 ZINC001167246324 1020663888 /nfs/dbraw/zinc/66/38/88/1020663888.db2.gz KWRIFSGYPBWIMD-UHFFFAOYSA-N -1 1 333.790 4.237 20 0 EIADMM CCOc1cc(-c2noc([C@H](C)OCC(C)C)n2)cc(Cl)c1[O-] ZINC000683589346 1020943753 /nfs/dbraw/zinc/94/37/53/1020943753.db2.gz MXNDFTMFCSMEIV-JTQLQIEISA-N -1 1 340.807 4.228 20 0 EIADMM CC(C)Oc1ncc(-c2nc(-c3ccc([O-])c(F)c3)no2)cc1Cl ZINC000683593513 1020949338 /nfs/dbraw/zinc/94/93/38/1020949338.db2.gz MACWXRUBFCYYDC-UHFFFAOYSA-N -1 1 349.749 4.084 20 0 EIADMM COc1cccc2cc(-c3nc(-c4ccc([O-])c(F)c4)no3)oc21 ZINC000683594305 1020951999 /nfs/dbraw/zinc/95/19/99/1020951999.db2.gz WANCOGAQSRGTLX-UHFFFAOYSA-N -1 1 326.283 4.003 20 0 EIADMM COc1ccc(C(=O)N2Cc3ccccc3-c3ccccc32)c([O-])c1 ZINC000612666415 1021265540 /nfs/dbraw/zinc/26/55/40/1021265540.db2.gz VNOGKCPYGBESED-UHFFFAOYSA-N -1 1 331.371 4.228 20 0 EIADMM O=C(c1ccc([O-])cc1)C1CCN(Cc2sccc2Cl)CC1 ZINC000683824655 1021720128 /nfs/dbraw/zinc/72/01/28/1021720128.db2.gz DCUAOBPFASSTHG-UHFFFAOYSA-N -1 1 335.856 4.202 20 0 EIADMM Cc1oc(-c2cccs2)nc1C[N@H+]1CCC[C@@H](C(C)(C)C(=O)[O-])C1 ZINC000325460258 1021762292 /nfs/dbraw/zinc/76/22/92/1021762292.db2.gz RBFBTJLZTSEACX-CYBMUJFWSA-N -1 1 348.468 4.034 20 0 EIADMM CCCCc1ccc([N-]S(=O)(=O)c2cccc(C(C)=O)c2)cc1 ZINC000007055353 1022025273 /nfs/dbraw/zinc/02/52/73/1022025273.db2.gz SHMCAJXFEIYUBO-UHFFFAOYSA-N -1 1 331.437 4.033 20 0 EIADMM O=C([N-]c1nc(C2CC2)no1)c1c(Cl)ccc(Cl)c1Cl ZINC000891289787 1022112491 /nfs/dbraw/zinc/11/24/91/1022112491.db2.gz GEMSVFIXCPCYQD-UHFFFAOYSA-N -1 1 332.574 4.160 20 0 EIADMM Cc1c(=O)[n-]c(S[C@H]2C[C@H](C)CCC2=O)nc1-c1ccccc1 ZINC000580517258 1022145026 /nfs/dbraw/zinc/14/50/26/1022145026.db2.gz NBKUAEADLMWOCE-ABAIWWIYSA-N -1 1 328.437 4.007 20 0 EIADMM CCc1nc(SCc2coc(-c3ccc(C)cc3)n2)[n-]c(=O)c1C ZINC000580572320 1022220247 /nfs/dbraw/zinc/22/02/47/1022220247.db2.gz SCXGGTPULWRIOP-UHFFFAOYSA-N -1 1 341.436 4.309 20 0 EIADMM CSc1cccc([N-]S(=O)(=O)c2ccc3ncccc3c2)c1C ZINC000340788223 1022475443 /nfs/dbraw/zinc/47/54/43/1022475443.db2.gz FKMJTJGXFNYPJM-UHFFFAOYSA-N -1 1 344.461 4.066 20 0 EIADMM CC(=O)c1csc(C(=O)[N-]c2nc(-c3ccc(C)s3)ns2)c1 ZINC000106647646 1022482927 /nfs/dbraw/zinc/48/29/27/1022482927.db2.gz PLNXOWKWABQVNC-UHFFFAOYSA-N -1 1 349.462 4.091 20 0 EIADMM CSc1ccc(Cl)c(C(=O)N=c2cc(-c3cccs3)[n-][nH]2)c1 ZINC000549678655 1033059969 /nfs/dbraw/zinc/05/99/69/1033059969.db2.gz NNFVFHWFFKUGKE-UHFFFAOYSA-N -1 1 349.868 4.188 20 0 EIADMM CCOc1cc(C(=O)Nc2cc(F)c(F)c(F)c2)cc(Cl)c1[O-] ZINC000186830644 1022763570 /nfs/dbraw/zinc/76/35/70/1022763570.db2.gz XXPGRZUIZQJFHT-UHFFFAOYSA-N -1 1 345.704 4.114 20 0 EIADMM Cc1ccc(C)c(OC2CCN(Cc3csc(C(=O)[O-])c3)CC2)c1 ZINC000581076835 1022823622 /nfs/dbraw/zinc/82/36/22/1022823622.db2.gz HGFVSVVGNWPYQI-UHFFFAOYSA-N -1 1 345.464 4.107 20 0 EIADMM COc1ccc([C@H]2CCCN2Cc2ccc(C(=O)[O-])c(F)c2)cc1F ZINC000659789451 1023270325 /nfs/dbraw/zinc/27/03/25/1023270325.db2.gz HZMPUHQXPRWNQR-QGZVFWFLSA-N -1 1 347.361 4.009 20 0 EIADMM O=C([O-])c1ccc2c(c1)CN(CCCc1ccc(C(F)(F)F)cc1)C2 ZINC000659790917 1023272383 /nfs/dbraw/zinc/27/23/83/1023272383.db2.gz RNJCIGGPENFZEX-UHFFFAOYSA-N -1 1 349.352 4.352 20 0 EIADMM Cc1cc(F)ccc1-c1ccc(CN[C@H](CC2CCC2)C(=O)[O-])o1 ZINC000417714431 1023415444 /nfs/dbraw/zinc/41/54/44/1023415444.db2.gz ZUOBKSXBLFHJME-QGZVFWFLSA-N -1 1 331.387 4.127 20 0 EIADMM CC(C)(C)c1nc(COC(=O)c2cccc3nc(C(F)F)[nH]c32)co1 ZINC000924085868 1023426552 /nfs/dbraw/zinc/42/65/52/1023426552.db2.gz VYWOTUAXSQQXQW-UHFFFAOYSA-N -1 1 349.337 4.143 20 0 EIADMM CN(C[C@@H]1CC=CCC1)C(=O)c1c([O-])cnc2ccc(Cl)cc21 ZINC000549191207 1023451747 /nfs/dbraw/zinc/45/17/47/1023451747.db2.gz LRNFTVBBVHJLGV-GFCCVEGCSA-N -1 1 330.815 4.022 20 0 EIADMM CCc1cccc(F)c1CN1CCC(C(=O)c2ccc(O)cc2)CC1 ZINC000684356279 1023477852 /nfs/dbraw/zinc/47/78/52/1023477852.db2.gz WFFRQJYEPNKQJI-UHFFFAOYSA-N -1 1 341.426 4.189 20 0 EIADMM COc1ccc(NCc2cccc([O-])c2Cl)cc1Br ZINC000328341904 1023558751 /nfs/dbraw/zinc/55/87/51/1023558751.db2.gz LLHIVRSGQQLWNA-UHFFFAOYSA-N -1 1 342.620 4.429 20 0 EIADMM Cc1ccc(Br)cc1-c1noc(-c2cc(F)ccc2[O-])n1 ZINC000314181907 1023573040 /nfs/dbraw/zinc/57/30/40/1023573040.db2.gz MVZDPNUJVYFQBJ-UHFFFAOYSA-N -1 1 349.159 4.319 20 0 EIADMM CC(C)CCOc1ccc(NC(=O)c2c(F)ccc([O-])c2F)cc1 ZINC000581851197 1023767037 /nfs/dbraw/zinc/76/70/37/1023767037.db2.gz BLJYCCZPAJXCFT-UHFFFAOYSA-N -1 1 335.350 4.348 20 0 EIADMM CC[C@@H](C)Oc1cccc([N-]S(=O)(=O)c2cccc(Cl)c2)c1 ZINC000511727649 1023839198 /nfs/dbraw/zinc/83/91/98/1023839198.db2.gz BYGAMZIQMINGLF-GFCCVEGCSA-N -1 1 339.844 4.318 20 0 EIADMM CC[C@H](C)Oc1cccc([N-]S(=O)(=O)c2ccc(C)c(C)c2)c1 ZINC000511736978 1023843990 /nfs/dbraw/zinc/84/39/90/1023843990.db2.gz YEEPNOYJNBAJMV-HNNXBMFYSA-N -1 1 333.453 4.282 20 0 EIADMM CC(=O)c1ccc(Cl)c([N-]S(=O)(=O)c2cc(C)c(C)s2)c1 ZINC000432064869 1023845603 /nfs/dbraw/zinc/84/56/03/1023845603.db2.gz WZBBPFLLJDNUMZ-UHFFFAOYSA-N -1 1 343.857 4.022 20 0 EIADMM CCOc1cc(C(=O)Nc2ccccc2SC)cc(Cl)c1[O-] ZINC000193003645 1023969931 /nfs/dbraw/zinc/96/99/31/1023969931.db2.gz MYDGZQCSQPQKCD-UHFFFAOYSA-N -1 1 337.828 4.419 20 0 EIADMM COc1cc(Cl)c([N-]S(=O)(=O)c2sc(C)cc2C)cc1C ZINC000431136624 1024678785 /nfs/dbraw/zinc/67/87/85/1024678785.db2.gz BXOAHSKQUWWSNN-UHFFFAOYSA-N -1 1 345.873 4.136 20 0 EIADMM CCN(C(=O)c1cncc([O-])c1)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000111585246 1024719989 /nfs/dbraw/zinc/71/99/89/1024719989.db2.gz OBKZYRVWDLSEQA-LLVKDONJSA-N -1 1 338.329 4.029 20 0 EIADMM CC(C)CCN(Cc1c(Br)cccc1C(=O)[O-])C1CC1 ZINC000652394167 1024805108 /nfs/dbraw/zinc/80/51/08/1024805108.db2.gz JRURNWMYKQMOGR-UHFFFAOYSA-N -1 1 340.261 4.158 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N1CCCCC[C@H]1[C@H]1CCCCC1=O ZINC000092429909 1024807044 /nfs/dbraw/zinc/80/70/44/1024807044.db2.gz YQNZSAIMAVGEAL-ZBFHGGJFSA-N -1 1 349.858 4.190 20 0 EIADMM O=C1c2ccc([O-])cc2CC/C1=C\c1ccc(Br)cc1 ZINC000060340069 1024954504 /nfs/dbraw/zinc/95/45/04/1024954504.db2.gz BCPPBPLRTBDNJU-UKTHLTGXSA-N -1 1 329.193 4.367 20 0 EIADMM O=C([O-])C[C@H]1CCCCN1Cc1ccc(Cl)c(C(F)(F)F)c1 ZINC000662214424 1024964654 /nfs/dbraw/zinc/96/46/54/1024964654.db2.gz MHHWZESHGKLNCB-LLVKDONJSA-N -1 1 335.753 4.188 20 0 EIADMM CCc1ccc(S(=O)(=O)[N-]c2ccccc2N2CCCCC2)cc1 ZINC000008109137 1025207605 /nfs/dbraw/zinc/20/76/05/1025207605.db2.gz PIKDBYDQHDPNIS-UHFFFAOYSA-N -1 1 344.480 4.040 20 0 EIADMM [O-]c1ccc(-c2noc(-c3ccnc(Oc4ccccc4)c3)n2)c(F)c1 ZINC000519520029 1025875999 /nfs/dbraw/zinc/87/59/99/1025875999.db2.gz JWJWWJOAOHWEPT-UHFFFAOYSA-N -1 1 349.321 4.436 20 0 EIADMM O=S(=O)([N-]c1cc(C2CCCC2)n[nH]1)c1csc2ccccc12 ZINC000506845121 1025999377 /nfs/dbraw/zinc/99/93/77/1025999377.db2.gz BANUMIAFFJZJFN-UHFFFAOYSA-N -1 1 347.465 4.083 20 0 EIADMM CC[C@H](C)[C@H](NCc1ccc(-c2nc3ccccc3s2)o1)C(=O)[O-] ZINC000277441520 1026031693 /nfs/dbraw/zinc/03/16/93/1026031693.db2.gz UORKWULMHGJGCN-ZBEGNZNMSA-N -1 1 344.436 4.145 20 0 EIADMM O=C([O-])CC[C@@H]1CCCN(Cc2ncc(-c3ccc(Cl)cc3)o2)C1 ZINC000324570754 1026059905 /nfs/dbraw/zinc/05/99/05/1026059905.db2.gz CLVMTBARIDYDRF-ZDUSSCGKSA-N -1 1 348.830 4.072 20 0 EIADMM O=C([O-])C1CCN([C@@H](c2ccc(F)cc2)c2ccc(Cl)cc2)CC1 ZINC000006528013 1026121112 /nfs/dbraw/zinc/12/11/12/1026121112.db2.gz FNTCLIBXEWCZBJ-GOSISDBHSA-N -1 1 347.817 4.365 20 0 EIADMM CSc1ccc(Cl)cc1[N-]S(=O)(=O)c1ccc(F)cc1 ZINC000049306721 1026162403 /nfs/dbraw/zinc/16/24/03/1026162403.db2.gz UOLIMBSIALZJEM-UHFFFAOYSA-N -1 1 331.821 4.002 20 0 EIADMM COc1ccc(-c2csc3[n-]c(-c4cscn4)nc(=O)c23)cc1 ZINC000432503703 1026207903 /nfs/dbraw/zinc/20/79/03/1026207903.db2.gz XOTHKJOAQLLDSW-UHFFFAOYSA-N -1 1 341.417 4.196 20 0 EIADMM CCOc1ccccc1OCCCC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000111668150 1026314397 /nfs/dbraw/zinc/31/43/97/1026314397.db2.gz DFDCEEHVGFETDP-UHFFFAOYSA-N -1 1 349.814 4.242 20 0 EIADMM Cc1c(=O)[n-]c(S[C@H]2CCOC(C)(C)C2)nc1-c1ccccc1 ZINC000582347204 1026480920 /nfs/dbraw/zinc/48/09/20/1026480920.db2.gz NYKVLUIOSOIBBS-AWEZNQCLSA-N -1 1 330.453 4.207 20 0 EIADMM CO[C@@H](c1ccccc1Cl)[C@@H](C)[NH2+]Cc1c(F)ccc(O)c1F ZINC000512216076 1026489386 /nfs/dbraw/zinc/48/93/86/1026489386.db2.gz ADUDVOGXVIOVFR-BMLIUANNSA-N -1 1 341.785 4.190 20 0 EIADMM COc1ccc([C@H](CCC(=O)[O-])NCc2ccsc2Cl)cc1 ZINC000426724318 1026505277 /nfs/dbraw/zinc/50/52/77/1026505277.db2.gz RHQNGOQALFBEND-AWEZNQCLSA-N -1 1 339.844 4.106 20 0 EIADMM Cc1ccc(CN[C@H](CC(=O)[O-])c2cc(Cl)cc(Cl)c2)nc1 ZINC000426754963 1026540139 /nfs/dbraw/zinc/54/01/39/1026540139.db2.gz VLZIWPQZUHPWMK-OAHLLOKOSA-N -1 1 339.222 4.002 20 0 EIADMM Cc1ccc([C@H](CC(=O)[O-])NCc2ccc(OCCC(C)C)cc2)o1 ZINC000426765322 1026557745 /nfs/dbraw/zinc/55/77/45/1026557745.db2.gz MMVQHERGAUBUPO-SFHVURJKSA-N -1 1 345.439 4.319 20 0 EIADMM O=C([O-])C[C@H](NCc1ccc(Cl)cc1F)c1cccc(Cl)c1 ZINC000426796882 1026567949 /nfs/dbraw/zinc/56/79/49/1026567949.db2.gz DQGUSMUMVOCDCT-HNNXBMFYSA-N -1 1 342.197 4.438 20 0 EIADMM O=C([O-])C[C@@H](NCc1cc(Cl)ccc1F)c1cccc(Cl)c1 ZINC000426804248 1026570825 /nfs/dbraw/zinc/57/08/25/1026570825.db2.gz SOHYPIIIECYFCY-OAHLLOKOSA-N -1 1 342.197 4.438 20 0 EIADMM O=C([O-])[C@H](NCc1ccc(-c2ccc(F)cc2)s1)c1ccccc1 ZINC000426821213 1026580031 /nfs/dbraw/zinc/58/00/31/1026580031.db2.gz QXUTXKAAGQJTLG-GOSISDBHSA-N -1 1 341.407 4.470 20 0 EIADMM CCCc1cccc(CN[C@@H](CC(=O)[O-])c2ccc(F)cc2F)c1 ZINC000426825880 1026583758 /nfs/dbraw/zinc/58/37/58/1026583758.db2.gz CBXZCUBNVIRBOO-SFHVURJKSA-N -1 1 333.378 4.223 20 0 EIADMM CC(C)CCOc1ccc(CN[C@@H](C(=O)[O-])c2ccccc2F)cc1 ZINC000426837248 1026585928 /nfs/dbraw/zinc/58/59/28/1026585928.db2.gz XURAUTRJFKOQQL-LJQANCHMSA-N -1 1 345.414 4.166 20 0 EIADMM COC(=O)c1c[n-]c(S[C@H]2CCc3c2cc(Cl)cc3Cl)n1 ZINC000432664069 1026688421 /nfs/dbraw/zinc/68/84/21/1026688421.db2.gz DHASPCBWMYGRPA-LBPRGKRZSA-N -1 1 343.235 4.283 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1c[nH]cc1-c1ccccc1F ZINC000427048674 1026690636 /nfs/dbraw/zinc/69/06/36/1026690636.db2.gz HUVBJDXHCADXNU-UHFFFAOYSA-N -1 1 330.746 4.432 20 0 EIADMM COC(=O)c1c[n-]c(S[C@@H](Cc2ccccc2)c2ccccc2)n1 ZINC000432666161 1026699978 /nfs/dbraw/zinc/69/99/78/1026699978.db2.gz REXQENBKJFNMJF-KRWDZBQOSA-N -1 1 338.432 4.272 20 0 EIADMM CCO[C@H](C)c1ncc(C(=O)[N-]c2cccc(F)c2SC)s1 ZINC000617276130 1026706508 /nfs/dbraw/zinc/70/65/08/1026706508.db2.gz XEQNKHIGQKEETH-SECBINFHSA-N -1 1 340.445 4.354 20 0 EIADMM Cc1nc2ccc(S(=O)(=O)[N-]c3c(C)cccc3C)cc2s1 ZINC000427114936 1026725017 /nfs/dbraw/zinc/72/50/17/1026725017.db2.gz PXLRMEQEHXOKLH-UHFFFAOYSA-N -1 1 332.450 4.022 20 0 EIADMM Cc1nc2ccc(S(=O)(=O)[N-]c3c(C)cc(C)cc3C)cc2s1 ZINC000427120176 1026730152 /nfs/dbraw/zinc/73/01/52/1026730152.db2.gz QJSFIHLUVVVYRO-UHFFFAOYSA-N -1 1 346.477 4.331 20 0 EIADMM [O-]c1cccc(CN2CCn3cccc3[C@@H]2c2ccccc2)c1Cl ZINC000507296188 1026732353 /nfs/dbraw/zinc/73/23/53/1026732353.db2.gz UBHLZHLBIDRYLC-FQEVSTJZSA-N -1 1 338.838 4.452 20 0 EIADMM O=C(N[C@@H](c1cc2ccccc2o1)c1ccccc1)c1cncc([O-])c1 ZINC000548740675 1026741005 /nfs/dbraw/zinc/74/10/05/1026741005.db2.gz KTODZGOKPHADBT-HXUWFJFHSA-N -1 1 344.370 4.053 20 0 EIADMM CCCc1nnc([N-]C(=O)c2ncoc2-c2ccccc2Cl)s1 ZINC000152644666 1026746244 /nfs/dbraw/zinc/74/62/44/1026746244.db2.gz PCVSICVVIQWCLH-UHFFFAOYSA-N -1 1 348.815 4.051 20 0 EIADMM COc1c(Br)cc(F)cc1Nc1cc([O-])c(F)c(F)c1 ZINC001211715495 1026803036 /nfs/dbraw/zinc/80/30/36/1026803036.db2.gz ZLTIVADUETVKHN-UHFFFAOYSA-N -1 1 348.118 4.324 20 0 EIADMM CCOC(=O)c1cnc(C(C)=Cc2cccc(SCC)c2)[n-]c1=O ZINC000432704527 1026805968 /nfs/dbraw/zinc/80/59/68/1026805968.db2.gz OENHDLHPSNZPAM-XFXZXTDPSA-N -1 1 344.436 4.031 20 0 EIADMM CCC[C@@H](Cc1ccccc1)N(CCC)C(=O)c1cncc([O-])c1 ZINC000550298439 1026903198 /nfs/dbraw/zinc/90/31/98/1026903198.db2.gz BUKCZEDDUVGHQI-SFHVURJKSA-N -1 1 326.440 4.051 20 0 EIADMM CCc1nc(S[C@H](C)Cc2ccc3ccccc3n2)[n-]c(=O)c1C ZINC000563438863 1026951944 /nfs/dbraw/zinc/95/19/44/1026951944.db2.gz JBCKDNZULDWXKL-GFCCVEGCSA-N -1 1 339.464 4.325 20 0 EIADMM O=C([O-])C[C@H]1CCCN(Cc2ccc(Cl)c(C(F)(F)F)c2)C1 ZINC000519810420 1027003659 /nfs/dbraw/zinc/00/36/59/1027003659.db2.gz DPGLSCLFOOVVEH-SNVBAGLBSA-N -1 1 335.753 4.046 20 0 EIADMM COC[C@H]([N-]c1nc(-c2cccc(Cl)c2)no1)c1ccccc1 ZINC000301926423 1027152051 /nfs/dbraw/zinc/15/20/51/1027152051.db2.gz HJRTUHMCJHLVOU-HNNXBMFYSA-N -1 1 329.787 4.190 20 0 EIADMM CCCc1cc(=O)[n-]c(SCc2ncc(-c3cccs3)o2)n1 ZINC000520224303 1027348982 /nfs/dbraw/zinc/34/89/82/1027348982.db2.gz ZBBPRWOMZXMMTH-UHFFFAOYSA-N -1 1 333.438 4.144 20 0 EIADMM C[C@H]([N-]c1nc(C2CCOCC2)no1)c1cc2cccc(F)c2o1 ZINC000665714150 1027402303 /nfs/dbraw/zinc/40/23/03/1027402303.db2.gz AHQQJXOVDVIMKO-JTQLQIEISA-N -1 1 331.347 4.022 20 0 EIADMM O=C([N-]c1nnc(CC2CCCCC2)s1)c1c(F)cccc1F ZINC000103420961 1027468904 /nfs/dbraw/zinc/46/89/04/1027468904.db2.gz KGEIYFYUGKSADO-UHFFFAOYSA-N -1 1 337.395 4.191 20 0 EIADMM O=C([N-]c1nnc(C(F)F)s1)c1c(Cl)cc(F)cc1Cl ZINC000431498501 1027499307 /nfs/dbraw/zinc/49/93/07/1027499307.db2.gz XAJXOZSKEBEUHI-UHFFFAOYSA-N -1 1 342.129 4.174 20 0 EIADMM CCc1ccccc1[N-]S(=O)(=O)c1ccc(OC)c2ccccc21 ZINC000614753521 1027531879 /nfs/dbraw/zinc/53/18/79/1027531879.db2.gz ZFFCPQQERNWMJJ-UHFFFAOYSA-N -1 1 341.432 4.212 20 0 EIADMM CCOc1ccc(CN(C)C(=O)c2cc3ccccc3cc2[O-])cc1 ZINC000018073990 1027622619 /nfs/dbraw/zinc/62/26/19/1027622619.db2.gz RJXVIOMSIHXFRG-UHFFFAOYSA-N -1 1 335.403 4.216 20 0 EIADMM Cc1c(NC(=O)c2cc3ccccc3cc2[O-])cnn1C1CCCC1 ZINC000444443205 1027752349 /nfs/dbraw/zinc/75/23/49/1027752349.db2.gz MIICGULMPHGDEW-UHFFFAOYSA-N -1 1 335.407 4.418 20 0 EIADMM COc1cc(C(=O)N([C@@H](C)c2ccco2)C2CC2)cc(Cl)c1[O-] ZINC000153646255 1027824218 /nfs/dbraw/zinc/82/42/18/1027824218.db2.gz PBKWGANKOAMKEO-JTQLQIEISA-N -1 1 335.787 4.013 20 0 EIADMM CCCN(CC1CCCCC1)C(=O)c1c(C)nc(C(C)C)[n-]c1=O ZINC000843771841 1028016947 /nfs/dbraw/zinc/01/69/47/1028016947.db2.gz PKASVOMQOHSUNJ-UHFFFAOYSA-N -1 1 333.476 4.047 20 0 EIADMM CCOc1cc(-c2noc(COc3ccccc3)n2)cc(Cl)c1[O-] ZINC000445429657 1028527894 /nfs/dbraw/zinc/52/78/94/1028527894.db2.gz BDOWLAZRFURSSS-UHFFFAOYSA-N -1 1 346.770 4.073 20 0 EIADMM [O-]c1ccc(-c2noc(-c3ccc(OC(F)F)cc3)n2)c(Cl)c1 ZINC000445450632 1028541854 /nfs/dbraw/zinc/54/18/54/1028541854.db2.gz ZMWBCMFOHOYQDL-UHFFFAOYSA-N -1 1 338.697 4.364 20 0 EIADMM CCSc1cc(-c2nc(-c3ccc([O-])cc3Cl)no2)ccn1 ZINC000445450927 1028543082 /nfs/dbraw/zinc/54/30/82/1028543082.db2.gz YKVSAYGKWSKGRC-UHFFFAOYSA-N -1 1 333.800 4.270 20 0 EIADMM CCC(=O)Nc1cccc(-c2nc(-c3ccc([O-])cc3Cl)no2)c1 ZINC000445442771 1028564364 /nfs/dbraw/zinc/56/43/64/1028564364.db2.gz AETGQGUMABSGPT-UHFFFAOYSA-N -1 1 343.770 4.111 20 0 EIADMM COc1cccc([C@@H]2C[C@@H]2c2nc(-c3ccc([O-])cc3Cl)no2)c1 ZINC000445443172 1028568341 /nfs/dbraw/zinc/56/83/41/1028568341.db2.gz FQJGLGOVRTUIKY-GJZGRUSLSA-N -1 1 342.782 4.375 20 0 EIADMM [O-]c1ccc(-c2noc(CCc3ccc(F)cc3F)n2)c(Cl)c1 ZINC000445446545 1028579322 /nfs/dbraw/zinc/57/93/22/1028579322.db2.gz MEIUMAFTSCGAPI-UHFFFAOYSA-N -1 1 336.725 4.159 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cc(F)c(F)cc3Cl)n2)c(F)c1 ZINC000445452358 1028602229 /nfs/dbraw/zinc/60/22/29/1028602229.db2.gz BKHCAXLQCTXECT-UHFFFAOYSA-N -1 1 326.661 4.180 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cc(-c4ccco4)on3)n2)c(Cl)c1 ZINC000445454052 1028607172 /nfs/dbraw/zinc/60/71/72/1028607172.db2.gz JSAVHQIDJDWNJE-UHFFFAOYSA-N -1 1 329.699 4.011 20 0 EIADMM Cc1c(Cl)cccc1OCc1nc(-c2ccc([O-])cc2F)no1 ZINC000445454636 1028608239 /nfs/dbraw/zinc/60/82/39/1028608239.db2.gz HBMZMNVEDWZBHU-UHFFFAOYSA-N -1 1 334.734 4.122 20 0 EIADMM [O-]c1c(-c2nc([C@@H]3COc4ccccc4O3)no2)ccc2ccccc21 ZINC000445472147 1028617840 /nfs/dbraw/zinc/61/78/40/1028617840.db2.gz OBDUKUVBORRIRZ-KRWDZBQOSA-N -1 1 346.342 4.108 20 0 EIADMM [O-]c1ccc(-c2noc([C@H]3C[C@H]3c3cccc(F)c3F)n2)c(F)c1 ZINC000445460392 1028618140 /nfs/dbraw/zinc/61/81/40/1028618140.db2.gz ACDFMVMFGNDJFH-RYUDHWBXSA-N -1 1 332.281 4.131 20 0 EIADMM [O-]c1ccc(-c2noc(/C=C/c3cccc4cccnc34)n2)cc1F ZINC000445478796 1028624707 /nfs/dbraw/zinc/62/47/07/1028624707.db2.gz ICMMVBYTKRJINI-VQHVLOKHSA-N -1 1 333.322 4.300 20 0 EIADMM Cc1cc(Br)ccc1-c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445480154 1028626708 /nfs/dbraw/zinc/62/67/08/1028626708.db2.gz LEUKVMAIQRJPLG-UHFFFAOYSA-N -1 1 349.159 4.319 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cc(F)cc(C(F)(F)F)c3)n2)cc1F ZINC000445484192 1028632299 /nfs/dbraw/zinc/63/22/99/1028632299.db2.gz WMQPMOZZYXTSPA-UHFFFAOYSA-N -1 1 342.223 4.406 20 0 EIADMM Cc1nc(CC(C)C)c(-c2nc(-c3ccc([O-])c(F)c3)no2)s1 ZINC000445484797 1028632994 /nfs/dbraw/zinc/63/29/94/1028632994.db2.gz XFDIPBYRFUFJHZ-UHFFFAOYSA-N -1 1 333.388 4.212 20 0 EIADMM Cc1ccc(-c2csc3[n-]c(-c4coc(C)n4)nc(=O)c23)s1 ZINC000685189900 1029093394 /nfs/dbraw/zinc/09/33/94/1029093394.db2.gz TUKBXDAIECLJCY-UHFFFAOYSA-N -1 1 329.406 4.397 20 0 EIADMM CCOc1cc(C(=O)N2CCC(C)(C(C)C)CC2)cc(Cl)c1[O-] ZINC000428433842 1029164787 /nfs/dbraw/zinc/16/47/87/1029164787.db2.gz DXKMDGODZCUPKB-UHFFFAOYSA-N -1 1 339.863 4.343 20 0 EIADMM CC(C)c1cccc([N-]S(=O)(=O)c2cc(F)c(F)c(F)c2)c1 ZINC000525017137 1029391686 /nfs/dbraw/zinc/39/16/86/1029391686.db2.gz HTCHOLGRGBLVNJ-UHFFFAOYSA-N -1 1 329.343 4.028 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2ccc(OC(C)C)c(C)c2)c(C)s1 ZINC000525021032 1029393025 /nfs/dbraw/zinc/39/30/25/1029393025.db2.gz UJAVPTLORADJHB-UHFFFAOYSA-N -1 1 339.482 4.261 20 0 EIADMM CC(C)[C@@H](CC1CCCCC1)C(=O)Nc1n[n-]c(C(F)(F)F)n1 ZINC000525235674 1029536330 /nfs/dbraw/zinc/53/63/30/1029536330.db2.gz UACJQZMQIPHGHV-LLVKDONJSA-N -1 1 332.370 4.005 20 0 EIADMM CCCc1cc(=O)[n-]c(SCc2cc(-c3ccccc3)no2)n1 ZINC000248203463 1029597893 /nfs/dbraw/zinc/59/78/93/1029597893.db2.gz XWXHSUNEYUUROM-UHFFFAOYSA-N -1 1 327.409 4.082 20 0 EIADMM CCc1ccc(S(=O)(=O)[N-]c2c(Cl)ccc(C)c2C)s1 ZINC000446961526 1029652929 /nfs/dbraw/zinc/65/29/29/1029652929.db2.gz ZPUWJNFDPQYPBO-UHFFFAOYSA-N -1 1 329.874 4.382 20 0 EIADMM CCc1ccc(CNc2ccc(-c3nc(C)c(C)c(=O)[n-]3)cn2)s1 ZINC000301355176 1029715862 /nfs/dbraw/zinc/71/58/62/1029715862.db2.gz KCJKNKLMVMEFEC-UHFFFAOYSA-N -1 1 340.452 4.097 20 0 EIADMM CC[C@@H]1CCC[C@@H](Nc2ccc(-c3nc(C)c(C)c(=O)[n-]3)cn2)C1 ZINC000301393944 1029724969 /nfs/dbraw/zinc/72/49/69/1029724969.db2.gz JYAXTUPWBRPQDV-GDBMZVCRSA-N -1 1 326.444 4.242 20 0 EIADMM Cc1nc(-c2ccc(N[C@@H]3CCC[C@H](C)[C@@H]3C)nc2)[n-]c(=O)c1C ZINC000301570809 1029763142 /nfs/dbraw/zinc/76/31/42/1029763142.db2.gz WUYNWRBRKWTDSS-MQIPJXDCSA-N -1 1 326.444 4.098 20 0 EIADMM CC(=O)c1cc(F)c([N-]C(=O)c2nc(Cl)ccc2Cl)c(F)c1 ZINC000760189489 1029926300 /nfs/dbraw/zinc/92/63/00/1029926300.db2.gz OGPYZEYTKAFEMI-UHFFFAOYSA-N -1 1 345.132 4.122 20 0 EIADMM C[C@@H]1C[C@H](c2cccnc2)N(C(=O)c2ccc3ccccc3c2[O-])C1 ZINC000182821457 1029968591 /nfs/dbraw/zinc/96/85/91/1029968591.db2.gz WPWSPDJUKMBBSL-AUUYWEPGSA-N -1 1 332.403 4.164 20 0 EIADMM COc1ccc(C(=O)Nc2cccc(F)c2[O-])cc1OC1CCCC1 ZINC000530004526 1030047787 /nfs/dbraw/zinc/04/77/87/1030047787.db2.gz DCWIXZHIVHASHP-UHFFFAOYSA-N -1 1 345.370 4.114 20 0 EIADMM COc1cc(C(=O)N[C@@H]2CC[C@H]3CCCC[C@@H]3C2)cc(Cl)c1[O-] ZINC000525953758 1030121623 /nfs/dbraw/zinc/12/16/23/1030121623.db2.gz SNWNINXHEUFWBW-YRGRVCCFSA-N -1 1 337.847 4.143 20 0 EIADMM Cc1cccc([C@@H](C)Nc2ccc(-c3nc(C)c(C)c(=O)[n-]3)cn2)c1 ZINC000450944749 1030123077 /nfs/dbraw/zinc/12/30/77/1030123077.db2.gz JRUQFCBEFPOYDD-OAHLLOKOSA-N -1 1 334.423 4.343 20 0 EIADMM Cc1cccc([C@H](C)Nc2ccc(-c3nc(C)c(C)c(=O)[n-]3)cn2)c1 ZINC000450944748 1030124406 /nfs/dbraw/zinc/12/44/06/1030124406.db2.gz JRUQFCBEFPOYDD-HNNXBMFYSA-N -1 1 334.423 4.343 20 0 EIADMM Cc1nc(-c2ccc(N3CC[C@@H](CC(C)(C)C)C3)nc2)[n-]c(=O)c1C ZINC000450943667 1030124493 /nfs/dbraw/zinc/12/44/93/1030124493.db2.gz IFWAWZBLAUMJQO-HNNXBMFYSA-N -1 1 340.471 4.124 20 0 EIADMM C[C@@H]1C[C@@H](C(=O)[O-])C[C@H](C)N1Cc1nc(C2CCCCC2)cs1 ZINC000530175867 1030196408 /nfs/dbraw/zinc/19/64/08/1030196408.db2.gz QFRHDRZEAQPXHN-AGGWBTHJSA-N -1 1 336.501 4.264 20 0 EIADMM O=C([O-])c1ccccc1CCN1CCc2c(cccc2C(F)(F)F)C1 ZINC000530173296 1030197295 /nfs/dbraw/zinc/19/72/95/1030197295.db2.gz UHNQSGHHCSOKED-UHFFFAOYSA-N -1 1 349.352 4.004 20 0 EIADMM CC(C)c1nocc1C(=O)[N-]c1nnc(CC2CCCCC2)s1 ZINC000530264897 1030238538 /nfs/dbraw/zinc/23/85/38/1030238538.db2.gz XFDKGUHPMXCKAL-UHFFFAOYSA-N -1 1 334.445 4.025 20 0 EIADMM CCOc1cc(C(=O)N[C@H](C)c2cc(C)oc2C)cc(Cl)c1[O-] ZINC000186714079 1030305613 /nfs/dbraw/zinc/30/56/13/1030305613.db2.gz YRRGTRXKJHTUJF-SNVBAGLBSA-N -1 1 337.803 4.145 20 0 EIADMM CCOc1cc(C(=O)N[C@@H]2C[C@H]2C2CCCCC2)cc(Cl)c1[O-] ZINC000447765395 1030322858 /nfs/dbraw/zinc/32/28/58/1030322858.db2.gz CUQZYBOANLKPKJ-DZGCQCFKSA-N -1 1 337.847 4.143 20 0 EIADMM Cc1cccc(C)c1[N-]S(=O)(=O)c1ccc(C(F)(F)F)c(F)c1 ZINC000447777172 1030327147 /nfs/dbraw/zinc/32/71/47/1030327147.db2.gz MZSLKTYHFQLUEL-UHFFFAOYSA-N -1 1 347.333 4.262 20 0 EIADMM COc1cc(C(=O)N(C)[C@H]2CCCc3ccccc32)cc(Cl)c1[O-] ZINC000526945540 1030338210 /nfs/dbraw/zinc/33/82/10/1030338210.db2.gz VBZQYLPXALAPKD-INIZCTEOSA-N -1 1 345.826 4.204 20 0 EIADMM Cc1ccc(Cl)c2ccc(NC(=O)c3c(F)ccc([O-])c3F)nc12 ZINC000685459621 1030360949 /nfs/dbraw/zinc/36/09/49/1030360949.db2.gz RMDNJOUQGMWFJY-UHFFFAOYSA-N -1 1 348.736 4.433 20 0 EIADMM CC[C@H](CN(CC)C(=O)c1c(F)ccc([O-])c1F)c1ccccc1 ZINC000685473042 1030362155 /nfs/dbraw/zinc/36/21/55/1030362155.db2.gz DQVIYEHNZRKIFA-CYBMUJFWSA-N -1 1 333.378 4.326 20 0 EIADMM O=C(N[C@H]1CCC[C@@H](c2ccccc2)C1)c1c(F)ccc([O-])c1F ZINC000685482823 1030371334 /nfs/dbraw/zinc/37/13/34/1030371334.db2.gz SHZILTVQBVEPGD-KGLIPLIRSA-N -1 1 331.362 4.127 20 0 EIADMM O=c1cc(C(F)F)nc(S[C@@H]2CCCc3ccc(F)cc32)[n-]1 ZINC000685575267 1030533550 /nfs/dbraw/zinc/53/35/50/1030533550.db2.gz BHGSUVSQPNSVDR-GFCCVEGCSA-N -1 1 326.343 4.429 20 0 EIADMM O=C(c1ncc2ccccc2c1[O-])N1CCCCC[C@@H]1c1ccncc1 ZINC000666417499 1030895123 /nfs/dbraw/zinc/89/51/23/1030895123.db2.gz JMCNERUTDKVTTR-GOSISDBHSA-N -1 1 347.418 4.093 20 0 EIADMM C[C@H]1CC[C@@H](c2noc(-c3cc(Oc4ccccc4)ccc3[O-])n2)O1 ZINC000528232963 1031278328 /nfs/dbraw/zinc/27/83/28/1031278328.db2.gz IKUNXFAAELZUMU-SJCJKPOMSA-N -1 1 338.363 4.475 20 0 EIADMM Cc1nc(Cc2ccccc2)sc1C(=O)Nc1ccc(F)cc1[O-] ZINC000531756488 1031536210 /nfs/dbraw/zinc/53/62/10/1031536210.db2.gz XFYHLJPZIJDHKF-UHFFFAOYSA-N -1 1 342.395 4.139 20 0 EIADMM CCOc1cc(-c2noc(C(C)(C)C(C)(F)F)n2)cc(Cl)c1[O-] ZINC000453170248 1031675644 /nfs/dbraw/zinc/67/56/44/1031675644.db2.gz UXTFNVUOIHXHFA-UHFFFAOYSA-N -1 1 346.761 4.427 20 0 EIADMM CC(C)(C)c1nc(CSc2nc(C(F)(F)F)cc(=O)[n-]2)cs1 ZINC000261435183 1032000110 /nfs/dbraw/zinc/00/01/10/1032000110.db2.gz WFNANTLXOGGQNX-UHFFFAOYSA-N -1 1 349.403 4.247 20 0 EIADMM CCN(C(=O)c1cc(Br)ccc1[O-])[C@H]1CCCC[C@H]1C ZINC001143552877 1033788143 /nfs/dbraw/zinc/78/81/43/1033788143.db2.gz GHAMQURGSXAQQK-RISCZKNCSA-N -1 1 340.261 4.196 20 0 EIADMM CC[C@H](CC1CCCC1)C(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC000513459308 1034972442 /nfs/dbraw/zinc/97/24/42/1034972442.db2.gz ZFISJNJVAIBNTE-CQSZACIVSA-N -1 1 327.428 4.327 20 0 EIADMM O=C(Cc1ccc([O-])c(Cl)c1)NC[C@H]1CCCC[C@@H]1C(F)(F)F ZINC000631627225 1035417643 /nfs/dbraw/zinc/41/76/43/1035417643.db2.gz YOGTVVMRPPJQJF-NEPJUHHUSA-N -1 1 349.780 4.073 20 0 EIADMM CCC(=O)c1cccc(S(=O)(=O)[N-]c2ccc(C)c(Cl)c2)c1 ZINC000195654091 1035877237 /nfs/dbraw/zinc/87/72/37/1035877237.db2.gz WIJUHNYDBXVLAM-UHFFFAOYSA-N -1 1 337.828 4.042 20 0 EIADMM CSCc1cccc([N-]S(=O)(=O)c2ccc(C(F)F)cc2)c1 ZINC000588844009 1036547245 /nfs/dbraw/zinc/54/72/45/1036547245.db2.gz RWBAFWLTKWHEOJ-UHFFFAOYSA-N -1 1 343.420 4.288 20 0 EIADMM COc1cc(C(=O)NCC(C)(C)c2cccc(C)c2)cc(Cl)c1[O-] ZINC000460188391 1036666766 /nfs/dbraw/zinc/66/67/66/1036666766.db2.gz WTUSDKQJYLRYKL-UHFFFAOYSA-N -1 1 347.842 4.070 20 0 EIADMM Cc1ccc(-c2ccc(C)c(NC(=O)c3cnc(C4CC4)[n-]c3=O)c2)o1 ZINC000907893371 1036755659 /nfs/dbraw/zinc/75/56/59/1036755659.db2.gz ZLNZEACZEKOIKD-UHFFFAOYSA-N -1 1 349.390 4.189 20 0 EIADMM CCOc1cc(C(=O)N2CCCc3ccccc32)cc(Cl)c1[O-] ZINC000192954464 1036806136 /nfs/dbraw/zinc/80/61/36/1036806136.db2.gz QJDWGBMQGDXVKF-UHFFFAOYSA-N -1 1 331.799 4.037 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)Nc1cc(F)ccc1-n1cccn1 ZINC000486922254 1036891319 /nfs/dbraw/zinc/89/13/19/1036891319.db2.gz FENBWUZIIHSZDU-UHFFFAOYSA-N -1 1 346.749 4.014 20 0 EIADMM CC(C)(CC(=O)Nc1cccc([O-])c1Br)C(F)(F)F ZINC000908708099 1036919582 /nfs/dbraw/zinc/91/95/82/1036919582.db2.gz PGMRKJVZMFLRPC-UHFFFAOYSA-N -1 1 340.139 4.072 20 0 EIADMM CC1(C)Cc2cc(NC(=O)Nc3ccc([O-])c(Cl)c3)ccc2O1 ZINC000486964296 1036926059 /nfs/dbraw/zinc/92/60/59/1036926059.db2.gz IDYDJEOHEWXJOQ-UHFFFAOYSA-N -1 1 332.787 4.403 20 0 EIADMM CCCc1nc(C)c(NC(=O)Nc2ccc([O-])c(Cl)c2)s1 ZINC000487224983 1037058347 /nfs/dbraw/zinc/05/83/47/1037058347.db2.gz OQLQPFPLVBAMQE-UHFFFAOYSA-N -1 1 325.821 4.407 20 0 EIADMM CCSCc1ccnc([N-]S(=O)(=O)/C=C\c2ccc(C)cc2)c1 ZINC000761358140 1037163668 /nfs/dbraw/zinc/16/36/68/1037163668.db2.gz DDWBVBNUTFXPIN-LUAWRHEFSA-N -1 1 348.493 4.056 20 0 EIADMM O=S(=O)([N-]c1cccc(F)c1F)c1cc(Cl)sc1Cl ZINC000067124797 1037164418 /nfs/dbraw/zinc/16/44/18/1037164418.db2.gz WCBWQISMWPYFAN-UHFFFAOYSA-N -1 1 344.191 4.134 20 0 EIADMM CC[C@@H](C)N(CC(=O)[O-])Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC000414688343 1037827258 /nfs/dbraw/zinc/82/72/58/1037827258.db2.gz YOKIHUKZNGXHCO-LLVKDONJSA-N -1 1 338.860 4.149 20 0 EIADMM Cc1nc(C(C)(C)NC(=O)c2cc3ccccc3cc2[O-])sc1C ZINC000605642628 1037847089 /nfs/dbraw/zinc/84/70/89/1037847089.db2.gz OVADFAOAVQDNBD-UHFFFAOYSA-N -1 1 340.448 4.284 20 0 EIADMM Cc1cc(Nc2cc(Br)cc(Cl)c2[O-])cnc1F ZINC001212192926 1038075525 /nfs/dbraw/zinc/07/55/25/1038075525.db2.gz RVMCYCAGAMGNFW-UHFFFAOYSA-N -1 1 331.572 4.394 20 0 EIADMM COc1ccc([N-]S(=O)(=O)c2cc(Cl)ccc2C)cc1Cl ZINC000031666065 1038352932 /nfs/dbraw/zinc/35/29/32/1038352932.db2.gz RLFAPBRZDFORIX-UHFFFAOYSA-N -1 1 346.235 4.111 20 0 EIADMM C[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1c([O-])cccc1F ZINC000608365321 1038803384 /nfs/dbraw/zinc/80/33/84/1038803384.db2.gz CYENEUAQVZKJIP-JTQLQIEISA-N -1 1 341.304 4.367 20 0 EIADMM O=C(CCC(=O)c1ccc2ccccc2c1)Nc1c([O-])cccc1F ZINC000608367121 1038804968 /nfs/dbraw/zinc/80/49/68/1038804968.db2.gz USAABUWPSNAHJB-UHFFFAOYSA-N -1 1 337.350 4.286 20 0 EIADMM Cc1cc(F)ccc1-c1ccc(CN2CCC[C@@H](C)[C@@H]2C(=O)[O-])o1 ZINC000424413533 1038848978 /nfs/dbraw/zinc/84/89/78/1038848978.db2.gz FQTUDYDBSPEOMI-KZULUSFZSA-N -1 1 331.387 4.079 20 0 EIADMM O=C(Nc1ccc([O-])c(F)c1F)C1(c2ccccc2F)CCCC1 ZINC000456797043 1039594191 /nfs/dbraw/zinc/59/41/91/1039594191.db2.gz YOOIHMPBHBQSFT-UHFFFAOYSA-N -1 1 335.325 4.260 20 0 EIADMM Cc1cc(CCCC(=O)Nc2ccc([O-])c(F)c2F)c(C)s1 ZINC000456781742 1039601437 /nfs/dbraw/zinc/60/14/37/1039601437.db2.gz JNAFFEDZVGZPBP-UHFFFAOYSA-N -1 1 325.380 4.310 20 0 EIADMM COc1ccc(CCCCCC(=O)Nc2ccc([O-])c(F)c2F)cc1 ZINC000456793403 1039611466 /nfs/dbraw/zinc/61/14/66/1039611466.db2.gz LZOQCLBPVMOCEV-UHFFFAOYSA-N -1 1 349.377 4.421 20 0 EIADMM CCC(=O)c1cccc([N-]S(=O)(=O)c2cc(Cl)ccc2C)c1 ZINC000433614414 1039687317 /nfs/dbraw/zinc/68/73/17/1039687317.db2.gz CXDYXDNOAVJNBV-UHFFFAOYSA-N -1 1 337.828 4.042 20 0 EIADMM CC[C@H](C)Oc1cccc([N-]S(=O)(=O)c2ccc(F)c(C)c2)c1 ZINC000552810318 1039820721 /nfs/dbraw/zinc/82/07/21/1039820721.db2.gz WDATZLDPSRYEPR-ZDUSSCGKSA-N -1 1 337.416 4.112 20 0 EIADMM COc1cc([N-]S(=O)(=O)c2ccccc2C(C)C)c(C)cc1C ZINC000478673931 1039857505 /nfs/dbraw/zinc/85/75/05/1039857505.db2.gz GIXAQVREXVIKNR-UHFFFAOYSA-N -1 1 333.453 4.236 20 0 EIADMM CC(C)c1cccc(S(=O)(=O)[N-]c2cccc3ncccc23)c1 ZINC000534942914 1039865495 /nfs/dbraw/zinc/86/54/95/1039865495.db2.gz WKBHTVOGYQTFJC-UHFFFAOYSA-N -1 1 326.421 4.159 20 0 EIADMM [O-]c1ccc(-c2noc(COC/C=C/c3ccccc3)n2)c(Cl)c1 ZINC000445450105 1039901691 /nfs/dbraw/zinc/90/16/91/1039901691.db2.gz QUVJHUHOUMRLDX-QPJJXVBHSA-N -1 1 342.782 4.326 20 0 EIADMM Cc1ccc(C(C)(C)C(=O)Nc2ccc(-c3cc(=O)[nH][n-]3)cc2)cc1 ZINC000477132552 1040250451 /nfs/dbraw/zinc/25/04/51/1040250451.db2.gz JZQWFZKKHPEUKL-UHFFFAOYSA-N -1 1 335.407 4.007 20 0 EIADMM Cc1cc(Br)c([O-])c(NC(=O)C(C)(C)c2ccccc2)c1 ZINC000482577691 1040365515 /nfs/dbraw/zinc/36/55/15/1040365515.db2.gz ORUGBUFXHILRGM-UHFFFAOYSA-N -1 1 348.240 4.379 20 0 EIADMM Cc1cc(Br)c([O-])c(NC(=O)[C@@H](C)c2ccsc2)c1 ZINC000482643223 1040406038 /nfs/dbraw/zinc/40/60/38/1040406038.db2.gz VCLKGCBDZOLMEF-VIFPVBQESA-N -1 1 340.242 4.267 20 0 EIADMM O=C(Nc1nc2c(s1)CCCCCC2)c1c(F)ccc([O-])c1F ZINC000539413710 1040427164 /nfs/dbraw/zinc/42/71/64/1040427164.db2.gz TVPUVXVCTKVKDX-UHFFFAOYSA-N -1 1 338.379 4.038 20 0 EIADMM O=S(=O)([N-]c1ccccc1F)c1c(Cl)cc(F)cc1Cl ZINC000435500115 1040429176 /nfs/dbraw/zinc/42/91/76/1040429176.db2.gz FEVRFTZJMOSETR-UHFFFAOYSA-N -1 1 338.162 4.072 20 0 EIADMM Cc1oc(CN2CC=C(c3ccc(Cl)cc3)CC2)cc1C(=O)[O-] ZINC000568059984 1040463824 /nfs/dbraw/zinc/46/38/24/1040463824.db2.gz NQHHAXYLWPZFSH-UHFFFAOYSA-N -1 1 331.799 4.229 20 0 EIADMM O=S(=O)([N-]Cc1ccc2sccc2c1)c1cc2ccccc2o1 ZINC000515333424 1040667997 /nfs/dbraw/zinc/66/79/97/1040667997.db2.gz OXTRUKCHOLPQCK-UHFFFAOYSA-N -1 1 343.429 4.126 20 0 EIADMM Cc1ccc(C(=O)CCc2nc(-c3ccc([O-])cc3Cl)no2)cc1 ZINC000445450594 1040770810 /nfs/dbraw/zinc/77/08/10/1040770810.db2.gz YXWGUZXLXRLTRO-UHFFFAOYSA-N -1 1 342.782 4.220 20 0 EIADMM CSCc1cc(-c2nc(-c3ccc([O-])cc3F)no2)ccc1F ZINC000445454715 1040793608 /nfs/dbraw/zinc/79/36/08/1040793608.db2.gz HNDJYOOYCRJQHX-UHFFFAOYSA-N -1 1 334.347 4.250 20 0 EIADMM CC(C)[C@@H]1C[C@@H](Cc2nc(-c3ccc([O-])cc3Cl)no2)CCO1 ZINC000445455602 1040796929 /nfs/dbraw/zinc/79/69/29/1040796929.db2.gz PZYRKVPGXGANCL-NHYWBVRUSA-N -1 1 336.819 4.089 20 0 EIADMM C[C@H](NC(=O)c1c(F)ccc([O-])c1F)c1cccc2ccccc21 ZINC000537732668 1040797769 /nfs/dbraw/zinc/79/77/69/1040797769.db2.gz UUWHYAJDRGPLFQ-NSHDSACASA-N -1 1 327.330 4.315 20 0 EIADMM O=C(Nc1ccc(F)cc1[O-])c1cc2ccc(C(F)(F)F)cc2[nH]1 ZINC000539863240 1040846468 /nfs/dbraw/zinc/84/64/68/1040846468.db2.gz DFEYCCMEUZJZII-UHFFFAOYSA-N -1 1 338.260 4.284 20 0 EIADMM CCc1cc(=O)[n-]c(SCCOc2ccc3ccccc3c2)n1 ZINC000436184094 1040929031 /nfs/dbraw/zinc/92/90/31/1040929031.db2.gz CDYPZVFTPNZMHM-UHFFFAOYSA-N -1 1 326.421 4.069 20 0 EIADMM CCc1cc(=O)[n-]c(S[C@@H](C)c2ccc(OC(F)F)cc2)n1 ZINC000436190250 1040932444 /nfs/dbraw/zinc/93/24/44/1040932444.db2.gz TVMVLEZXWFPELE-VIFPVBQESA-N -1 1 326.368 4.199 20 0 EIADMM Cc1cc2cc[nH]c2cc1[N-]S(=O)(=O)c1cc(C)c(F)c(C)c1 ZINC000436175503 1040936974 /nfs/dbraw/zinc/93/69/74/1040936974.db2.gz AVUUFGYRYYNZDF-UHFFFAOYSA-N -1 1 332.400 4.033 20 0 EIADMM CC(F)(F)c1cccc([N-]S(=O)(=O)c2ccc3c(c2)CCC3)c1 ZINC000436178293 1040943250 /nfs/dbraw/zinc/94/32/50/1040943250.db2.gz LXMFJLLCHRGSPF-UHFFFAOYSA-N -1 1 337.391 4.088 20 0 EIADMM CC(C)c1cccc(S(=O)(=O)[N-]c2ccc3scnc3c2)c1 ZINC000460819865 1040951771 /nfs/dbraw/zinc/95/17/71/1040951771.db2.gz KKPULPKMGVJTOR-UHFFFAOYSA-N -1 1 332.450 4.221 20 0 EIADMM CSc1cccc([N-]S(=O)(=O)c2ccc(Cl)cc2)c1C ZINC000538090716 1041041871 /nfs/dbraw/zinc/04/18/71/1041041871.db2.gz PMWAPYDYRDOHEK-UHFFFAOYSA-N -1 1 327.858 4.171 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1CC[C@@H](c2ccccc2F)C1 ZINC000436482685 1041265301 /nfs/dbraw/zinc/26/53/01/1041265301.db2.gz BBRVXHMJNTUJEK-OAHLLOKOSA-N -1 1 335.378 4.314 20 0 EIADMM COc1ccc([C@H](CCC(=O)[O-])NCc2cscc2Cl)cc1 ZINC000904004541 1041266980 /nfs/dbraw/zinc/26/69/80/1041266980.db2.gz CVIZQDODZMKQFO-HNNXBMFYSA-N -1 1 339.844 4.106 20 0 EIADMM O=C([O-])C[C@H](NCc1cnc(C2CCCC2)s1)c1ccccc1F ZINC000904046234 1041301033 /nfs/dbraw/zinc/30/10/33/1041301033.db2.gz XVYTYQDWOJLFJP-INIZCTEOSA-N -1 1 348.443 4.245 20 0 EIADMM [O-]c1c(-c2nc(-c3nccc4[nH]ccc43)no2)ccc2ccccc21 ZINC000436522088 1041306008 /nfs/dbraw/zinc/30/60/08/1041306008.db2.gz RKOWMPXZSPHVEA-UHFFFAOYSA-N -1 1 328.331 4.139 20 0 EIADMM CCOc1ccc(-c2noc(-c3cc(F)ccc3[O-])n2)cc1Cl ZINC000436522078 1041306224 /nfs/dbraw/zinc/30/62/24/1041306224.db2.gz RATSINFPEZTPIZ-UHFFFAOYSA-N -1 1 334.734 4.300 20 0 EIADMM Cc1ccccc1[C@]1(F)CCN(C(=O)c2cc(Cl)ccc2[O-])C1 ZINC000436516035 1041321528 /nfs/dbraw/zinc/32/15/28/1041321528.db2.gz TWRSCDULNIXNFP-SFHVURJKSA-N -1 1 333.790 4.065 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N(CCc1ccc(F)cc1)C1CC1 ZINC000436550523 1041325868 /nfs/dbraw/zinc/32/58/68/1041325868.db2.gz IYYVZRYPELAONC-UHFFFAOYSA-N -1 1 333.790 4.032 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N1CCC[C@@H](Cc2ccccc2)C1 ZINC000436553767 1041327421 /nfs/dbraw/zinc/32/74/21/1041327421.db2.gz GYYSOMGQMVXYIY-HNNXBMFYSA-N -1 1 329.827 4.141 20 0 EIADMM CC(C)(C)C[C@H]1CCCN1C(=O)c1ccc(Br)cc1[O-] ZINC000436539895 1041333160 /nfs/dbraw/zinc/33/31/60/1041333160.db2.gz QBUIHDKVDOPXEA-GFCCVEGCSA-N -1 1 340.261 4.196 20 0 EIADMM COc1ccc2c(c1)CCC[C@H]2N(C)C(=O)c1ccc(Cl)cc1[O-] ZINC000436538071 1041333299 /nfs/dbraw/zinc/33/32/99/1041333299.db2.gz IUQYHHHHFDWCEV-QGZVFWFLSA-N -1 1 345.826 4.204 20 0 EIADMM O=C(c1cc(F)ccc1[O-])N1CCC[C@H]1Cc1ccccc1Cl ZINC000436540143 1041333593 /nfs/dbraw/zinc/33/35/93/1041333593.db2.gz NWWTVPSWVJIQDX-AWEZNQCLSA-N -1 1 333.790 4.032 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1CC[C@@H](c2cccc(F)c2)C1 ZINC000436570724 1041350144 /nfs/dbraw/zinc/35/01/44/1041350144.db2.gz SBGXTNGQXDPWNG-MRXNPFEDSA-N -1 1 335.378 4.314 20 0 EIADMM C[C@@H]1CN(C)c2ccccc2N(C(=O)c2cc3ccccc3cc2[O-])C1 ZINC000436593075 1041351675 /nfs/dbraw/zinc/35/16/75/1041351675.db2.gz CCTDXFTXBLZSFR-OAHLLOKOSA-N -1 1 346.430 4.278 20 0 EIADMM O=C(NCc1coc(-c2ccccc2)n1)c1ccc2ccccc2c1[O-] ZINC000436591668 1041352138 /nfs/dbraw/zinc/35/21/38/1041352138.db2.gz RAEIRCXBCXEPFI-UHFFFAOYSA-N -1 1 344.370 4.130 20 0 EIADMM Cc1ccc2nc(-c3ccc(-c4ccc(O)cc4)cc3)[n-]c(=O)c2c1 ZINC000436593462 1041352667 /nfs/dbraw/zinc/35/26/67/1041352667.db2.gz CCDXPRVEOIMWDY-UHFFFAOYSA-N -1 1 328.371 4.271 20 0 EIADMM CCc1c(NC(=O)c2ccccc2[O-])cnn1-c1ccccc1Cl ZINC000436594350 1041353955 /nfs/dbraw/zinc/35/39/55/1041353955.db2.gz IPKFFNHTUNWIPL-UHFFFAOYSA-N -1 1 341.798 4.046 20 0 EIADMM O=C(N[C@@H](c1nccs1)c1ccccc1)c1ccc(Cl)cc1[O-] ZINC000436597031 1041354992 /nfs/dbraw/zinc/35/49/92/1041354992.db2.gz SNIGBIHYKZFNGH-OAHLLOKOSA-N -1 1 344.823 4.022 20 0 EIADMM Cc1csc([C@@H](NC(=O)c2ccc3ccccc3c2[O-])C2CC2)n1 ZINC000436581499 1041359620 /nfs/dbraw/zinc/35/96/20/1041359620.db2.gz FVFTYYABFMPZTK-INIZCTEOSA-N -1 1 338.432 4.191 20 0 EIADMM C[C@]1(c2ccccc2)CCN(C(=O)c2ccc3ccccc3c2[O-])C1 ZINC000436581986 1041360117 /nfs/dbraw/zinc/36/01/17/1041360117.db2.gz KOAUZAQSVQAUKS-QFIPXVFZSA-N -1 1 331.415 4.349 20 0 EIADMM COCc1nc2cc(NC(=O)c3ccc(C(C)C)cc3[O-])ccc2o1 ZINC000436584028 1041361310 /nfs/dbraw/zinc/36/13/10/1041361310.db2.gz IJBWQVKRPXNMHY-UHFFFAOYSA-N -1 1 340.379 4.056 20 0 EIADMM O=C(NC[C@H]1CCO[C@@H]1c1ccccc1)c1ccc2ccccc2c1[O-] ZINC000436587426 1041363761 /nfs/dbraw/zinc/36/37/61/1041363761.db2.gz FDSRUZRGHKCZLC-DYESRHJHSA-N -1 1 347.414 4.053 20 0 EIADMM O=C(c1cc(F)ccc1[O-])N1CCC[C@]2(CCCc3ccccc32)C1 ZINC000436587202 1041364165 /nfs/dbraw/zinc/36/41/65/1041364165.db2.gz WIAMPEVBHHVYIT-OAQYLSRUSA-N -1 1 339.410 4.042 20 0 EIADMM C[C@H]([C@H]1Cc2ccccc2O1)N(C)C(=O)c1ccc2ccccc2c1[O-] ZINC000436609837 1041369860 /nfs/dbraw/zinc/36/98/60/1041369860.db2.gz WPDCLCYPRZIVIH-JLTOFOAXSA-N -1 1 347.414 4.010 20 0 EIADMM O=C(Nc1ccc2scnc2c1)c1cc(Br)ccc1[O-] ZINC000436635050 1041384053 /nfs/dbraw/zinc/38/40/53/1041384053.db2.gz MESRKPMXZJGIJB-UHFFFAOYSA-N -1 1 349.209 4.017 20 0 EIADMM O=S(=O)([N-]c1ccccc1Cl)c1ccc(C(F)(F)F)s1 ZINC000461347367 1041389920 /nfs/dbraw/zinc/38/99/20/1041389920.db2.gz QQFGFWUIBFFMNT-UHFFFAOYSA-N -1 1 341.763 4.221 20 0 EIADMM O=C(Nc1cccc(-c2ncco2)c1)c1ccc2ccccc2c1[O-] ZINC000436666127 1041405952 /nfs/dbraw/zinc/40/59/52/1041405952.db2.gz SXRBXJJBJZJNBM-UHFFFAOYSA-N -1 1 330.343 4.453 20 0 EIADMM CC(=O)Nc1ccc([O-])c(-c2nc([C@H]3CCCC(C)(C)C3)no2)c1 ZINC000436686869 1041420850 /nfs/dbraw/zinc/42/08/50/1041420850.db2.gz GQXBWWDDZXNBKV-LBPRGKRZSA-N -1 1 329.400 4.084 20 0 EIADMM CCOc1cc(NC(=O)c2cc(Cl)c([O-])c(OCC)c2)ccc1C ZINC000436715017 1041439147 /nfs/dbraw/zinc/43/91/47/1041439147.db2.gz HJGINPKKPTUQOU-UHFFFAOYSA-N -1 1 349.814 4.404 20 0 EIADMM O=C(Nc1ccc(Cl)cc1OCC(F)(F)F)c1ccccc1[O-] ZINC000436716404 1041441039 /nfs/dbraw/zinc/44/10/39/1041441039.db2.gz AMLRKDBIHAARPF-UHFFFAOYSA-N -1 1 345.704 4.239 20 0 EIADMM C[C@H](Cc1ccc(Cl)cc1)N(C)C(=O)c1ccc(Cl)cc1[O-] ZINC000436719134 1041441328 /nfs/dbraw/zinc/44/13/28/1041441328.db2.gz NMMKSMTUPMZQNG-LLVKDONJSA-N -1 1 338.234 4.402 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N1CCC[C@@H](c2ccccc2)CC1 ZINC000436718754 1041442609 /nfs/dbraw/zinc/44/26/09/1041442609.db2.gz MBLLBEQCRCFAFU-OAHLLOKOSA-N -1 1 329.827 4.456 20 0 EIADMM CCN(C(=O)c1ccc(Cl)cc1[O-])[C@@H](C)c1cccc(OC)c1 ZINC000436721504 1041444131 /nfs/dbraw/zinc/44/41/31/1041444131.db2.gz INJZYZMRFPZNEO-LBPRGKRZSA-N -1 1 333.815 4.278 20 0 EIADMM C[C@@H]1CN(C(=O)c2ccc(C(F)(F)F)cc2[O-])[C@H]2CCCC[C@H]12 ZINC000436736008 1041446381 /nfs/dbraw/zinc/44/63/81/1041446381.db2.gz FJEPIBQKYWRXST-QKCSRTOESA-N -1 1 327.346 4.062 20 0 EIADMM C[C@@H](Oc1ccccc1NC(=O)c1ccc([O-])cc1F)C(F)(F)F ZINC000436746004 1041451795 /nfs/dbraw/zinc/45/17/95/1041451795.db2.gz CJJPGLLLQMCCFI-SECBINFHSA-N -1 1 343.276 4.113 20 0 EIADMM Cc1cc(C)c(Br)c(C(=O)Nc2ccc(F)cc2[O-])c1 ZINC000461461139 1041454753 /nfs/dbraw/zinc/45/47/53/1041454753.db2.gz RNFMEPJRRSLQHK-UHFFFAOYSA-N -1 1 338.176 4.163 20 0 EIADMM O=C(c1ccc(C(F)(F)F)cc1[O-])N1CCC[C@@H]2CCCC[C@@H]21 ZINC000436763089 1041459879 /nfs/dbraw/zinc/45/98/79/1041459879.db2.gz ISNKVFXMIMRWEL-FZMZJTMJSA-N -1 1 327.346 4.206 20 0 EIADMM Cc1ccccc1[C@@H]1CCN(C(=O)c2ccc(C(F)(F)F)cc2[O-])C1 ZINC000436763059 1041460502 /nfs/dbraw/zinc/46/05/02/1041460502.db2.gz IHHZZPCHPWLZJQ-CYBMUJFWSA-N -1 1 349.352 4.349 20 0 EIADMM CC[C@H](C)N(Cc1ccccc1)C(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC000436748559 1041462351 /nfs/dbraw/zinc/46/23/51/1041462351.db2.gz GSFIQBPIHMMAAF-ZDUSSCGKSA-N -1 1 347.842 4.495 20 0 EIADMM O=C(c1ccc(C(F)(F)F)cc1[O-])N1CCC2(CCCC2)CC1 ZINC000436754579 1041466482 /nfs/dbraw/zinc/46/64/82/1041466482.db2.gz ZSUUNZMBVNGPSN-UHFFFAOYSA-N -1 1 327.346 4.207 20 0 EIADMM CC[C@@]1(C(=O)[O-])CCCN(Cc2ccc(F)c(Cl)c2Cl)C1 ZINC000904400334 1041467410 /nfs/dbraw/zinc/46/74/10/1041467410.db2.gz GMGNVSHUFCFFNH-OAHLLOKOSA-N -1 1 334.218 4.209 20 0 EIADMM O=c1cc(C2CC2)nc(SCc2coc(-c3ccccc3)n2)[n-]1 ZINC000195080402 1041472235 /nfs/dbraw/zinc/47/22/35/1041472235.db2.gz BKESYUMNHXRRIT-UHFFFAOYSA-N -1 1 325.393 4.007 20 0 EIADMM O=c1cc(C2CC2)nc(SCc2coc(-c3ccc(F)cc3)n2)[n-]1 ZINC000195082879 1041473494 /nfs/dbraw/zinc/47/34/94/1041473494.db2.gz AGMIBMHVEXUSAF-UHFFFAOYSA-N -1 1 343.383 4.146 20 0 EIADMM Cc1ccccc1[C@@H](CC(F)(F)F)NC(=O)c1c([O-])cccc1F ZINC000436812210 1041491955 /nfs/dbraw/zinc/49/19/55/1041491955.db2.gz ALUWBUKNUSSQPP-CYBMUJFWSA-N -1 1 341.304 4.263 20 0 EIADMM O=C(Nc1cc(Cl)c([O-])c2ccccc12)[C@@H]1CCOC2(CCC2)C1 ZINC000899051600 1041505815 /nfs/dbraw/zinc/50/58/15/1041505815.db2.gz YYCIYRLUOWIIAT-GFCCVEGCSA-N -1 1 345.826 4.487 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1C[C@H]2CCCN2c2ccccc21 ZINC000538745101 1041520663 /nfs/dbraw/zinc/52/06/63/1041520663.db2.gz SFJLFBKDOZBKFL-MRXNPFEDSA-N -1 1 344.414 4.175 20 0 EIADMM O=C1CC[C@@H](c2nc(-c3ccc([O-])cc3Cl)no2)c2ccccc21 ZINC000436871698 1041529566 /nfs/dbraw/zinc/52/95/66/1041529566.db2.gz KODBAZONSJLBJX-CYBMUJFWSA-N -1 1 340.766 4.204 20 0 EIADMM Cc1csc(-c2cccc(NC(=O)c3ccc([O-])cc3F)c2)n1 ZINC000436870584 1041530200 /nfs/dbraw/zinc/53/02/00/1041530200.db2.gz QHBVATPCUUEZMZ-UHFFFAOYSA-N -1 1 328.368 4.216 20 0 EIADMM C[C@H](NC(=O)c1cc(F)ccc1[O-])c1ccc(-c2ccncc2)cc1 ZINC000436871413 1041530574 /nfs/dbraw/zinc/53/05/74/1041530574.db2.gz SMUPKRGFZXHQSJ-ZDUSSCGKSA-N -1 1 336.366 4.084 20 0 EIADMM COc1ccc(-c2nc(-c3ccc([O-])cc3Cl)no2)c(C)c1OC ZINC000436874810 1041533109 /nfs/dbraw/zinc/53/31/09/1041533109.db2.gz VVXLLBYEIDHNIU-UHFFFAOYSA-N -1 1 346.770 4.088 20 0 EIADMM CC(C)n1nc2c(c1NC(=O)c1cc3ccccc3cc1[O-])CCC2 ZINC000436857559 1041534195 /nfs/dbraw/zinc/53/41/95/1041534195.db2.gz QJLUTSNJLRDSPZ-UHFFFAOYSA-N -1 1 335.407 4.064 20 0 EIADMM [O-]c1ccc(-c2noc(-c3ncoc3-c3ccc(F)cc3)n2)c(F)c1 ZINC000436878220 1041536477 /nfs/dbraw/zinc/53/64/77/1041536477.db2.gz JAMFWXIMZFGTPQ-UHFFFAOYSA-N -1 1 341.273 4.042 20 0 EIADMM O=C(NCC1(c2cccs2)CCCCC1)c1ccc([O-])cc1F ZINC000436877656 1041537820 /nfs/dbraw/zinc/53/78/20/1041537820.db2.gz PTYUXBAJSLFBOA-UHFFFAOYSA-N -1 1 333.428 4.225 20 0 EIADMM [O-]c1ccc(-c2noc(C3(Oc4ccc(Cl)cc4)CC3)n2)cc1F ZINC000436879035 1041537856 /nfs/dbraw/zinc/53/78/56/1041537856.db2.gz MDTVXHRUBZDUOU-UHFFFAOYSA-N -1 1 346.745 4.303 20 0 EIADMM O=C(c1ccc([O-])cc1F)N1CC=C(c2cccc(Cl)c2)CC1 ZINC000436892044 1041545360 /nfs/dbraw/zinc/54/53/60/1041545360.db2.gz YVSRVOMTESQJKZ-UHFFFAOYSA-N -1 1 331.774 4.114 20 0 EIADMM COc1ccc(C(=O)Nc2ccccc2-c2csc(C)n2)c([O-])c1 ZINC000436908401 1041548262 /nfs/dbraw/zinc/54/82/62/1041548262.db2.gz MMOWEMZXSDHOJA-UHFFFAOYSA-N -1 1 340.404 4.085 20 0 EIADMM [O-]c1ccc(Oc2ccccc2)cc1-c1nc(Cc2ccncc2)no1 ZINC000436898562 1041551399 /nfs/dbraw/zinc/55/13/99/1041551399.db2.gz YTTOWNKVDYPRLV-UHFFFAOYSA-N -1 1 345.358 4.220 20 0 EIADMM Cc1cccc(OCCCc2noc(-c3cc(F)ccc3[O-])n2)c1C ZINC000436926140 1041560728 /nfs/dbraw/zinc/56/07/28/1041560728.db2.gz KNFICXUXTCVPDO-UHFFFAOYSA-N -1 1 342.370 4.210 20 0 EIADMM C[C@@H]1C[C@@H](c2ccccc2)[C@H](C)N1C(=O)c1ccc(Cl)cc1[O-] ZINC000436927846 1041562056 /nfs/dbraw/zinc/56/20/56/1041562056.db2.gz AAWQBWMIUQFTKN-IIYDPXPESA-N -1 1 329.827 4.452 20 0 EIADMM O=C(c1cc(Cl)ccc1[O-])N1CC2(CCC2)[C@H]1c1ccccc1 ZINC000436973841 1041578417 /nfs/dbraw/zinc/57/84/17/1041578417.db2.gz VJUGDEWNXPJKGX-QGZVFWFLSA-N -1 1 327.811 4.413 20 0 EIADMM C[C@@H](NC(=O)c1ccc2ccccc2c1[O-])c1ccc(Cl)cn1 ZINC000436981212 1041581137 /nfs/dbraw/zinc/58/11/37/1041581137.db2.gz QBEJWJBBMRJTDO-LLVKDONJSA-N -1 1 326.783 4.085 20 0 EIADMM CCCc1cc(C(=O)Nc2cc(C)cc(Br)c2[O-])ccn1 ZINC000437003728 1041589555 /nfs/dbraw/zinc/58/95/55/1041589555.db2.gz SCDZMPXPBYNGMJ-UHFFFAOYSA-N -1 1 349.228 4.063 20 0 EIADMM C[C@@H](Sc1nc(C(F)F)cc(=O)[n-]1)c1ncc(C(C)(C)C)o1 ZINC000289303105 1041739539 /nfs/dbraw/zinc/73/95/39/1041739539.db2.gz BTTSVZAUYCWVRA-SSDOTTSWSA-N -1 1 329.372 4.259 20 0 EIADMM CC(C)n1ncc2ccc([N-]S(=O)(=O)c3cccc(Cl)c3)cc21 ZINC000509543735 1042365658 /nfs/dbraw/zinc/36/56/58/1042365658.db2.gz VYBAULVBZYVLLB-UHFFFAOYSA-N -1 1 349.843 4.071 20 0 EIADMM COc1ccc(C(=O)Nc2cccc(NC3CCCC3)c2)c([O-])c1 ZINC000303459640 1042437600 /nfs/dbraw/zinc/43/76/00/1042437600.db2.gz LKHFEAURXAEOFS-UHFFFAOYSA-N -1 1 326.396 4.008 20 0 EIADMM O=c1[n-]c(-c2nc3ccccc3o2)nc2cc(C(F)(F)F)ccc12 ZINC000439001164 1042455645 /nfs/dbraw/zinc/45/56/45/1042455645.db2.gz BUCCVUJZUQRXTF-UHFFFAOYSA-N -1 1 331.253 4.162 20 0 EIADMM C[C@H](C(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)c1cccc(Cl)c1 ZINC000439065015 1042489048 /nfs/dbraw/zinc/48/90/48/1042489048.db2.gz AJRLHRXPKOTOOB-NSHDSACASA-N -1 1 341.798 4.178 20 0 EIADMM Cc1onc(-c2cccc(F)c2)c1C(=O)[N-]c1nc(C(C)C)ns1 ZINC000913809232 1042545018 /nfs/dbraw/zinc/54/50/18/1042545018.db2.gz MWKAFMXXVOSFBA-UHFFFAOYSA-N -1 1 346.387 4.016 20 0 EIADMM CCC[C@@H](C)c1cc([N-]S(=O)(=O)c2cccc(C(F)F)c2)[nH]n1 ZINC000780398350 1042548010 /nfs/dbraw/zinc/54/80/10/1042548010.db2.gz MELCHHBVEWVDGY-SNVBAGLBSA-N -1 1 343.399 4.052 20 0 EIADMM C[C@@H](CNC(=O)c1ccc([O-])cc1F)c1ccc(C(F)(F)F)cc1 ZINC000189917061 1042815176 /nfs/dbraw/zinc/81/51/76/1042815176.db2.gz PYSIITGBWKRNBX-JTQLQIEISA-N -1 1 341.304 4.084 20 0 EIADMM CCON(CC1CCCCC1)C(=O)c1ccc2ccc(O)cc2c1[O-] ZINC001299175714 1042893700 /nfs/dbraw/zinc/89/37/00/1042893700.db2.gz DFJVTWNIMQPXRS-UHFFFAOYSA-N -1 1 343.423 4.225 20 0 EIADMM C[C@@H](c1ccc(Cl)c(Cl)c1)N1CCC2(C[C@@H]2C(=O)[O-])CC1 ZINC000405359308 1042952283 /nfs/dbraw/zinc/95/22/83/1042952283.db2.gz NBSFLEINEZKZQO-CMPLNLGQSA-N -1 1 328.239 4.241 20 0 EIADMM CCCc1ccccc1[N-]S(=O)(=O)c1ccc(OC)cc1Cl ZINC000520643857 1042966750 /nfs/dbraw/zinc/96/67/50/1042966750.db2.gz MPYZFGNSOFVPQL-UHFFFAOYSA-N -1 1 339.844 4.102 20 0 EIADMM O=C(Nc1ccc(OC(F)F)cc1)c1ccc2ccccc2c1[O-] ZINC000391753853 1043020458 /nfs/dbraw/zinc/02/04/58/1043020458.db2.gz RJTCYTOZNWNURS-UHFFFAOYSA-N -1 1 329.302 4.399 20 0 EIADMM O=c1nc(CN2CCCC[C@H]2c2ccccc2)[n-]c2ccsc21 ZINC000273872394 1043110057 /nfs/dbraw/zinc/11/00/57/1043110057.db2.gz QKAGUFAOQDEHNK-HNNXBMFYSA-N -1 1 325.437 4.124 20 0 EIADMM O=C(Nc1csc(-c2ccccc2)n1)c1c(F)ccc([O-])c1F ZINC000672333089 1043121812 /nfs/dbraw/zinc/12/18/12/1043121812.db2.gz IEKDWIBWGRZYRV-UHFFFAOYSA-N -1 1 332.331 4.046 20 0 EIADMM Cc1[nH]c(-c2cccc(C)c2)nc1C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000509178752 1043207051 /nfs/dbraw/zinc/20/70/51/1043207051.db2.gz OFHZGSRTFOPGHY-UHFFFAOYSA-N -1 1 341.798 4.305 20 0 EIADMM CSc1ccc([N-]S(=O)(=O)c2c(C)ccc3ncccc32)cc1 ZINC000673982030 1043235002 /nfs/dbraw/zinc/23/50/02/1043235002.db2.gz JOHBEUWWNHTPBT-UHFFFAOYSA-N -1 1 344.461 4.066 20 0 EIADMM CCOc1cc(C(=O)NC(C)(C)c2ccccc2C)cc(Cl)c1[O-] ZINC000508055483 1043247450 /nfs/dbraw/zinc/24/74/50/1043247450.db2.gz VEHLUURKOUEDCB-UHFFFAOYSA-N -1 1 347.842 4.418 20 0 EIADMM COC(=O)c1cc(F)c(Nc2cc(F)c([O-])c(Cl)c2)c(C)c1F ZINC001214491622 1043284279 /nfs/dbraw/zinc/28/42/79/1043284279.db2.gz GFZYHMYUPNAZJC-UHFFFAOYSA-N -1 1 345.704 4.302 20 0 EIADMM COc1cc(C(=O)N[C@H](C)CC2CCCCC2)cc(Cl)c1[O-] ZINC000428086186 1043325608 /nfs/dbraw/zinc/32/56/08/1043325608.db2.gz ANCBVDXMCDSIHS-LLVKDONJSA-N -1 1 325.836 4.143 20 0 EIADMM CCc1ccccc1S(=O)(=O)[N-]c1ccccc1CC(F)(F)F ZINC000187505209 1043355222 /nfs/dbraw/zinc/35/52/22/1043355222.db2.gz SXHLUIDTOCVYLR-UHFFFAOYSA-N -1 1 343.370 4.155 20 0 EIADMM CC(C)c1ccccc1S(=O)(=O)[N-]c1ccc(-c2cnco2)cc1 ZINC000188953181 1043390466 /nfs/dbraw/zinc/39/04/66/1043390466.db2.gz NOFJGTJWWKFFQX-UHFFFAOYSA-N -1 1 342.420 4.266 20 0 EIADMM CCN1C(=O)c2ccc(Cl)cc2N[C@@H]1c1ccc([O-])c(Cl)c1 ZINC000520849481 1043402708 /nfs/dbraw/zinc/40/27/08/1043402708.db2.gz NRCULMGAAPSENC-HNNXBMFYSA-N -1 1 337.206 4.285 20 0 EIADMM CSCc1cccc([N-]S(=O)(=O)c2ccc(C(C)C)cc2)c1 ZINC000521340400 1043714893 /nfs/dbraw/zinc/71/48/93/1043714893.db2.gz XEAFXUILGPHOKI-UHFFFAOYSA-N -1 1 335.494 4.474 20 0 EIADMM Cc1cc(C)cc(-c2nnc([N-]C(=O)c3c(F)cccc3F)s2)c1 ZINC000115150853 1043855596 /nfs/dbraw/zinc/85/55/96/1043855596.db2.gz HYOCXPJVUQTGJE-UHFFFAOYSA-N -1 1 345.374 4.352 20 0 EIADMM Cc1ccccc1CC1CN(C(=O)c2ccc3ccccc3c2[O-])C1 ZINC000674746513 1043860005 /nfs/dbraw/zinc/86/00/05/1043860005.db2.gz RMVIZRGEZBJGKY-UHFFFAOYSA-N -1 1 331.415 4.169 20 0 EIADMM COc1cc(C(=O)Nc2cccc(C(C)(F)F)c2)cc(Cl)c1[O-] ZINC000442928119 1043894822 /nfs/dbraw/zinc/89/48/22/1043894822.db2.gz AHLWSWQGTLQZHM-UHFFFAOYSA-N -1 1 341.741 4.418 20 0 EIADMM CCCCCN(CCCCC)C(=O)c1nc2ccccc2c(=O)[n-]1 ZINC000079403333 1043897914 /nfs/dbraw/zinc/89/79/14/1043897914.db2.gz HAMKFRKRMLEGQE-UHFFFAOYSA-N -1 1 329.444 4.158 20 0 EIADMM COc1cc(C(=O)N2CCC[C@H]2CC(C)(C)C)cc(Cl)c1[O-] ZINC000442942532 1043908545 /nfs/dbraw/zinc/90/85/45/1043908545.db2.gz PVTNJPDNGXHLGZ-LBPRGKRZSA-N -1 1 325.836 4.095 20 0 EIADMM COc1cc(C(=O)NC(C)(C)CCc2ccccc2)cc(Cl)c1[O-] ZINC000442965828 1043927795 /nfs/dbraw/zinc/92/77/95/1043927795.db2.gz LMMVDQQLBKCNLV-UHFFFAOYSA-N -1 1 347.842 4.195 20 0 EIADMM COc1cc(-c2nc([C@H]3CCCCS3)no2)cc(Cl)c1[O-] ZINC000443195646 1044083661 /nfs/dbraw/zinc/08/36/61/1044083661.db2.gz SGKVMCXIWGEVAZ-LLVKDONJSA-N -1 1 326.805 4.062 20 0 EIADMM C[C@H](NC(=O)c1ccc([O-])cc1F)c1ccc(Cl)cc1Cl ZINC000226266873 1044101401 /nfs/dbraw/zinc/10/14/01/1044101401.db2.gz OGNGCIGPEOLQPV-QMMMGPOBSA-N -1 1 328.170 4.329 20 0 EIADMM CC[C@H](Cc1ccccc1)N(C)C(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC000443288073 1044157986 /nfs/dbraw/zinc/15/79/86/1044157986.db2.gz AMPMUSYSZRALDE-OAHLLOKOSA-N -1 1 347.842 4.148 20 0 EIADMM CCOc1cc(-c2nc(Cc3ccccc3)no2)cc(Cl)c1[O-] ZINC000191161895 1044238542 /nfs/dbraw/zinc/23/85/42/1044238542.db2.gz CAYOBUISSLZQIM-UHFFFAOYSA-N -1 1 330.771 4.085 20 0 EIADMM [O-]c1c(Br)ccc(Cl)c1Nc1cccc(O)c1F ZINC001212554226 1044301456 /nfs/dbraw/zinc/30/14/56/1044301456.db2.gz MVWITFTWFVODOW-UHFFFAOYSA-N -1 1 332.556 4.396 20 0 EIADMM O=C(Nc1cccc(Br)c1)Nc1ccc([O-])c(Cl)c1 ZINC000398463015 1044326496 /nfs/dbraw/zinc/32/64/96/1044326496.db2.gz LULVWIKSLPIRAG-UHFFFAOYSA-N -1 1 341.592 4.452 20 0 EIADMM O=C(Nc1ccc(Br)cc1)Nc1ccc([O-])c(Cl)c1 ZINC000398514012 1044331389 /nfs/dbraw/zinc/33/13/89/1044331389.db2.gz JOWYZODDINBQGX-UHFFFAOYSA-N -1 1 341.592 4.452 20 0 EIADMM CCc1cc(=O)[n-]c(SCc2ccc(Br)c(C)c2)n1 ZINC000443478142 1044369919 /nfs/dbraw/zinc/36/99/19/1044369919.db2.gz YUUPETNSXNGUGT-UHFFFAOYSA-N -1 1 339.258 4.108 20 0 EIADMM CCOc1cc(C(=O)Nc2ccccc2Cl)cc(Cl)c1[O-] ZINC000193055267 1044406446 /nfs/dbraw/zinc/40/64/46/1044406446.db2.gz OBLHUDXILXBPJL-UHFFFAOYSA-N -1 1 326.179 4.350 20 0 EIADMM CC(C)[C@H]1c2ccccc2CCN1Cc1nc(=O)c2sccc2[n-]1 ZINC000675663651 1044420276 /nfs/dbraw/zinc/42/02/76/1044420276.db2.gz IPRJZNSPJJPQIZ-KRWDZBQOSA-N -1 1 339.464 4.152 20 0 EIADMM CCCCCC[C@H](C)C(=O)Nc1nc(Br)ccc1[O-] ZINC001154597121 1044460709 /nfs/dbraw/zinc/46/07/09/1044460709.db2.gz ABDZFUNDXDRLMQ-JTQLQIEISA-N -1 1 329.238 4.095 20 0 EIADMM COC[C@H]([N-]c1nc(-c2ccccc2)no1)c1cccc(Cl)c1 ZINC000673521808 1044575373 /nfs/dbraw/zinc/57/53/73/1044575373.db2.gz SBSZFZNNEDGORC-HNNXBMFYSA-N -1 1 329.787 4.190 20 0 EIADMM O=S(=O)(/C=C\c1ccccc1Cl)[N-]c1ccc2ccccc2n1 ZINC000734975697 1044727357 /nfs/dbraw/zinc/72/73/57/1044727357.db2.gz XAHBTPWBWVYFHF-QXMHVHEDSA-N -1 1 344.823 4.301 20 0 EIADMM CC1(C)C[C@@H](O)c2cccc(NCc3cccc([O-])c3Cl)c2O1 ZINC000922918344 1044860371 /nfs/dbraw/zinc/86/03/71/1044860371.db2.gz RBKJQTORIBZERI-OAHLLOKOSA-N -1 1 333.815 4.252 20 0 EIADMM CN(Cc1ccc(F)c(Cl)c1)C(=O)c1c([O-])cccc1Cl ZINC000762370472 1045210014 /nfs/dbraw/zinc/21/00/14/1045210014.db2.gz WYIPGLFBYZNBCW-UHFFFAOYSA-N -1 1 328.170 4.110 20 0 EIADMM CC(C)(C)OC(=O)Nc1ccc(C(=O)NCC2CCCCC2)c([O-])c1 ZINC000740921525 1045245737 /nfs/dbraw/zinc/24/57/37/1045245737.db2.gz RYNPXEOJRSNCCF-UHFFFAOYSA-N -1 1 348.443 4.049 20 0 EIADMM Cc1c(=O)[n-]c(SC[C@@H]2CC2(Cl)Cl)nc1-c1ccccc1 ZINC000767440869 1045528144 /nfs/dbraw/zinc/52/81/44/1045528144.db2.gz VSSUMETVQDUMRC-NSHDSACASA-N -1 1 341.263 4.444 20 0 EIADMM CC1(C)[C@@H](C(F)(F)F)CCN1C(=O)c1cc2ccccc2cc1[O-] ZINC000326391109 1045802998 /nfs/dbraw/zinc/80/29/98/1045802998.db2.gz KLFJRXIAJWCBHL-HNNXBMFYSA-N -1 1 337.341 4.348 20 0 EIADMM CC(=O)c1cc(Nc2ccc([O-])c(F)c2F)ccc1Br ZINC001212016630 1045840562 /nfs/dbraw/zinc/84/05/62/1045840562.db2.gz ZPYCNBOELOLFDA-UHFFFAOYSA-N -1 1 342.139 4.379 20 0 EIADMM COc1ccc(OC(F)F)c(NCc2cccc([O-])c2Cl)c1 ZINC000393328927 1045944567 /nfs/dbraw/zinc/94/45/67/1045944567.db2.gz UTZWLHDUWYGOPY-UHFFFAOYSA-N -1 1 329.730 4.268 20 0 EIADMM O=C(c1c([O-])cccc1Cl)N1CCC[C@@H]1CCc1ccccc1 ZINC000769711775 1046049698 /nfs/dbraw/zinc/04/96/98/1046049698.db2.gz IHXGFGJAQDIMQP-OAHLLOKOSA-N -1 1 329.827 4.283 20 0 EIADMM O=C(c1c([O-])cccc1Cl)N(CCc1ccc(F)cc1)C1CC1 ZINC000769872756 1046101765 /nfs/dbraw/zinc/10/17/65/1046101765.db2.gz OXWCALHLAJUJIV-UHFFFAOYSA-N -1 1 333.790 4.032 20 0 EIADMM O=C(Nc1cccc(CC[C@H](O)c2ccccc2)c1)c1ccccc1[O-] ZINC000769970253 1046112136 /nfs/dbraw/zinc/11/21/36/1046112136.db2.gz IMCCIGPHVOJTMC-FQEVSTJZSA-N -1 1 347.414 4.311 20 0 EIADMM O=C(c1c([O-])cccc1Cl)N1CCCCC[C@H]1[C@H]1CCCCC1=O ZINC000769973768 1046118316 /nfs/dbraw/zinc/11/83/16/1046118316.db2.gz HZGLFMILZWUCIK-HIFRSBDPSA-N -1 1 349.858 4.190 20 0 EIADMM O=C([O-])[C@H]1CCCN1Cc1ccc(-c2ccc(Cl)c(Cl)c2)o1 ZINC000263406336 1046281007 /nfs/dbraw/zinc/28/10/07/1046281007.db2.gz JXMJVDKJXYGHSW-CQSZACIVSA-N -1 1 340.206 4.302 20 0 EIADMM O=C([O-])c1ccc(CN2CCCC[C@@H]2c2nc3ccccc3o2)cc1 ZINC000263485443 1046294837 /nfs/dbraw/zinc/29/48/37/1046294837.db2.gz PFYFQBDLXQLBGU-QGZVFWFLSA-N -1 1 336.391 4.253 20 0 EIADMM C[C@H](CN(C)Cc1c(Cl)cccc1Oc1ccccc1)C(=O)[O-] ZINC000263528451 1046303747 /nfs/dbraw/zinc/30/37/47/1046303747.db2.gz VFJQSAAWWZYSED-CYBMUJFWSA-N -1 1 333.815 4.285 20 0 EIADMM CCc1cc(=O)[n-]c(S[C@H](C)C(=O)c2ccc(C(C)(C)C)cc2)n1 ZINC000428698451 1046563438 /nfs/dbraw/zinc/56/34/38/1046563438.db2.gz DZXJYTAIABRBLK-GFCCVEGCSA-N -1 1 344.480 4.406 20 0 EIADMM CCOc1cc(-c2noc([C@@H](CC)SC)n2)cc(Cl)c1[O-] ZINC000445409626 1046645445 /nfs/dbraw/zinc/64/54/45/1046645445.db2.gz BJMRFALFMSDZNK-LLVKDONJSA-N -1 1 328.821 4.308 20 0 EIADMM C[C@@H](CNC(=O)c1ccc2ccccc2c1[O-])c1nc2ccccc2o1 ZINC000746563736 1046775675 /nfs/dbraw/zinc/77/56/75/1046775675.db2.gz NMUGSBVUNVYPQM-ZDUSSCGKSA-N -1 1 346.386 4.220 20 0 EIADMM C[C@@H](C(=O)Nc1cc(F)c([O-])cc1Cl)c1c(F)cccc1F ZINC001157899928 1046826453 /nfs/dbraw/zinc/82/64/53/1046826453.db2.gz OEHSIJNHLGZMQF-SSDOTTSWSA-N -1 1 329.705 4.205 20 0 EIADMM O=C(NC12CCC(C(F)(F)F)(CC1)CC2)c1c([O-])cccc1Cl ZINC000787625103 1047031789 /nfs/dbraw/zinc/03/17/89/1047031789.db2.gz ZWRHCNPYBHTVLZ-UHFFFAOYSA-N -1 1 347.764 4.431 20 0 EIADMM COc1cc(C(=O)N[C@@H](C)Cc2ccc(C)cc2C)cc(Cl)c1[O-] ZINC000460210218 1047189049 /nfs/dbraw/zinc/18/90/49/1047189049.db2.gz HTOFXGKTBPFQHJ-ZDUSSCGKSA-N -1 1 347.842 4.032 20 0 EIADMM COc1cc(C(=O)NC2(c3ccccc3)CCCC2)cc(Cl)c1[O-] ZINC000460209987 1047189126 /nfs/dbraw/zinc/18/91/26/1047189126.db2.gz JLNJAIQEWNXUAR-UHFFFAOYSA-N -1 1 345.826 4.254 20 0 EIADMM Cc1ccc(Cl)c(S(=O)(=O)[N-]c2ccc(Cl)cc2F)c1 ZINC000498025702 1047282833 /nfs/dbraw/zinc/28/28/33/1047282833.db2.gz KZZSQGZZWCXBBY-UHFFFAOYSA-N -1 1 334.199 4.242 20 0 EIADMM Cc1nc(C(C)C)[n-]c(=O)c1C(=O)NC[C@H]1CCCC[C@@H]1C(C)(C)C ZINC000747366118 1047391165 /nfs/dbraw/zinc/39/11/65/1047391165.db2.gz UKNYZUCHFCLKNR-CABCVRRESA-N -1 1 347.503 4.196 20 0 EIADMM CN(C)c1ccc(NC(=O)Nc2ccc([O-])c(Cl)c2)cc1Cl ZINC000789837960 1047477770 /nfs/dbraw/zinc/47/77/70/1047477770.db2.gz IDWZWBAIOILHRK-UHFFFAOYSA-N -1 1 340.210 4.409 20 0 EIADMM Cc1csc(-c2cccc(C(=O)Nc3nc(Cl)ccc3[O-])c2)n1 ZINC000789932385 1047495717 /nfs/dbraw/zinc/49/57/17/1047495717.db2.gz WMIDGAHLAQMQPP-UHFFFAOYSA-N -1 1 345.811 4.125 20 0 EIADMM CC(C)(c1nnc([N-]C(=O)c2ccc(Cl)o2)s1)c1ccccc1 ZINC000106686061 1047696199 /nfs/dbraw/zinc/69/61/99/1047696199.db2.gz QLOAGOOFNIHJKT-UHFFFAOYSA-N -1 1 347.827 4.363 20 0 EIADMM Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)c1ccccc1[O-] ZINC000131055009 1047823234 /nfs/dbraw/zinc/82/32/34/1047823234.db2.gz NNCPJUGBEAWLES-UHFFFAOYSA-N -1 1 346.386 4.205 20 0 EIADMM O=C(CC1CCCC1)Nc1c([O-])cc(Br)cc1Cl ZINC000556850642 1048061292 /nfs/dbraw/zinc/06/12/92/1048061292.db2.gz ICAKUWYZRRCSSV-UHFFFAOYSA-N -1 1 332.625 4.327 20 0 EIADMM O=C(N[C@H]1CCO[C@@H](c2ccccc2)C1)c1cc2ccccc2cc1[O-] ZINC000132017949 1048180975 /nfs/dbraw/zinc/18/09/75/1048180975.db2.gz GBELBFYNXFRNKL-GHTZIAJQSA-N -1 1 347.414 4.196 20 0 EIADMM O=C(Cc1ccc([O-])c(Cl)c1)Nc1scnc1-c1ccccc1 ZINC001143891847 1048270282 /nfs/dbraw/zinc/27/02/82/1048270282.db2.gz VEFBGAYHYGKSSG-UHFFFAOYSA-N -1 1 344.823 4.350 20 0 EIADMM O=C(NCCOc1cccc2ccccc21)c1c([O-])cccc1Cl ZINC000920456304 1048677333 /nfs/dbraw/zinc/67/73/33/1048677333.db2.gz IIEQYTANDGWIAU-UHFFFAOYSA-N -1 1 341.794 4.008 20 0 EIADMM [O-]c1cc(F)c(CN2CCSC[C@H]2c2ccc(F)cc2)c(F)c1 ZINC001144554616 1048724006 /nfs/dbraw/zinc/72/40/06/1048724006.db2.gz CHYHRVUIKOOKAT-KRWDZBQOSA-N -1 1 339.382 4.100 20 0 EIADMM CSc1nc2ccc(NC(=O)c3cc(F)ccc3[O-])cc2s1 ZINC001135520645 1048761477 /nfs/dbraw/zinc/76/14/77/1048761477.db2.gz BPUZLDOYZLLLBQ-UHFFFAOYSA-N -1 1 334.397 4.115 20 0 EIADMM Cc1cc(CN(Cc2ccccc2)Cc2cc(F)c([O-])cc2F)on1 ZINC001144659297 1048792093 /nfs/dbraw/zinc/79/20/93/1048792093.db2.gz CEFXKCDBHKXKOE-UHFFFAOYSA-N -1 1 344.361 4.169 20 0 EIADMM O=C([N-]c1nc2c(s1)c(Cl)ccc2F)c1ocnc1C(F)F ZINC001132364052 1048826456 /nfs/dbraw/zinc/82/64/56/1048826456.db2.gz ZFOQVZZUYYUVNI-UHFFFAOYSA-N -1 1 347.705 4.267 20 0 EIADMM O=C(NCc1cccc2ccccc21)c1ccc2ccc(O)cc2c1[O-] ZINC001144753055 1048845183 /nfs/dbraw/zinc/84/51/83/1048845183.db2.gz XJPRZUORKQHJNA-UHFFFAOYSA-N -1 1 343.382 4.334 20 0 EIADMM C[C@@H](NC(=O)c1ncccc1[O-])c1ccc(Cl)c(Cl)c1Cl ZINC001144855226 1048870141 /nfs/dbraw/zinc/87/01/41/1048870141.db2.gz OLQLDRPEIZZWKC-SSDOTTSWSA-N -1 1 345.613 4.238 20 0 EIADMM CC[C@H](C)CO[N-]C(=O)[C@H](C)c1cccc(C(=O)c2ccccc2)c1 ZINC000816980026 1048885792 /nfs/dbraw/zinc/88/57/92/1048885792.db2.gz CYFRCWYOHKUMLG-JKSUJKDBSA-N -1 1 339.435 4.115 20 0 EIADMM Cc1cccc(OCCCNC(=O)c2cc3ccccc3cc2[O-])c1 ZINC001135788013 1048886342 /nfs/dbraw/zinc/88/63/42/1048886342.db2.gz SHDPNKUPXOGEHW-UHFFFAOYSA-N -1 1 335.403 4.053 20 0 EIADMM O=S(=O)([N-]c1cccc(C(F)F)c1)c1cccc(C(F)F)c1 ZINC000780383533 1048932225 /nfs/dbraw/zinc/93/22/25/1048932225.db2.gz YZPGXTFBMZZGQM-UHFFFAOYSA-N -1 1 333.306 4.363 20 0 EIADMM O=C(NCCCCc1ccccc1)c1ccc2ccc(O)cc2c1[O-] ZINC001135894588 1048956512 /nfs/dbraw/zinc/95/65/12/1048956512.db2.gz NQDYIMNAMBEHER-UHFFFAOYSA-N -1 1 335.403 4.004 20 0 EIADMM COc1cccc([C@@H]2CCCN2C(=O)c2cc(Cl)ccc2[O-])c1 ZINC001135937645 1048996531 /nfs/dbraw/zinc/99/65/31/1048996531.db2.gz VYZBFWXCTFQVIP-INIZCTEOSA-N -1 1 331.799 4.032 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N(Cc1ccccc1F)C1CC1 ZINC001136048883 1049053760 /nfs/dbraw/zinc/05/37/60/1049053760.db2.gz UGNIGZQWVZBSQQ-UHFFFAOYSA-N -1 1 335.378 4.489 20 0 EIADMM O=C(CC1Cc2ccccc2C1)Nc1cccc(C(F)(F)F)c1[O-] ZINC001146804063 1049060534 /nfs/dbraw/zinc/06/05/34/1049060534.db2.gz MHADBIGSQZZQRZ-UHFFFAOYSA-N -1 1 335.325 4.155 20 0 EIADMM Cc1nc(C(C)(C)C)[n-]c(=O)c1C(=O)Nc1ccc2sccc2c1 ZINC001136091150 1049087001 /nfs/dbraw/zinc/08/70/01/1049087001.db2.gz DMXZTIDYTJBUBT-UHFFFAOYSA-N -1 1 341.436 4.255 20 0 EIADMM CCN(CC)c1ccc(NC(=O)Cc2ccc([O-])c(Cl)c2)cc1 ZINC001136137533 1049148751 /nfs/dbraw/zinc/14/87/51/1049148751.db2.gz AIAMNLHNYIXCTL-UHFFFAOYSA-N -1 1 332.831 4.073 20 0 EIADMM O=C(Nc1cc(Cl)c([O-])c2ccccc12)c1cn2ccccc2n1 ZINC001148252927 1049290439 /nfs/dbraw/zinc/29/04/39/1049290439.db2.gz NOWUFPGYWAAKDL-UHFFFAOYSA-N -1 1 337.766 4.099 20 0 EIADMM CCO[C@@H]1C[C@@H](NC(=O)c2cc3ccccc3cc2[O-])C1(CC)CC ZINC001148354795 1049304629 /nfs/dbraw/zinc/30/46/29/1049304629.db2.gz JQPBETNWPCGGES-RTBURBONSA-N -1 1 341.451 4.259 20 0 EIADMM COC(C)(C)[C@H]1CCCN1C(=O)c1cccc(-c2ccccc2)c1[O-] ZINC001148866700 1049391506 /nfs/dbraw/zinc/39/15/06/1049391506.db2.gz NJBTYMLPWDLDLM-GOSISDBHSA-N -1 1 339.435 4.089 20 0 EIADMM O=C(N[C@@H]1CCc2c1cccc2O)c1cccc(-c2ccccc2)c1[O-] ZINC001148872497 1049393661 /nfs/dbraw/zinc/39/36/61/1049393661.db2.gz KLFKEHAUSXHACN-LJQANCHMSA-N -1 1 345.398 4.182 20 0 EIADMM CCCCCc1nnc(NC(=O)c2ccc3ccccc3c2[O-])s1 ZINC001136358480 1049530287 /nfs/dbraw/zinc/53/02/87/1049530287.db2.gz SJFUGSIGQJHPGD-UHFFFAOYSA-N -1 1 341.436 4.382 20 0 EIADMM CCCN(C(=O)c1cc(Cl)ccc1[O-])[C@H]1CCc2ccccc2C1 ZINC001136387946 1049564132 /nfs/dbraw/zinc/56/41/32/1049564132.db2.gz CPVGPPLYMOTCGP-KRWDZBQOSA-N -1 1 343.854 4.455 20 0 EIADMM CC1(C)CN(C(=O)c2ccc3ccc(O)cc3c2[O-])[C@H]1c1ccccc1 ZINC001136401288 1049584837 /nfs/dbraw/zinc/58/48/37/1049584837.db2.gz NXWLHIKCWKLECL-FQEVSTJZSA-N -1 1 347.414 4.474 20 0 EIADMM Cc1cccc(CN(CC(C)C)C(=O)c2cc(C)cc(C=O)c2[O-])c1 ZINC001136432157 1049623919 /nfs/dbraw/zinc/62/39/19/1049623919.db2.gz GCDURMVWPZEHOE-UHFFFAOYSA-N -1 1 339.435 4.120 20 0 EIADMM C[C@@H](NC(=O)c1c([O-])cccc1Cl)c1cccc(OC(F)F)c1 ZINC000149280035 1049640107 /nfs/dbraw/zinc/64/01/07/1049640107.db2.gz DQBLFUVPDHPCPO-SECBINFHSA-N -1 1 341.741 4.138 20 0 EIADMM CCOc1ccccc1[C@@H](CC)NC(=O)Cc1ccc([O-])c(Cl)c1 ZINC001136504449 1049696206 /nfs/dbraw/zinc/69/62/06/1049696206.db2.gz BEFOBTXOGAEVAN-MRXNPFEDSA-N -1 1 347.842 4.254 20 0 EIADMM Cc1cccc(-c2cccc(CNC(=O)c3ccc([O-])c(F)c3)c2)c1 ZINC001136553446 1049741113 /nfs/dbraw/zinc/74/11/13/1049741113.db2.gz AOOWBLNBIGEOCU-UHFFFAOYSA-N -1 1 335.378 4.437 20 0 EIADMM Cc1conc1[N-]C(=O)c1nc(Cl)c(Cl)c(Cl)c1Cl ZINC000813376454 1049763173 /nfs/dbraw/zinc/76/31/73/1049763173.db2.gz MRKFUYSTDRCSFA-UHFFFAOYSA-N -1 1 340.981 4.244 20 0 EIADMM O=C(Nc1cccc(F)c1[O-])c1c2c(sc1-n1cccc1)CCC2 ZINC001171638597 1049779139 /nfs/dbraw/zinc/77/91/39/1049779139.db2.gz ZUISQFSFZBOCMN-UHFFFAOYSA-N -1 1 342.395 4.125 20 0 EIADMM CSc1ccc(Cl)cc1[N-]C(=O)c1coc2c1C(=O)CCC2 ZINC000822777771 1049795548 /nfs/dbraw/zinc/79/55/48/1049795548.db2.gz RJIMJXJLJHVRAJ-UHFFFAOYSA-N -1 1 335.812 4.426 20 0 EIADMM CC[C@H]1CC[C@H](C)N1C(=O)c1ccc(NC(=O)OC(C)(C)C)cc1[O-] ZINC000772872440 1049859219 /nfs/dbraw/zinc/85/92/19/1049859219.db2.gz MWFKYSNSDKBXGV-JSGCOSHPSA-N -1 1 348.443 4.142 20 0 EIADMM Cc1c2ccccc2oc1[C@H](NC(=O)c1ncc(C)cc1[O-])C(C)C ZINC001136766098 1049870043 /nfs/dbraw/zinc/87/00/43/1049870043.db2.gz DSANTPLGTWYRHF-QGZVFWFLSA-N -1 1 338.407 4.277 20 0 EIADMM O=S(=O)([N-][C@@H](C1CCC1)C1CCCC1)c1cc2ccccc2o1 ZINC001212284344 1049902034 /nfs/dbraw/zinc/90/20/34/1049902034.db2.gz WSJAHXOFJJCLDZ-GOSISDBHSA-N -1 1 333.453 4.070 20 0 EIADMM CSc1c(F)cccc1[N-]C(=O)c1csc([C@@H]2CCCO2)n1 ZINC000617274661 1049973027 /nfs/dbraw/zinc/97/30/27/1049973027.db2.gz FAMMPCFUSASBDJ-LBPRGKRZSA-N -1 1 338.429 4.108 20 0 EIADMM C[C@@H](CN(C)C(=O)c1cc(-c2ccc(C=O)o2)ccc1[O-])C(C)(C)C ZINC001177240031 1050171341 /nfs/dbraw/zinc/17/13/41/1050171341.db2.gz TZVVPRVLAQDJMJ-ZDUSSCGKSA-N -1 1 343.423 4.219 20 0 EIADMM Cc1cnc(Br)cc1Nc1c(F)ccc([O-])c1Cl ZINC001250228399 1050228773 /nfs/dbraw/zinc/22/87/73/1050228773.db2.gz ACLKDUCOHVMWSI-UHFFFAOYSA-N -1 1 331.572 4.394 20 0 EIADMM Cc1ccc(-c2noc(-c3ncc(C(F)(F)F)[n-]3)n2)c(Cl)c1 ZINC001212690122 1050229353 /nfs/dbraw/zinc/22/93/53/1050229353.db2.gz YWSYPFOGKBSSBR-UHFFFAOYSA-N -1 1 328.681 4.107 20 0 EIADMM Cc1ccc(-c2noc(-c3nc(C(F)(F)F)c[n-]3)n2)c(Cl)c1 ZINC001212690122 1050229367 /nfs/dbraw/zinc/22/93/67/1050229367.db2.gz YWSYPFOGKBSSBR-UHFFFAOYSA-N -1 1 328.681 4.107 20 0 EIADMM CCCOc1ccc(NC(=O)c2ccc([O-])cc2F)cc1OCCC ZINC000154620630 1050241538 /nfs/dbraw/zinc/24/15/38/1050241538.db2.gz XNIJLWTWWKUYTL-UHFFFAOYSA-N -1 1 347.386 4.361 20 0 EIADMM O=C(Nc1cccc(C(F)(F)F)c1[O-])[C@H]1C[C@H]1c1cccs1 ZINC001177543978 1050248044 /nfs/dbraw/zinc/24/80/44/1050248044.db2.gz FBDSSFDKXALMNI-BDAKNGLRSA-N -1 1 327.327 4.215 20 0 EIADMM O=C(Nc1ccc(C(F)(F)F)cc1Cl)c1ccc([O-])c(F)c1 ZINC001186226007 1050263558 /nfs/dbraw/zinc/26/35/58/1050263558.db2.gz JPTIFZGGERGTMD-UHFFFAOYSA-N -1 1 333.668 4.456 20 0 EIADMM O=C(Nc1ccn2cc(-c3ccccc3)nc2c1)c1ccc([O-])c(F)c1 ZINC001186209500 1050271817 /nfs/dbraw/zinc/27/18/17/1050271817.db2.gz UZJXUDJYTUKGQR-UHFFFAOYSA-N -1 1 347.349 4.098 20 0 EIADMM Cc1cc(Cl)cc(Cl)c1CNC(=O)c1ccc([O-])cc1F ZINC001186337566 1050303810 /nfs/dbraw/zinc/30/38/10/1050303810.db2.gz MDYARCNGBBYEMK-UHFFFAOYSA-N -1 1 328.170 4.077 20 0 EIADMM Cc1c(F)ccc([N-]S(=O)(=O)c2csc3ccccc32)c1F ZINC001186497763 1050338402 /nfs/dbraw/zinc/33/84/02/1050338402.db2.gz GEMCGCMZAQAABC-UHFFFAOYSA-N -1 1 339.388 4.289 20 0 EIADMM CC(=O)OCc1cccc(Cl)c1Nc1cc([O-])c(F)c(F)c1 ZINC001212778619 1050339263 /nfs/dbraw/zinc/33/92/63/1050339263.db2.gz YUVUWXLQEXONQU-UHFFFAOYSA-N -1 1 327.714 4.131 20 0 EIADMM COc1ccccc1-c1ccccc1-c1noc(-c2ccncc2[O-])n1 ZINC001212722728 1050417495 /nfs/dbraw/zinc/41/74/95/1050417495.db2.gz XWXPHMNDGJFFOQ-UHFFFAOYSA-N -1 1 345.358 4.180 20 0 EIADMM Cc1ccc(CNc2cc(C)cc(C[N-]C(=O)C(F)(F)F)c2)cc1 ZINC001178713390 1050536645 /nfs/dbraw/zinc/53/66/45/1050536645.db2.gz PTYYLRVNPRMGJD-UHFFFAOYSA-N -1 1 336.357 4.094 20 0 EIADMM O=C(Nc1cccc(Br)c1)Nc1cc(F)c([O-])cc1F ZINC001187464465 1050545351 /nfs/dbraw/zinc/54/53/51/1050545351.db2.gz SZVALLKXSOXXOZ-UHFFFAOYSA-N -1 1 343.127 4.077 20 0 EIADMM O=C(Nc1cccc(Br)c1)Nc1ccc([O-])c(F)c1F ZINC001187465588 1050546107 /nfs/dbraw/zinc/54/61/07/1050546107.db2.gz ZHGBPFIAJOKISL-UHFFFAOYSA-N -1 1 343.127 4.077 20 0 EIADMM O=C(Nc1cccc(C(F)(F)F)c1[O-])[C@H]1CCC(=O)c2ccccc21 ZINC001178928333 1050582433 /nfs/dbraw/zinc/58/24/33/1050582433.db2.gz CQBUEYPUYNTIMT-LBPRGKRZSA-N -1 1 349.308 4.110 20 0 EIADMM CC(C)(C)C1CCC(C[N-]S(=O)(=O)c2cccc(F)c2F)CC1 ZINC001187983429 1050663222 /nfs/dbraw/zinc/66/32/22/1050663222.db2.gz JHMGABIIMBPTMB-UHFFFAOYSA-N -1 1 345.455 4.096 20 0 EIADMM CN(C)C(=O)c1ccc(Nc2cc(Cl)c([O-])cc2Cl)cc1 ZINC001174007935 1050676750 /nfs/dbraw/zinc/67/67/50/1050676750.db2.gz IZQNHHZFGSGTNA-UHFFFAOYSA-N -1 1 325.195 4.144 20 0 EIADMM Cc1c(Cl)cc(Nc2cccc(S(C)(=O)=O)c2)c([O-])c1Cl ZINC001174029165 1050712813 /nfs/dbraw/zinc/71/28/13/1050712813.db2.gz PTIDZSDSYILCJO-UHFFFAOYSA-N -1 1 346.235 4.155 20 0 EIADMM CC(=O)c1cc(F)c([N-]C(=O)c2cc3nc(C)ccc3o2)c(F)c1F ZINC000763540419 1050725373 /nfs/dbraw/zinc/72/53/73/1050725373.db2.gz UTQNJGODRLCXKU-UHFFFAOYSA-N -1 1 348.280 4.008 20 0 EIADMM O=C(Nc1cc(F)c([O-])cc1Cl)[C@H]1C[C@@H]1c1c(F)cccc1F ZINC001179657051 1050739904 /nfs/dbraw/zinc/73/99/04/1050739904.db2.gz ZWURZPSWTPDKLW-YUMQZZPRSA-N -1 1 341.716 4.205 20 0 EIADMM O=C(Nc1cc(F)c([O-])cc1Cl)[C@H]1Cc2ccc(Cl)cc21 ZINC001179660283 1050741072 /nfs/dbraw/zinc/74/10/72/1050741072.db2.gz NYOACWZPSVWVCV-JTQLQIEISA-N -1 1 326.154 4.117 20 0 EIADMM CC1CCN(C(=O)c2ccc(Nc3cc([O-])c(F)c(F)c3)cc2)CC1 ZINC001174161763 1050802524 /nfs/dbraw/zinc/80/25/24/1050802524.db2.gz OGHZOVBAPPFZSO-UHFFFAOYSA-N -1 1 346.377 4.286 20 0 EIADMM O=C(Nc1cc(=O)n(-c2ccccc2)[n-]1)Nc1ccc2ccccc2c1 ZINC001188583963 1050809312 /nfs/dbraw/zinc/80/93/12/1050809312.db2.gz LDDBKTCCZNROFJ-UHFFFAOYSA-N -1 1 344.374 4.375 20 0 EIADMM O=C(Nc1ccc2ccncc2c1)c1ccc([O-])c(C(F)(F)F)c1 ZINC001188586305 1050809927 /nfs/dbraw/zinc/80/99/27/1050809927.db2.gz JPGNBVARYVPGRM-UHFFFAOYSA-N -1 1 332.281 4.212 20 0 EIADMM Cn1ccc2cc(NC(=O)c3ccc([O-])c(C(F)(F)F)c3)ccc21 ZINC001188585281 1050809992 /nfs/dbraw/zinc/80/99/92/1050809992.db2.gz DNGAYETXZWAOJY-UHFFFAOYSA-N -1 1 334.297 4.155 20 0 EIADMM CCS[C@H]1CCC[C@H](NC(=O)c2ccc(C(F)(F)F)c([O-])c2)C1 ZINC000619582470 1050825857 /nfs/dbraw/zinc/82/58/57/1050825857.db2.gz ILUINLMNCZJKSQ-RYUDHWBXSA-N -1 1 347.402 4.205 20 0 EIADMM CC1CCN(C(=O)c2cccc(Nc3c([O-])cc(F)cc3F)c2)CC1 ZINC001174204701 1050840326 /nfs/dbraw/zinc/84/03/26/1050840326.db2.gz SFAIZEWAFRGDIT-UHFFFAOYSA-N -1 1 346.377 4.286 20 0 EIADMM O=C(Nc1cccc2ccccc21)Nc1cc2ccc([O-])cc2oc1=O ZINC001188912248 1050859189 /nfs/dbraw/zinc/85/91/89/1050859189.db2.gz BDUXAIVDVAGGQB-UHFFFAOYSA-N -1 1 346.342 4.296 20 0 EIADMM CC(=O)c1cccc(S(=O)(=O)[N-]c2c(C)cccc2C(C)(C)C)c1 ZINC001189239364 1050933412 /nfs/dbraw/zinc/93/34/12/1050933412.db2.gz MVRUYRVIGDAMIM-UHFFFAOYSA-N -1 1 345.464 4.296 20 0 EIADMM CCOc1cc(C(=O)N[C@@H](C)C2CCC(F)CC2)cc(Cl)c1[O-] ZINC000619962186 1050969765 /nfs/dbraw/zinc/96/97/65/1050969765.db2.gz JEUCFJINXXKJJX-ZBOXLXRLSA-N -1 1 343.826 4.091 20 0 EIADMM CC(C)c1ccc(C(=O)Nc2cc(Cl)cc3c[nH]nc32)c([O-])c1 ZINC001180391964 1050978296 /nfs/dbraw/zinc/97/82/96/1050978296.db2.gz YPRYKUQOVBWPEV-UHFFFAOYSA-N -1 1 329.787 4.298 20 0 EIADMM O=S(=O)([N-]c1ccc(F)c(F)c1)c1ccc(F)c2ccccc21 ZINC001189349186 1050978752 /nfs/dbraw/zinc/97/87/52/1050978752.db2.gz VDQWEZXEXSCCSQ-UHFFFAOYSA-N -1 1 337.322 4.058 20 0 EIADMM O=C(Nc1cccc(C(F)(F)F)c1[O-])C1(C(F)(F)F)CCCC1 ZINC001180480045 1051000266 /nfs/dbraw/zinc/00/02/66/1051000266.db2.gz HYVKVOGGNGMDJP-UHFFFAOYSA-N -1 1 341.251 4.472 20 0 EIADMM COc1cc(Cl)ccc1[N-]S(=O)(=O)C1=Cc2ccccc2CC1 ZINC000775295939 1051041847 /nfs/dbraw/zinc/04/18/47/1051041847.db2.gz VWDVCAYMQNCQGW-UHFFFAOYSA-N -1 1 349.839 4.078 20 0 EIADMM C[C@@H]1CCCC[C@@H]1CC(=O)N1CCC(C(=O)c2ccc([O-])cc2)CC1 ZINC000620170551 1051045833 /nfs/dbraw/zinc/04/58/33/1051045833.db2.gz MSZUOUIJTXHJQP-CRAIPNDOSA-N -1 1 343.467 4.030 20 0 EIADMM O=S(=O)(CCCF)[N-]c1ccccc1Oc1ccc(Cl)cc1 ZINC001189910893 1051076560 /nfs/dbraw/zinc/07/65/60/1051076560.db2.gz FIGAOPZHHXKABW-UHFFFAOYSA-N -1 1 343.807 4.234 20 0 EIADMM C=Cc1cccc([N-]S(=O)(=O)c2cc(F)cc(C(F)(F)F)c2)c1 ZINC001189985550 1051097122 /nfs/dbraw/zinc/09/71/22/1051097122.db2.gz JNGDVHCWPVISKU-UHFFFAOYSA-N -1 1 345.317 4.288 20 0 EIADMM O=c1cc(-c2ccccc2)nc(SCc2cnc(Cl)s2)[n-]1 ZINC001190201144 1051136662 /nfs/dbraw/zinc/13/66/62/1051136662.db2.gz KDIRSWLFVLHKGS-UHFFFAOYSA-N -1 1 335.841 4.251 20 0 EIADMM Cc1noc(-c2ccccc2)c1NC(=O)Nc1c(F)cc([O-])cc1F ZINC001190373508 1051173379 /nfs/dbraw/zinc/17/33/79/1051173379.db2.gz BOBMPBSAGAIHBW-UHFFFAOYSA-N -1 1 345.305 4.278 20 0 EIADMM CCC(C)(C)c1ccc(S(=O)(=O)[N-]c2cnc(C)cc2C)cc1 ZINC001190423448 1051181172 /nfs/dbraw/zinc/18/11/72/1051181172.db2.gz GVFBUQJWLVCOGD-UHFFFAOYSA-N -1 1 332.469 4.187 20 0 EIADMM O=S(=O)([N-]c1cccc(C(F)(F)F)c1)c1ccc(C2CC2)cc1 ZINC001190463667 1051191388 /nfs/dbraw/zinc/19/13/88/1051191388.db2.gz JNJRVSGAQZYWPF-UHFFFAOYSA-N -1 1 341.354 4.384 20 0 EIADMM CC(C)OCc1cccc([N-]S(=O)(=O)c2ccc(C3CC3)cc2)c1 ZINC001190500814 1051195652 /nfs/dbraw/zinc/19/56/52/1051195652.db2.gz ZNLKFSRLSHYQJI-UHFFFAOYSA-N -1 1 345.464 4.290 20 0 EIADMM Cc1ccnc2cc([N-]S(=O)(=O)c3ccc(C4CC4)cc3)ccc12 ZINC001190500087 1051196212 /nfs/dbraw/zinc/19/62/12/1051196212.db2.gz LMRXDCKZBSAHHT-UHFFFAOYSA-N -1 1 338.432 4.221 20 0 EIADMM COc1cc(C(=O)N2CCC[C@@H]2C2CCCCC2)cc(Cl)c1[O-] ZINC000153616442 1051202365 /nfs/dbraw/zinc/20/23/65/1051202365.db2.gz QMQJPEGTBQOTPI-OAHLLOKOSA-N -1 1 337.847 4.239 20 0 EIADMM COc1cc(C(=O)N(CC2CC2)c2ccccc2)cc(Cl)c1[O-] ZINC000153964107 1051250226 /nfs/dbraw/zinc/25/02/26/1051250226.db2.gz LIDVMPVIBYCTLK-UHFFFAOYSA-N -1 1 331.799 4.111 20 0 EIADMM O=C(Nc1ccccc1OC(F)(F)F)Nc1cc([O-])c(F)cc1F ZINC001190684059 1051257004 /nfs/dbraw/zinc/25/70/04/1051257004.db2.gz PXTFGPGSRSJCDO-UHFFFAOYSA-N -1 1 348.227 4.213 20 0 EIADMM O=C(Nc1ccccc1OC(F)(F)F)Nc1cc(F)cc(F)c1[O-] ZINC001190686098 1051259030 /nfs/dbraw/zinc/25/90/30/1051259030.db2.gz VFIJKNAKVPGGAB-UHFFFAOYSA-N -1 1 348.227 4.213 20 0 EIADMM O=S(=O)([N-]c1ccc(/C=C/c2ccccc2)cc1)c1ccncc1 ZINC001190888117 1051298085 /nfs/dbraw/zinc/29/80/85/1051298085.db2.gz SFLIXOGUPSCZRI-VOTSOKGWSA-N -1 1 336.416 4.053 20 0 EIADMM [O-]c1cc(F)c(Nc2ncc(F)cc2Br)cc1Cl ZINC001250020086 1051302931 /nfs/dbraw/zinc/30/29/31/1051302931.db2.gz CVWRPEHFKVRIDH-UHFFFAOYSA-N -1 1 335.535 4.225 20 0 EIADMM Cc1cnc(Br)c(Nc2cc(Cl)c([O-])cc2F)c1 ZINC001250020662 1051310671 /nfs/dbraw/zinc/31/06/71/1051310671.db2.gz PCBRFNAABHDZOW-UHFFFAOYSA-N -1 1 331.572 4.394 20 0 EIADMM O=c1oc2cc([O-])ccc2cc1Nc1cc(F)cc(C(F)(F)F)c1 ZINC001175063030 1051315130 /nfs/dbraw/zinc/31/51/30/1051315130.db2.gz VEGUKYUXFQBAML-UHFFFAOYSA-N -1 1 339.244 4.400 20 0 EIADMM COc1cc(C(=O)N[C@@H]2C[C@H](C)c3ccccc32)cc(Cl)c1[O-] ZINC001191156420 1051366966 /nfs/dbraw/zinc/36/69/66/1051366966.db2.gz YMMWSEXVLICRFD-ZUZCIYMTSA-N -1 1 331.799 4.033 20 0 EIADMM COc1cc(C(=O)N[C@@H]2C[C@@H](C)c3ccccc32)cc(Cl)c1[O-] ZINC001191156418 1051367059 /nfs/dbraw/zinc/36/70/59/1051367059.db2.gz YMMWSEXVLICRFD-MEBBXXQBSA-N -1 1 331.799 4.033 20 0 EIADMM CC(C)C[C@@H]1C[C@H]1[N-]S(=O)(=O)c1sc2ccccc2c1Cl ZINC001191171658 1051373977 /nfs/dbraw/zinc/37/39/77/1051373977.db2.gz MFMWKXNVAVZWOA-ZYHUDNBSSA-N -1 1 343.901 4.268 20 0 EIADMM CCCCc1ccc(S(=O)(=O)[N-]c2cc(OC)ccc2C)cc1 ZINC001191223701 1051400659 /nfs/dbraw/zinc/40/06/59/1051400659.db2.gz DQGMGANMDUNDLS-UHFFFAOYSA-N -1 1 333.453 4.147 20 0 EIADMM Cn1c(CC(=O)Nc2cccc(C(F)(F)F)c2[O-])cc2ccccc21 ZINC001182267535 1051449987 /nfs/dbraw/zinc/44/99/87/1051449987.db2.gz ZUHIOKVCJIWADI-UHFFFAOYSA-N -1 1 348.324 4.084 20 0 EIADMM [O-]c1c(Br)c(F)ccc1Nc1ccc(-n2cccn2)cc1 ZINC001175374477 1051559171 /nfs/dbraw/zinc/55/91/71/1051559171.db2.gz JSLHJPVQZMNVCF-UHFFFAOYSA-N -1 1 348.175 4.223 20 0 EIADMM CC(C)c1ccccc1NC(=O)Nc1cc2ccc([O-])cc2oc1=O ZINC001192227731 1051674420 /nfs/dbraw/zinc/67/44/20/1051674420.db2.gz VFEQGVCEKPGXMR-UHFFFAOYSA-N -1 1 338.363 4.266 20 0 EIADMM Nc1cc(C(F)(F)F)c(Nc2c(Cl)ccc([O-])c2Cl)cn1 ZINC001175717663 1051737629 /nfs/dbraw/zinc/73/76/29/1051737629.db2.gz LEQLHBXKNHSSRS-UHFFFAOYSA-N -1 1 338.116 4.439 20 0 EIADMM Nc1cc(C(F)(F)F)c(Nc2ccc(Cl)c(Cl)c2[O-])cn1 ZINC001175716581 1051738112 /nfs/dbraw/zinc/73/81/12/1051738112.db2.gz WHAZHCZSFGVTQY-UHFFFAOYSA-N -1 1 338.116 4.439 20 0 EIADMM CC(C)(C)c1ccc(C2(C(=O)Nc3nc(Cl)ccc3[O-])CC2)cc1 ZINC001183209623 1051810625 /nfs/dbraw/zinc/81/06/25/1051810625.db2.gz FJDICBWYHCAECI-UHFFFAOYSA-N -1 1 344.842 4.408 20 0 EIADMM COC(=O)C1(c2ccc(Nc3cc([O-])c(Cl)cc3F)cc2)CC1 ZINC001175920234 1051844339 /nfs/dbraw/zinc/84/43/39/1051844339.db2.gz JUEMZLKCIZRRCC-UHFFFAOYSA-N -1 1 335.762 4.133 20 0 EIADMM CC(C)(NC(=O)c1ccc(Br)c([O-])c1)C1CCCCC1 ZINC001183878957 1051911331 /nfs/dbraw/zinc/91/13/31/1051911331.db2.gz RFLHEITWZZQEDI-UHFFFAOYSA-N -1 1 340.261 4.243 20 0 EIADMM Cc1ccc2ccc(F)c(Nc3ccc(-n4ccc(=O)[n-]4)cc3)c2n1 ZINC001176119528 1051920844 /nfs/dbraw/zinc/92/08/44/1051920844.db2.gz RWGWYWARXLQRAG-UHFFFAOYSA-N -1 1 334.354 4.317 20 0 EIADMM CCOc1cc(-c2nc([C@@H](C)c3ccco3)no2)cc(Cl)c1[O-] ZINC000621795779 1051954314 /nfs/dbraw/zinc/95/43/14/1051954314.db2.gz PPCAMKRCAQUMPB-VIFPVBQESA-N -1 1 334.759 4.239 20 0 EIADMM O=C(CCCC1CCCCC1)Nc1ccc(-n2ccc(=O)[n-]2)cc1 ZINC001184224946 1051973231 /nfs/dbraw/zinc/97/32/31/1051973231.db2.gz RXDQILJAOUQODH-UHFFFAOYSA-N -1 1 327.428 4.267 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2cc(Cl)ncc2C)c2ccccc12 ZINC001193834242 1052007761 /nfs/dbraw/zinc/00/77/61/1052007761.db2.gz XFDZUIBDKRSZPW-UHFFFAOYSA-N -1 1 346.839 4.306 20 0 EIADMM [O-]c1cc(Nc2cccc3c2cnn3[C@H]2CCCCO2)cc(F)c1F ZINC001176318859 1052025987 /nfs/dbraw/zinc/02/59/87/1052025987.db2.gz ZXKGJYTYFMQJEK-QGZVFWFLSA-N -1 1 345.349 4.463 20 0 EIADMM O=C(OCc1cc2ccccc2nc1Cl)c1ccc([O-])cc1F ZINC000773573385 1052036415 /nfs/dbraw/zinc/03/64/15/1052036415.db2.gz LUHUYMJIWQLBDT-UHFFFAOYSA-N -1 1 331.730 4.090 20 0 EIADMM CC[C@H](OC(=O)c1ccc([O-])cc1F)C(=O)c1ccc(Cl)cc1 ZINC000773575275 1052037093 /nfs/dbraw/zinc/03/70/93/1052037093.db2.gz XIFOAFULEDXCPD-HNNXBMFYSA-N -1 1 336.746 4.003 20 0 EIADMM O=C([O-])C[C@@H](NCc1ccc(-c2ccccc2)o1)c1cccs1 ZINC000671162004 1052057177 /nfs/dbraw/zinc/05/71/77/1052057177.db2.gz DXKOHEZPCHHJDM-OAHLLOKOSA-N -1 1 327.405 4.314 20 0 EIADMM O=C([O-])C[C@@H](NCc1ncc(-c2ccccc2)s1)c1cccs1 ZINC000671162446 1052072576 /nfs/dbraw/zinc/07/25/76/1052072576.db2.gz DPCLCZDJQZNIMM-CYBMUJFWSA-N -1 1 344.461 4.177 20 0 EIADMM [O-]c1c(Cl)c(Cl)ccc1Nc1cnc(N2CCCCC2)nc1 ZINC001176508378 1052101749 /nfs/dbraw/zinc/10/17/49/1052101749.db2.gz PXOHRXHHTDFTIO-UHFFFAOYSA-N -1 1 339.226 4.223 20 0 EIADMM CNc1cccc(Br)c1Nc1c(F)cc(F)c([O-])c1F ZINC001176673336 1052159577 /nfs/dbraw/zinc/15/95/77/1052159577.db2.gz SXWDBNKDBKUNSA-UHFFFAOYSA-N -1 1 347.134 4.357 20 0 EIADMM Cc1cccc(C)c1S(=O)(=O)[N-]c1cnc2cc(Cl)ccc2c1 ZINC001194609679 1052168537 /nfs/dbraw/zinc/16/85/37/1052168537.db2.gz DTCNJWTUGZUMMK-UHFFFAOYSA-N -1 1 346.839 4.306 20 0 EIADMM Cc1cc(Nc2c(F)cc(F)c([O-])c2F)n(-c2ccccc2F)n1 ZINC001176662957 1052173115 /nfs/dbraw/zinc/17/31/15/1052173115.db2.gz FEVZCCIZFRNZLO-UHFFFAOYSA-N -1 1 337.276 4.186 20 0 EIADMM Cc1cccc(C)c1S(=O)(=O)[N-]c1cccc2nc(Cl)ccc12 ZINC001194643369 1052185143 /nfs/dbraw/zinc/18/51/43/1052185143.db2.gz UTLNAMKVMNCGRC-UHFFFAOYSA-N -1 1 346.839 4.306 20 0 EIADMM Cc1c2cc(C)ccc2[nH]c1C(=O)NCc1ccc([O-])c(Cl)c1 ZINC001176988672 1052210273 /nfs/dbraw/zinc/21/02/73/1052210273.db2.gz RPRDUIKGKWDKLL-UHFFFAOYSA-N -1 1 328.799 4.074 20 0 EIADMM O=C(NCc1ccc([O-])c(Cl)c1)c1ccc(C(F)(F)F)s1 ZINC001176994724 1052217551 /nfs/dbraw/zinc/21/75/51/1052217551.db2.gz XIODSJXDUFWZIE-UHFFFAOYSA-N -1 1 335.734 4.056 20 0 EIADMM Cc1ccc2c([N-]S(=O)(=O)c3ccc(Cl)c(C)c3)cccc2n1 ZINC001185530329 1052257361 /nfs/dbraw/zinc/25/73/61/1052257361.db2.gz ZCLCXNNCDNLDAM-UHFFFAOYSA-N -1 1 346.839 4.306 20 0 EIADMM CCC(=O)c1cccc([N-]S(=O)(=O)c2ccc(Cl)c(C)c2)c1 ZINC001185532067 1052258504 /nfs/dbraw/zinc/25/85/04/1052258504.db2.gz KBMQZBDLCKCDPN-UHFFFAOYSA-N -1 1 337.828 4.042 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1CCc2sc(Cl)cc2C1 ZINC000622735781 1052403170 /nfs/dbraw/zinc/40/31/70/1052403170.db2.gz FHLVUUHOAPSPGD-UHFFFAOYSA-N -1 1 343.835 4.459 20 0 EIADMM CN(C(=O)c1c(F)ccc([O-])c1F)C1CC(C)(C)CC(C)(C)C1 ZINC000622749902 1052427060 /nfs/dbraw/zinc/42/70/60/1052427060.db2.gz QWCRAONAGPLGOG-UHFFFAOYSA-N -1 1 325.399 4.347 20 0 EIADMM CSCc1ccccc1[N-]S(=O)(=O)c1cccc(Cl)c1 ZINC000184034312 1052990743 /nfs/dbraw/zinc/99/07/43/1052990743.db2.gz ZAVIGGNYZVFLHO-UHFFFAOYSA-N -1 1 327.858 4.004 20 0 EIADMM COc1ccc(Br)c(NCc2cccc([O-])c2Cl)c1 ZINC000380829489 1053044345 /nfs/dbraw/zinc/04/43/45/1053044345.db2.gz JBYBKVKDJBOKKP-UHFFFAOYSA-N -1 1 342.620 4.429 20 0 EIADMM C[C@@H](Sc1nc(C2CC2)cc(=O)[n-]1)c1nc(-c2cccs2)no1 ZINC000195079716 1053051232 /nfs/dbraw/zinc/05/12/32/1053051232.db2.gz ZYEILXJGVIXVBR-MRVPVSSYSA-N -1 1 346.437 4.024 20 0 EIADMM O=C(Nc1ccc(-c2cccc(O)c2)cc1)c1c[n-]c(C(F)(F)F)n1 ZINC001194783494 1053091122 /nfs/dbraw/zinc/09/11/22/1053091122.db2.gz OPOGZLJAJDWNAE-UHFFFAOYSA-N -1 1 347.296 4.053 20 0 EIADMM O=C([O-])CCc1cccc(CNCc2csc(C(F)(F)F)c2)c1 ZINC000864518927 1053300083 /nfs/dbraw/zinc/30/00/83/1053300083.db2.gz YVFWEPSAZVNPMS-UHFFFAOYSA-N -1 1 343.370 4.074 20 0 EIADMM COc1cc(C)c([N-]S(=O)(=O)c2c(C)cccc2Cl)c(C)c1 ZINC001195309943 1053374398 /nfs/dbraw/zinc/37/43/98/1053374398.db2.gz QKXGADDQBFOIOK-UHFFFAOYSA-N -1 1 339.844 4.075 20 0 EIADMM Cc1c(=O)[n-]c(S[C@@H](C)C(=O)C(C)(C)C)nc1-c1ccccc1 ZINC000865364999 1053484491 /nfs/dbraw/zinc/48/44/91/1053484491.db2.gz YVUKCRHFRDXXTK-LBPRGKRZSA-N -1 1 330.453 4.253 20 0 EIADMM [O-]c1cc(F)c(NC(=S)Nc2ccc(C(F)(F)F)cc2)cc1F ZINC001196189365 1053598817 /nfs/dbraw/zinc/59/88/17/1053598817.db2.gz KCXUJPCDUFZPOL-UHFFFAOYSA-N -1 1 348.296 4.498 20 0 EIADMM COc1cccc([N-]S(=O)(=O)c2ccc3cc(Cl)ccc3c2)c1 ZINC001196412708 1053665483 /nfs/dbraw/zinc/66/54/83/1053665483.db2.gz PRTMVESFSJZZHW-UHFFFAOYSA-N -1 1 347.823 4.303 20 0 EIADMM [O-]c1cc(F)ccc1NC(=S)Nc1ccc(Br)cc1 ZINC001196622111 1053714993 /nfs/dbraw/zinc/71/49/93/1053714993.db2.gz RVLBABXMSVBMQB-UHFFFAOYSA-N -1 1 341.205 4.103 20 0 EIADMM Cc1ccc(F)c([N-]S(=O)(=O)c2cc(Cl)sc2Cl)c1 ZINC000020627320 1053724205 /nfs/dbraw/zinc/72/42/05/1053724205.db2.gz MQOYPJIHIXIUJT-UHFFFAOYSA-N -1 1 340.228 4.303 20 0 EIADMM CC[C@H](OC1CCCCC1)C(=O)Nc1cc(F)c([O-])cc1Cl ZINC000885676925 1053800113 /nfs/dbraw/zinc/80/01/13/1053800113.db2.gz WVVWBCXZRDWBBY-HNNXBMFYSA-N -1 1 329.799 4.251 20 0 EIADMM CCC(C)(CC)NC(=O)CCn1c(-c2ccc(C)cc2)n[n-]c1=S ZINC000112938158 1053870491 /nfs/dbraw/zinc/87/04/91/1053870491.db2.gz SEGJXMOMDVGRSE-UHFFFAOYSA-N -1 1 346.500 4.001 20 0 EIADMM O=C(Nc1nc(-c2c(F)cccc2F)cs1)c1ccccc1[O-] ZINC000031811976 1054081691 /nfs/dbraw/zinc/08/16/91/1054081691.db2.gz IZEHVVNGQTZMAT-UHFFFAOYSA-N -1 1 332.331 4.046 20 0 EIADMM CCCc1ccccc1[N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1 ZINC000032098412 1054091838 /nfs/dbraw/zinc/09/18/38/1054091838.db2.gz SXOBDCMFUSHCCJ-UHFFFAOYSA-N -1 1 343.370 4.459 20 0 EIADMM CC(=O)c1ccc([N-]S(=O)(=O)c2ccc(CCC(C)C)cc2)cc1 ZINC000032531841 1054105493 /nfs/dbraw/zinc/10/54/93/1054105493.db2.gz GCZUWXDGEJBSGO-UHFFFAOYSA-N -1 1 345.464 4.279 20 0 EIADMM CC(C)c1ccc(S(=O)(=O)[N-]c2cccc(-c3cnco3)c2)cc1 ZINC000033899385 1054129848 /nfs/dbraw/zinc/12/98/48/1054129848.db2.gz VRFOXYLSRIZFTR-UHFFFAOYSA-N -1 1 342.420 4.266 20 0 EIADMM CCS[C@@H]1CCC[C@@H](NC(=O)c2ccc3ccccc3c2[O-])C1 ZINC001149045319 1054168710 /nfs/dbraw/zinc/16/87/10/1054168710.db2.gz SYRQOAAZQVAGEP-HUUCEWRRSA-N -1 1 329.465 4.340 20 0 EIADMM CC(C)([N-]C(=O)C(F)(F)c1c(F)cccc1F)c1cccc(F)c1 ZINC000857453445 1054251014 /nfs/dbraw/zinc/25/10/14/1054251014.db2.gz IPQWSTJZBMPBTI-UHFFFAOYSA-N -1 1 343.295 4.247 20 0 EIADMM O=S(=O)([N-]c1cc(F)cc(Cl)c1)c1ccc2occc2c1 ZINC001198854303 1054280382 /nfs/dbraw/zinc/28/03/82/1054280382.db2.gz BBYGCCKZXYNASY-UHFFFAOYSA-N -1 1 325.748 4.026 20 0 EIADMM [O-]c1c(F)cc(Br)cc1NC(=S)Nc1ccccc1 ZINC000169055229 1054506956 /nfs/dbraw/zinc/50/69/56/1054506956.db2.gz HPOQTMAARKSUNR-UHFFFAOYSA-N -1 1 341.205 4.103 20 0 EIADMM CSc1ccc([O-])c(C(=O)Nc2cccc(CC(F)(F)F)c2)c1 ZINC001137090363 1054794047 /nfs/dbraw/zinc/79/40/47/1054794047.db2.gz DRSIPQNWCKMJQF-UHFFFAOYSA-N -1 1 341.354 4.471 20 0 EIADMM Cc1cccc(C)c1[N-]S(=O)(=O)c1ccc(F)c(C(F)(F)F)c1 ZINC000063911386 1054841690 /nfs/dbraw/zinc/84/16/90/1054841690.db2.gz BFJLWDMINIDHJJ-UHFFFAOYSA-N -1 1 347.333 4.262 20 0 EIADMM COc1ccc(C(=O)Nc2ccc3nc(C4CC4)sc3c2)c([O-])c1 ZINC000063962929 1054845493 /nfs/dbraw/zinc/84/54/93/1054845493.db2.gz CXLLJJBCMGOFHA-UHFFFAOYSA-N -1 1 340.404 4.140 20 0 EIADMM CC(C)CCOc1cccc([N-]S(=O)(=O)c2ccc(F)cc2)c1 ZINC000064374031 1054856356 /nfs/dbraw/zinc/85/63/56/1054856356.db2.gz DKSIHIRWZLHBOH-UHFFFAOYSA-N -1 1 337.416 4.051 20 0 EIADMM CC(C)N(Cc1ccccc1)C(=O)NCc1ccc([O-])c(Cl)c1 ZINC000876395295 1054893894 /nfs/dbraw/zinc/89/38/94/1054893894.db2.gz ZUECSBIJPCMELE-UHFFFAOYSA-N -1 1 332.831 4.166 20 0 EIADMM O=C(Nc1ccccc1Br)Nc1cc(F)cc(F)c1[O-] ZINC001201979500 1054957379 /nfs/dbraw/zinc/95/73/79/1054957379.db2.gz HWEGJVAJRKKMDC-UHFFFAOYSA-N -1 1 343.127 4.077 20 0 EIADMM C[C@H](NC(=O)c1c([O-])cccc1Cl)c1ccc2ncsc2c1 ZINC000777208460 1054968464 /nfs/dbraw/zinc/96/84/64/1054968464.db2.gz OCPFXFNGOJEGPH-VIFPVBQESA-N -1 1 332.812 4.146 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1cnn(-c2ccccc2Cl)c1 ZINC000111667019 1055225964 /nfs/dbraw/zinc/22/59/64/1055225964.db2.gz GGAIRKDTBVZHCF-UHFFFAOYSA-N -1 1 348.189 4.137 20 0 EIADMM O=S(=O)([N-]c1ccccc1COc1ccccc1)c1ccccc1 ZINC000055688117 1055808945 /nfs/dbraw/zinc/80/89/45/1055808945.db2.gz DRJNRJODIFENPU-UHFFFAOYSA-N -1 1 339.416 4.066 20 0 EIADMM COc1ccccc1[C@@H]1CC[C@H](C)CN1C(=O)c1ccc([O-])c(F)c1 ZINC000672141439 1056667201 /nfs/dbraw/zinc/66/72/01/1056667201.db2.gz JRARLLGITWHVEC-GUYCJALGSA-N -1 1 343.398 4.153 20 0 EIADMM O=C([N-]c1nnc(C2CCCCC2)s1)c1c(F)cc(F)cc1F ZINC000741524531 1058267599 /nfs/dbraw/zinc/26/75/99/1058267599.db2.gz NGKDILXLVNNYIM-UHFFFAOYSA-N -1 1 341.358 4.255 20 0 EIADMM Cc1cc(-n2cccn2)ccc1NC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000192315547 1060202527 /nfs/dbraw/zinc/20/25/27/1060202527.db2.gz VAGBHIJUFOWKJI-UHFFFAOYSA-N -1 1 342.786 4.184 20 0 EIADMM CCC(=CC(=O)Nc1ccc(-n2ccc(=O)[n-]2)cc1)c1ccc(C)cc1 ZINC001168914844 1060516960 /nfs/dbraw/zinc/51/69/60/1060516960.db2.gz OMYIZLKAKZQFHC-JQIJEIRASA-N -1 1 347.418 4.318 20 0 EIADMM O=C(CCCc1ccc2c(c1)-c1ccccc1C2)[N-]OCC(F)(F)F ZINC000766774404 1060887569 /nfs/dbraw/zinc/88/75/69/1060887569.db2.gz FCBRCRLIQALTCY-UHFFFAOYSA-N -1 1 349.352 4.191 20 0 EIADMM CCc1cc(=O)[n-]c(SCCSc2ccc(Cl)cc2)n1 ZINC000767058613 1061093133 /nfs/dbraw/zinc/09/31/33/1061093133.db2.gz YSUGLZURIPYFLX-UHFFFAOYSA-N -1 1 326.874 4.282 20 0 EIADMM C[C@H](NC(=O)c1ccc([O-])c(F)c1)c1ccccc1C(F)(F)F ZINC000767327263 1061200724 /nfs/dbraw/zinc/20/07/24/1061200724.db2.gz LEYHDPFQRAIVLS-VIFPVBQESA-N -1 1 327.277 4.041 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2cccc(OC(F)(F)F)c2)c(C)c1 ZINC000024429676 202116315 /nfs/dbraw/zinc/11/63/15/202116315.db2.gz JBQIOZCQJRESJE-UHFFFAOYSA-N -1 1 345.342 4.003 20 0 EIADMM CSc1ccc([N-]S(=O)(=O)c2ccc(C)c(Cl)c2)cc1 ZINC000033904836 202270738 /nfs/dbraw/zinc/27/07/38/202270738.db2.gz CAKQFDAIUSUXRV-UHFFFAOYSA-N -1 1 327.858 4.171 20 0 EIADMM Cc1ccc(F)c(S(=O)(=O)[N-]c2ccc(Cl)cc2Cl)c1 ZINC000071974111 203155110 /nfs/dbraw/zinc/15/51/10/203155110.db2.gz ARWNZHNRCYMALV-UHFFFAOYSA-N -1 1 334.199 4.242 20 0 EIADMM CCCc1cc(C(=O)[N-]c2cc(F)ccc2SCC(F)F)no1 ZINC000449948239 1032145868 /nfs/dbraw/zinc/14/58/68/1032145868.db2.gz LJSSMHPOWVFWOG-UHFFFAOYSA-N -1 1 344.358 4.376 20 0 EIADMM CCc1ccc(S(=O)(=O)[N-]c2ccc(SC(F)F)cc2)cc1 ZINC000005133191 1032158324 /nfs/dbraw/zinc/15/83/24/1032158324.db2.gz YPIXZFUTLJMYQG-UHFFFAOYSA-N -1 1 343.420 4.365 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1CCC[C@H](c2nccs2)C1 ZINC000170890834 1032231961 /nfs/dbraw/zinc/23/19/61/1032231961.db2.gz XXFSAJNMGDUTOO-HNNXBMFYSA-N -1 1 338.432 4.022 20 0 EIADMM Cc1ccccc1[C@@H]1C[C@H](C)N(C(=O)c2c([O-])cccc2Cl)C1 ZINC000738543777 1032421227 /nfs/dbraw/zinc/42/12/27/1032421227.db2.gz KKFJZGYKMAUKGK-UONOGXRCSA-N -1 1 329.827 4.372 20 0 EIADMM CO[C@@H]1CCCC[C@H]1C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000529539294 1032444250 /nfs/dbraw/zinc/44/42/50/1032444250.db2.gz QEIUWIYTDSBOQQ-CZUORRHYSA-N -1 1 333.815 4.343 20 0 EIADMM C[C@H](NCc1cccc([O-])c1Cl)c1nc(-c2ccncc2)cs1 ZINC000339270923 1018725945 /nfs/dbraw/zinc/72/59/45/1018725945.db2.gz IUWRLSVYUIBDQJ-NSHDSACASA-N -1 1 345.855 4.415 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2ccc(F)cc2C)c(Cl)cc1F ZINC000471123372 1019003340 /nfs/dbraw/zinc/00/33/40/1019003340.db2.gz FSKLYFNNWQHYDH-UHFFFAOYSA-N -1 1 331.771 4.036 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2cccc(C(F)(F)F)c2C)cc1F ZINC000471129554 1019042258 /nfs/dbraw/zinc/04/22/58/1019042258.db2.gz CUQWHOBPUCERMS-UHFFFAOYSA-N -1 1 347.333 4.262 20 0 EIADMM Cc1ccc(CC2CN(C(=O)c3cc4ccccc4cc3[O-])C2)cc1 ZINC001167097960 1020020396 /nfs/dbraw/zinc/02/03/96/1020020396.db2.gz WWBWXWOEISDDJI-UHFFFAOYSA-N -1 1 331.415 4.169 20 0 EIADMM C[C@H](Oc1ccccc1NC(=O)c1cncc([O-])c1)c1ccccc1 ZINC000339955003 1020196161 /nfs/dbraw/zinc/19/61/61/1020196161.db2.gz LAQZDZRDIRUWTC-AWEZNQCLSA-N -1 1 334.375 4.180 20 0 EIADMM CC(C)c1ccc(C(=O)N2CCN(C3CC3)c3ccccc32)c([O-])c1 ZINC001625842038 1020258345 /nfs/dbraw/zinc/25/83/45/1020258345.db2.gz OUDPERYTBLNBCX-UHFFFAOYSA-N -1 1 336.435 4.145 20 0 EIADMM CC(C)(C)OC(=O)Nc1ccc(C(=O)NCCCC2CCC2)c([O-])c1 ZINC001167181244 1020494550 /nfs/dbraw/zinc/49/45/50/1020494550.db2.gz KUYNOHWKMSCLTA-UHFFFAOYSA-N -1 1 348.443 4.049 20 0 EIADMM COc1cc([N-]S(=O)(=O)c2ccccc2)c(C2CC2)cc1Cl ZINC000655602936 1020848119 /nfs/dbraw/zinc/84/81/19/1020848119.db2.gz PFPDCJJFROTLJX-UHFFFAOYSA-N -1 1 337.828 4.027 20 0 EIADMM CCCCc1nnc([N-]C(=O)c2coc(C3CCCCC3)n2)s1 ZINC000547932181 1020895823 /nfs/dbraw/zinc/89/58/23/1020895823.db2.gz BCTFSUBAWDGHDC-UHFFFAOYSA-N -1 1 334.445 4.169 20 0 EIADMM O=C([N-]c1cccc(Cl)c1SCC(F)F)c1nccs1 ZINC000683567495 1020898196 /nfs/dbraw/zinc/89/81/96/1020898196.db2.gz PVIWTQBDYUJTBP-UHFFFAOYSA-N -1 1 334.800 4.406 20 0 EIADMM CC(C)Oc1ncc(-c2nc(-c3ccc([O-])cc3F)no2)cc1Cl ZINC000683592066 1020945309 /nfs/dbraw/zinc/94/53/09/1020945309.db2.gz JHLKNFLUHYECQR-UHFFFAOYSA-N -1 1 349.749 4.084 20 0 EIADMM [O-]c1ccc(-c2noc([C@H]3CCc4c3cccc4Cl)n2)cc1F ZINC000683594605 1020951174 /nfs/dbraw/zinc/95/11/74/1020951174.db2.gz ZJCWANFBOLAYJE-LBPRGKRZSA-N -1 1 330.746 4.313 20 0 EIADMM CN1CCCN(C(=O)c2cc3ccccc3cc2[O-])c2ccccc21 ZINC000172429455 1021855806 /nfs/dbraw/zinc/85/58/06/1021855806.db2.gz DNLAQHORNUJUFN-UHFFFAOYSA-N -1 1 332.403 4.032 20 0 EIADMM C[C@H](CC(=O)N1CCC(C(=O)c2ccc([O-])cc2)CC1)CC(C)(C)C ZINC000613346794 1021883041 /nfs/dbraw/zinc/88/30/41/1021883041.db2.gz ITFPCBITKAGFCU-OAHLLOKOSA-N -1 1 345.483 4.276 20 0 EIADMM CCOC1(C)CCN([C@H](C(=O)[O-])c2cccc(Cl)c2Cl)CC1 ZINC000580451425 1022036319 /nfs/dbraw/zinc/03/63/19/1022036319.db2.gz GWKGGCDCJMPHLQ-AWEZNQCLSA-N -1 1 346.254 4.010 20 0 EIADMM O=C([O-])[C@H](NCc1ccc(F)cc1Cl)c1ccc(Cl)cc1 ZINC000756334184 1022077655 /nfs/dbraw/zinc/07/76/55/1022077655.db2.gz ZWLCZZLWTDLDSC-CQSZACIVSA-N -1 1 328.170 4.048 20 0 EIADMM O=S(=O)([N-]c1ccc(CCC(F)(F)F)cc1)c1cccc(F)c1 ZINC000175777204 1022451739 /nfs/dbraw/zinc/45/17/39/1022451739.db2.gz DSLRJLKIUUYIAM-UHFFFAOYSA-N -1 1 347.333 4.121 20 0 EIADMM COC(=O)c1ccc(-c2cc(F)c([O-])cc2F)cc1C(F)(F)F ZINC001211339355 1022521567 /nfs/dbraw/zinc/52/15/67/1022521567.db2.gz NDVVYJNQUVFGFM-UHFFFAOYSA-N -1 1 332.224 4.143 20 0 EIADMM Cc1[nH]c2ccc(C(=O)Nc3ccc(-c4cc(=O)[nH][n-]4)cc3)cc2c1C ZINC000339118247 1022601217 /nfs/dbraw/zinc/60/12/17/1022601217.db2.gz DMDUIQBMTYUGJV-UHFFFAOYSA-N -1 1 346.390 4.133 20 0 EIADMM Cc1c([N-]S(=O)(=O)c2cccc3ccccc32)cccc1N(C)C ZINC000181156824 1022605103 /nfs/dbraw/zinc/60/51/03/1022605103.db2.gz ZTSMJEWQPGUTRS-UHFFFAOYSA-N -1 1 340.448 4.015 20 0 EIADMM CCOc1cc(C(=O)N2[C@H](C)C[C@@H]3CCCC[C@@H]32)cc(Cl)c1[O-] ZINC000186816260 1022747757 /nfs/dbraw/zinc/74/77/57/1022747757.db2.gz BYTHZKBAGAOGIN-XUJVJEKNSA-N -1 1 337.847 4.238 20 0 EIADMM CC(=O)[C@@H]1C[C@H](C(=O)Nc2cc(Cl)c([O-])c3ccccc23)C1(C)C ZINC001167444679 1022817725 /nfs/dbraw/zinc/81/77/25/1022817725.db2.gz KSISTNPSRURXNV-UONOGXRCSA-N -1 1 345.826 4.389 20 0 EIADMM O=C(c1cc(Cl)ccc1[O-])N1CC=C(c2ccc(F)cc2)CC1 ZINC000178904188 1023187771 /nfs/dbraw/zinc/18/77/71/1023187771.db2.gz ORABFIRUBCRFJQ-UHFFFAOYSA-N -1 1 331.774 4.114 20 0 EIADMM O=C(Nc1cc([O-])c(F)cc1F)c1cc2c(cccc2C2CC2)[nH]1 ZINC001625896448 1023215362 /nfs/dbraw/zinc/21/53/62/1023215362.db2.gz MYUXDADAFYEWEW-UHFFFAOYSA-N -1 1 328.318 4.281 20 0 EIADMM O=C(c1ccc([O-])cc1F)N(Cc1cccs1)Cc1cccs1 ZINC000181060850 1023235902 /nfs/dbraw/zinc/23/59/02/1023235902.db2.gz BZJQVQUITGUZEC-UHFFFAOYSA-N -1 1 347.436 4.497 20 0 EIADMM O=C([O-])c1cccc2c1CC[N@@H+](CCSc1ccc(Cl)cc1)C2 ZINC000581500602 1023307814 /nfs/dbraw/zinc/30/78/14/1023307814.db2.gz YFAUTCZWNLVXSB-UHFFFAOYSA-N -1 1 347.867 4.189 20 0 EIADMM C[C@H](Oc1ccc2ccccc2c1)C(=O)Nc1c([O-])cccc1F ZINC000684293215 1023332780 /nfs/dbraw/zinc/33/27/80/1023332780.db2.gz GTSJMYGZUOTAKE-LBPRGKRZSA-N -1 1 325.339 4.091 20 0 EIADMM Cc1oc([C@@H](C)N2CC[C@@H](C(F)(F)F)C(C)(C)C2)cc1C(=O)[O-] ZINC000581553826 1023357482 /nfs/dbraw/zinc/35/74/82/1023357482.db2.gz HRSKIOCDVKRFNF-NOZJJQNGSA-N -1 1 333.350 4.258 20 0 EIADMM CCSc1ccc(Cl)cc1[N-]C(=O)c1ccnc(F)c1F ZINC000188923258 1023392021 /nfs/dbraw/zinc/39/20/21/1023392021.db2.gz AIVKKPRBSZVMTI-UHFFFAOYSA-N -1 1 328.771 4.378 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2cccc(Cl)c2C)cc(C)c1F ZINC000460436474 1023544964 /nfs/dbraw/zinc/54/49/64/1023544964.db2.gz IACOXQXJKQMBER-UHFFFAOYSA-N -1 1 327.808 4.205 20 0 EIADMM [O-]c1ccc(-c2noc([C@H]3CC[C@@H](c4ccccc4)O3)n2)cc1F ZINC000377461612 1023553729 /nfs/dbraw/zinc/55/37/29/1023553729.db2.gz VWTXTFMZJBIFSO-JKSUJKDBSA-N -1 1 326.327 4.174 20 0 EIADMM COc1cc(OC)c(NCc2cccc([O-])c2Cl)cc1Cl ZINC000328506096 1023586600 /nfs/dbraw/zinc/58/66/00/1023586600.db2.gz ZTOOBWLMCZXLOH-UHFFFAOYSA-N -1 1 328.195 4.328 20 0 EIADMM O=S(=O)([N-]c1ccc(F)c(Cl)c1)c1cccc(C(F)F)c1 ZINC000780366029 1023813493 /nfs/dbraw/zinc/81/34/93/1023813493.db2.gz RIRVEJYSBMFBEZ-UHFFFAOYSA-N -1 1 335.734 4.218 20 0 EIADMM CC[C@H](C)Oc1ccc([N-]S(=O)(=O)c2cccc(Cl)c2)cc1 ZINC000511696050 1023829240 /nfs/dbraw/zinc/82/92/40/1023829240.db2.gz TXWKRTFIUSETBG-LBPRGKRZSA-N -1 1 339.844 4.318 20 0 EIADMM CC[C@@H](C)Oc1cccc([N-]S(=O)(=O)c2ccc(Cl)cc2)c1 ZINC000511730178 1023841196 /nfs/dbraw/zinc/84/11/96/1023841196.db2.gz QDUOFWNTMANISD-GFCCVEGCSA-N -1 1 339.844 4.318 20 0 EIADMM CCn1c2ccc(C(=O)[O-])cc2nc1CN1CCC(C)(C(C)C)CC1 ZINC000581949058 1023921960 /nfs/dbraw/zinc/92/19/60/1023921960.db2.gz LZGLZHKWAJWHAC-UHFFFAOYSA-N -1 1 343.471 4.013 20 0 EIADMM CC(C)(C)N(Cc1ccsc1)Cc1nc(=O)c2sccc2[n-]1 ZINC000661136248 1024266602 /nfs/dbraw/zinc/26/66/02/1024266602.db2.gz POUUJDFFQQGZCO-UHFFFAOYSA-N -1 1 333.482 4.259 20 0 EIADMM Cc1ccc(-c2nsc([N-]C(=O)c3oc(C4CC4)nc3C)n2)s1 ZINC000544818044 1033202932 /nfs/dbraw/zinc/20/29/32/1033202932.db2.gz ZHJRDEODDDSLLY-UHFFFAOYSA-N -1 1 346.437 4.001 20 0 EIADMM CCC[C@H](C)[N-]S(=O)(=O)c1c(Cl)cc(Cl)cc1Cl ZINC000048664473 1024686967 /nfs/dbraw/zinc/68/69/67/1024686967.db2.gz NYSJDPCMLLABMI-ZETCQYMHSA-N -1 1 330.664 4.114 20 0 EIADMM CCN(CCC(F)(F)F)Cc1nc2ccccc2c(C)c1C(=O)[O-] ZINC000652405572 1024816636 /nfs/dbraw/zinc/81/66/36/1024816636.db2.gz UVFBUPZVFPCHSL-UHFFFAOYSA-N -1 1 340.345 4.016 20 0 EIADMM Cc1oc(CN(C)CCOc2cccc(C(C)(C)C)c2)cc1C(=O)[O-] ZINC000652454374 1024841417 /nfs/dbraw/zinc/84/14/17/1024841417.db2.gz QAJICNFDRVLBEX-UHFFFAOYSA-N -1 1 345.439 4.095 20 0 EIADMM Cc1ccc(-c2csc(CN3CCC[C@H](CCC(=O)[O-])C3)n2)cc1 ZINC000652495358 1024854425 /nfs/dbraw/zinc/85/44/25/1024854425.db2.gz UNILHGMFFRWGOK-OAHLLOKOSA-N -1 1 344.480 4.195 20 0 EIADMM O=C([O-])CC[C@H](CNCc1c(Cl)cccc1Cl)C(F)(F)F ZINC000663262179 1024963036 /nfs/dbraw/zinc/96/30/36/1024963036.db2.gz QOIYQRYYXGZMME-MRVPVSSYSA-N -1 1 344.160 4.126 20 0 EIADMM O=C([O-])C[C@H](NCc1ccc(CSC(F)F)o1)c1ccsc1 ZINC000277020678 1024998985 /nfs/dbraw/zinc/99/89/85/1024998985.db2.gz OGLHFPWKSPBBCE-LBPRGKRZSA-N -1 1 347.408 4.103 20 0 EIADMM Cc1ccc2oc(C(=O)Nc3ccc(-c4cc(=O)[nH][n-]4)cc3)cc2c1 ZINC000342002659 1025033357 /nfs/dbraw/zinc/03/33/57/1025033357.db2.gz JTWOBTKDSQMZGE-UHFFFAOYSA-N -1 1 333.347 4.089 20 0 EIADMM CSCc1c2ccccc2oc1C(=O)Nc1ccc(F)cc1[O-] ZINC000610861067 1025075853 /nfs/dbraw/zinc/07/58/53/1025075853.db2.gz NFVCURQROLTQAB-UHFFFAOYSA-N -1 1 331.368 4.393 20 0 EIADMM Cc1cc(F)ccc1S(=O)(=O)[N-]c1ccc(-c2nccs2)cc1 ZINC000096695251 1025136749 /nfs/dbraw/zinc/13/67/49/1025136749.db2.gz BXSIREVPLOKGBZ-UHFFFAOYSA-N -1 1 348.424 4.058 20 0 EIADMM CCCc1csc(NC(=O)c2cc(Cl)c([O-])c(OCC)c2)n1 ZINC000186982474 1025148606 /nfs/dbraw/zinc/14/86/06/1025148606.db2.gz WHSZDYLWBIJNPJ-UHFFFAOYSA-N -1 1 340.832 4.106 20 0 EIADMM CSc1ccccc1[N-]C(=O)c1cc(-c2cccc(F)c2)no1 ZINC000041751524 1025338618 /nfs/dbraw/zinc/33/86/18/1025338618.db2.gz XGDHOJXPBPVRKQ-UHFFFAOYSA-N -1 1 328.368 4.455 20 0 EIADMM COc1ccc([N-]S(=O)(=O)c2cccc3ccccc32)cc1Cl ZINC000323558197 1025357827 /nfs/dbraw/zinc/35/78/27/1025357827.db2.gz QBJLSHLVNLTSDG-UHFFFAOYSA-N -1 1 347.823 4.303 20 0 EIADMM CSc1cccc(CSc2nc([O-])cc(=O)n2C2CCCC2)c1 ZINC000657243349 1025360163 /nfs/dbraw/zinc/36/01/63/1025360163.db2.gz NAYPOUNLBKTWEZ-UHFFFAOYSA-N -1 1 348.493 4.078 20 0 EIADMM CO[C@H](CSc1nc(-c2ccccc2)c(C)c(=O)[n-]1)C1CCCC1 ZINC000657256759 1025419820 /nfs/dbraw/zinc/41/98/20/1025419820.db2.gz FVJREEPJFWFLAP-MRXNPFEDSA-N -1 1 344.480 4.455 20 0 EIADMM CCc1nc(SCc2cccc(Br)c2)[n-]c(=O)c1C ZINC000657263942 1025455359 /nfs/dbraw/zinc/45/53/59/1025455359.db2.gz PSBFQNHKKQAKLL-UHFFFAOYSA-N -1 1 339.258 4.108 20 0 EIADMM Cc1cnc(C(=O)N(Cc2ccc3ccccc3c2)C2CC2)c([O-])c1 ZINC000426644866 1025840690 /nfs/dbraw/zinc/84/06/90/1025840690.db2.gz XXLPOIADEGRCOH-UHFFFAOYSA-N -1 1 332.403 4.054 20 0 EIADMM CC(C)CN(C(=O)c1ccc([O-])cn1)[C@@H](C)c1ccccc1Cl ZINC001143435478 1026115761 /nfs/dbraw/zinc/11/57/61/1026115761.db2.gz RJRCDJQEEKOLRK-ZDUSSCGKSA-N -1 1 332.831 4.300 20 0 EIADMM CC1(C)CC(=O)c2cc(NC(=O)c3cc([O-])ccc3Cl)ccc2O1 ZINC000365615658 1026263852 /nfs/dbraw/zinc/26/38/52/1026263852.db2.gz ZAZUXIWPHDZEHW-UHFFFAOYSA-N -1 1 345.782 4.042 20 0 EIADMM CCOc1ccc(C(=O)CCC(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000111666291 1026315653 /nfs/dbraw/zinc/31/56/53/1026315653.db2.gz DKVKVGBYVWCIFP-UHFFFAOYSA-N -1 1 347.798 4.046 20 0 EIADMM O=C([O-])c1cccc(CNCc2ccc(-c3ccccc3)cc2F)c1 ZINC000426673367 1026439647 /nfs/dbraw/zinc/43/96/47/1026439647.db2.gz WYOYIFYPCIASPS-UHFFFAOYSA-N -1 1 335.378 4.481 20 0 EIADMM Cc1ccc(-c2ccc(CNCc3cc(C(=O)[O-])co3)s2)cc1 ZINC000426713274 1026496442 /nfs/dbraw/zinc/49/64/42/1026496442.db2.gz DGXQQVBYGSFPLW-UHFFFAOYSA-N -1 1 327.405 4.305 20 0 EIADMM O=C([O-])c1coc(CNCc2ccc(-c3ccccc3F)s2)c1 ZINC000426713041 1026509731 /nfs/dbraw/zinc/50/97/31/1026509731.db2.gz ARULTUSYRFWGKU-UHFFFAOYSA-N -1 1 331.368 4.135 20 0 EIADMM C[C@@H](C(=O)[O-])[C@H](NCc1ccccc1Br)c1ccccc1 ZINC000426740547 1026521604 /nfs/dbraw/zinc/52/16/04/1026521604.db2.gz BFGUESGJYPWPGP-WBMJQRKESA-N -1 1 348.240 4.001 20 0 EIADMM Cc1ccc(CN[C@@H](CC(=O)[O-])c2cc(Cl)cc(Cl)c2)o1 ZINC000426745184 1026525815 /nfs/dbraw/zinc/52/58/15/1026525815.db2.gz FXOIXICMCKDIDC-AWEZNQCLSA-N -1 1 328.195 4.200 20 0 EIADMM O=C([O-])[C@@H](NCc1ccc(F)cc1Cl)c1cccc(Cl)c1 ZINC000426744045 1026526367 /nfs/dbraw/zinc/52/63/67/1026526367.db2.gz VWSFLOZIXAXQQP-AWEZNQCLSA-N -1 1 328.170 4.048 20 0 EIADMM O=C([O-])[C@@H](NCc1cccc2[nH]ccc21)c1c(Cl)cccc1Cl ZINC000426752660 1026537698 /nfs/dbraw/zinc/53/76/98/1026537698.db2.gz AUNNBVWMSSDMBP-INIZCTEOSA-N -1 1 349.217 4.390 20 0 EIADMM O=C([O-])[C@@H](NCc1cc(Cl)ccc1Cl)c1ccc(F)cc1 ZINC000426772240 1026551087 /nfs/dbraw/zinc/55/10/87/1026551087.db2.gz CMSVLJBELHJDPF-AWEZNQCLSA-N -1 1 328.170 4.048 20 0 EIADMM CCc1ccc(-c2ccc(CN[C@H](CC(C)(C)C)C(=O)[O-])o2)cc1 ZINC000426778242 1026552025 /nfs/dbraw/zinc/55/20/25/1026552025.db2.gz VYGVDVIMJFSEDW-QGZVFWFLSA-N -1 1 329.440 4.488 20 0 EIADMM Cc1ccc([C@H](CC(=O)[O-])NCc2ccc(Cl)c(Cl)c2)o1 ZINC000426782252 1026556418 /nfs/dbraw/zinc/55/64/18/1026556418.db2.gz FDYINUOWQNVGME-ZDUSSCGKSA-N -1 1 328.195 4.200 20 0 EIADMM Cc1ccc([C@@H](CC(=O)[O-])NCc2ccc(F)c(C(F)(F)F)c2)o1 ZINC000426765342 1026558198 /nfs/dbraw/zinc/55/81/98/1026558198.db2.gz MSHPZEUQXCWDIA-CYBMUJFWSA-N -1 1 345.292 4.052 20 0 EIADMM CCOc1cc(C(=O)N(C)C(C)(C)c2ccccc2)cc(Cl)c1[O-] ZINC000671894025 1026563970 /nfs/dbraw/zinc/56/39/70/1026563970.db2.gz KYRRXCSYXXWQNR-UHFFFAOYSA-N -1 1 347.842 4.452 20 0 EIADMM Cc1cc([C@H](NCc2ccsc2Cl)C(=O)[O-])ccc1Cl ZINC000426799165 1026569250 /nfs/dbraw/zinc/56/92/50/1026569250.db2.gz KIGWTKLVCWZOKT-LBPRGKRZSA-N -1 1 330.236 4.279 20 0 EIADMM COc1ccc2cc(CN[C@H](CC(=O)[O-])c3ccc(C)o3)ccc2c1 ZINC000426808394 1026574113 /nfs/dbraw/zinc/57/41/13/1026574113.db2.gz MHMHJACTZYLLCI-GOSISDBHSA-N -1 1 339.391 4.055 20 0 EIADMM Cc1cc([C@H](NCc2ccc(Cl)cc2F)C(=O)[O-])ccc1Cl ZINC000426826565 1026584024 /nfs/dbraw/zinc/58/40/24/1026584024.db2.gz FKKRTVQXUJQBQL-HNNXBMFYSA-N -1 1 342.197 4.356 20 0 EIADMM O=C([O-])C[C@H](NCc1ccc(F)c(Cl)c1)c1ccc(F)cc1F ZINC000426830129 1026585396 /nfs/dbraw/zinc/58/53/96/1026585396.db2.gz VLIBZLFVBWMUFL-HNNXBMFYSA-N -1 1 343.732 4.063 20 0 EIADMM Cc1ccc(CN(C)C(=O)c2ccc(C(F)(F)F)c([O-])c2)s1 ZINC000684872503 1026638702 /nfs/dbraw/zinc/63/87/02/1026638702.db2.gz MGTKZWSIJHUCOX-UHFFFAOYSA-N -1 1 329.343 4.053 20 0 EIADMM CCOCc1cccc(NC(=O)c2ccc(C(F)(F)F)c([O-])c2)c1 ZINC000684872293 1026639368 /nfs/dbraw/zinc/63/93/68/1026639368.db2.gz HGBBGRRZDXNRRE-UHFFFAOYSA-N -1 1 339.313 4.200 20 0 EIADMM CCN(CCc1ccccc1)C(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684873630 1026644938 /nfs/dbraw/zinc/64/49/38/1026644938.db2.gz YPFAJGVAPQYENJ-UHFFFAOYSA-N -1 1 337.341 4.116 20 0 EIADMM CSc1ccc([O-])c(C(=O)N(C)c2ccc(OC(C)C)cc2)c1 ZINC000614006445 1026725540 /nfs/dbraw/zinc/72/55/40/1026725540.db2.gz VYTBXXJNDSOGGQ-UHFFFAOYSA-N -1 1 331.437 4.178 20 0 EIADMM Cc1cnc(C(=O)N(C)[C@@H](C)[C@@H](C)c2ccc(Cl)cc2)c([O-])c1 ZINC000427249481 1026788546 /nfs/dbraw/zinc/78/85/46/1026788546.db2.gz NCNYTKJDVVGDBC-OLZOCXBDSA-N -1 1 332.831 4.013 20 0 EIADMM CCOC(=O)c1cnc(C(C)=Cc2cc3ccccc3s2)[n-]c1=O ZINC000432697842 1026788501 /nfs/dbraw/zinc/78/85/01/1026788501.db2.gz XXKUDALNTHRMBI-FLIBITNWSA-N -1 1 340.404 4.134 20 0 EIADMM Cc1ccc(-c2csc3[nH]c(-c4ccc([O-])cn4)nc(=O)c23)cc1C ZINC000427447779 1026851827 /nfs/dbraw/zinc/85/18/27/1026851827.db2.gz AUALFAZBDUPBKP-UHFFFAOYSA-N -1 1 349.415 4.448 20 0 EIADMM Cn1c2ccccc2nc1[C@@H]1CCCN1Cc1cccc([O-])c1Cl ZINC000507630318 1026858628 /nfs/dbraw/zinc/85/86/28/1026858628.db2.gz OWXKKTDOTKGZNS-INIZCTEOSA-N -1 1 341.842 4.269 20 0 EIADMM CCC[C@@]1(C)CCCN(C(=O)c2ccc(Br)cc2[O-])C1 ZINC000440933521 1027137256 /nfs/dbraw/zinc/13/72/56/1027137256.db2.gz GMOHANDGWXKTQR-INIZCTEOSA-N -1 1 340.261 4.197 20 0 EIADMM Cc1sc(NC(=O)c2cc(F)ccc2[O-])nc1-c1ccccc1 ZINC001141885454 1027393859 /nfs/dbraw/zinc/39/38/59/1027393859.db2.gz LFTQMWVQTWXGPK-UHFFFAOYSA-N -1 1 328.368 4.216 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)C1(Oc2ccc(Cl)cc2)CC1 ZINC000550322667 1027438613 /nfs/dbraw/zinc/43/86/13/1027438613.db2.gz UCWUJNBVWPHTMA-UHFFFAOYSA-N -1 1 338.190 4.249 20 0 EIADMM CN(CC1(c2ccccc2)CC1)C(=O)c1cc2ccccc2cc1[O-] ZINC000444376232 1027439700 /nfs/dbraw/zinc/43/97/00/1027439700.db2.gz LYUBJJWDTKLKJB-UHFFFAOYSA-N -1 1 331.415 4.349 20 0 EIADMM Cc1csc(-c2cccc([N-]S(=O)(=O)c3ccc(F)cc3)c2)n1 ZINC000523286689 1027940960 /nfs/dbraw/zinc/94/09/60/1027940960.db2.gz IHYHPNGVQNIETC-UHFFFAOYSA-N -1 1 348.424 4.058 20 0 EIADMM CCc1ccc([C@@H](C)CC(=O)Nc2ccc(-c3cc(=O)[nH][n-]3)cc2)cc1 ZINC000523426355 1028084606 /nfs/dbraw/zinc/08/46/06/1028084606.db2.gz FUPATLBBQRCRAV-AWEZNQCLSA-N -1 1 349.434 4.477 20 0 EIADMM O=c1cc(C(F)F)nc(SC[C@@H]2CCC3(CCCCC3)O2)[n-]1 ZINC000329773051 1028120339 /nfs/dbraw/zinc/12/03/39/1028120339.db2.gz HWFRNFJIIRLNAO-JTQLQIEISA-N -1 1 330.400 4.094 20 0 EIADMM CCC(C)(CC)[N-]S(=O)(=O)c1c(Cl)cccc1C(F)(F)F ZINC000523569191 1028219720 /nfs/dbraw/zinc/21/97/20/1028219720.db2.gz PFQZOCSIEQGENA-UHFFFAOYSA-N -1 1 343.798 4.216 20 0 EIADMM CC(=O)Nc1ccc([O-])c(-c2nc(C(C)(C)C3=CCCCC3)no2)c1 ZINC000278162774 1028354356 /nfs/dbraw/zinc/35/43/56/1028354356.db2.gz UIZPYMHBEGQILV-UHFFFAOYSA-N -1 1 341.411 4.179 20 0 EIADMM COCc1cc(C(=O)[N-]c2c(F)cccc2Oc2ccccc2)no1 ZINC000080107831 1028505452 /nfs/dbraw/zinc/50/54/52/1028505452.db2.gz OBJNCWDRBPCYFK-UHFFFAOYSA-N -1 1 342.326 4.005 20 0 EIADMM CCOc1cc(-c2noc(Cc3ccccc3F)n2)cc(Cl)c1[O-] ZINC000445404560 1028515546 /nfs/dbraw/zinc/51/55/46/1028515546.db2.gz CXFDARAEYVQSHF-UHFFFAOYSA-N -1 1 348.761 4.224 20 0 EIADMM CCOc1cc(-c2noc(-c3ccc(OC)cc3)n2)cc(Cl)c1[O-] ZINC000445431250 1028529068 /nfs/dbraw/zinc/52/90/68/1028529068.db2.gz MJZVBPGGDSDPCS-UHFFFAOYSA-N -1 1 346.770 4.170 20 0 EIADMM CCOc1cc(-c2noc(Cc3cccs3)n2)cc(Cl)c1[O-] ZINC000445431929 1028529722 /nfs/dbraw/zinc/52/97/22/1028529722.db2.gz RGJCKRQOGDAOLN-UHFFFAOYSA-N -1 1 336.800 4.147 20 0 EIADMM O=S(=O)([N-]c1ccc(F)c(Cl)c1)c1ccc(C(F)F)cc1 ZINC000583343036 1028549504 /nfs/dbraw/zinc/54/95/04/1028549504.db2.gz CNUCOUWXAYNHGQ-UHFFFAOYSA-N -1 1 335.734 4.218 20 0 EIADMM [O-]c1ccc(-c2noc(C3=Cc4ccccc4OC3)n2)c(Cl)c1 ZINC000445444888 1028571544 /nfs/dbraw/zinc/57/15/44/1028571544.db2.gz HPNRFGZVMJEZIZ-UHFFFAOYSA-N -1 1 326.739 4.029 20 0 EIADMM CC[C@@H](Oc1cccc(C)c1)c1nc(-c2ccc([O-])cc2F)no1 ZINC000445455805 1028607496 /nfs/dbraw/zinc/60/74/96/1028607496.db2.gz GKRAKNHMLLKMIW-MRXNPFEDSA-N -1 1 328.343 4.420 20 0 EIADMM [O-]c1ccc(-c2noc(Cc3coc4cc(F)ccc34)n2)c(F)c1 ZINC000445456730 1028610883 /nfs/dbraw/zinc/61/08/83/1028610883.db2.gz PWYMYQJZQOBBNU-UHFFFAOYSA-N -1 1 328.274 4.057 20 0 EIADMM COc1ccccc1/C(C)=C/c1nc(-c2ccc([O-])cc2F)no1 ZINC000445457056 1028612193 /nfs/dbraw/zinc/61/21/93/1028612193.db2.gz QWGNAEHZLIMZJF-PKNBQFBNSA-N -1 1 326.327 4.150 20 0 EIADMM [O-]c1ccc(-c2noc(/C=C\c3cccc4cccnc34)n2)cc1F ZINC000445478794 1028624804 /nfs/dbraw/zinc/62/48/04/1028624804.db2.gz ICMMVBYTKRJINI-CLFYSBASSA-N -1 1 333.322 4.300 20 0 EIADMM CC[C@H](Oc1cccc(C)c1)c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445478375 1028625036 /nfs/dbraw/zinc/62/50/36/1028625036.db2.gz DTTPSHLHQBVZFG-INIZCTEOSA-N -1 1 328.343 4.420 20 0 EIADMM Cc1nc(CC(C)C)sc1-c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445479324 1028628225 /nfs/dbraw/zinc/62/82/25/1028628225.db2.gz VLDMGKQOLDNVSU-UHFFFAOYSA-N -1 1 333.388 4.212 20 0 EIADMM [O-]c1ccc(-c2noc([C@H]3C[C@@H]3c3cccc(F)c3F)n2)cc1F ZINC000445484161 1028633245 /nfs/dbraw/zinc/63/32/45/1028633245.db2.gz WICNIOQGYPJKCJ-MNOVXSKESA-N -1 1 332.281 4.131 20 0 EIADMM [O-]c1ccc(-c2noc([C@H]3C[C@H]3c3cccc(F)c3F)n2)cc1F ZINC000445484164 1028633715 /nfs/dbraw/zinc/63/37/15/1028633715.db2.gz WICNIOQGYPJKCJ-QWRGUYRKSA-N -1 1 332.281 4.131 20 0 EIADMM [O-]c1ccc(-c2noc(Cc3ccccc3C(F)(F)F)n2)cc1F ZINC000445486701 1028635720 /nfs/dbraw/zinc/63/57/20/1028635720.db2.gz OXYGERUAGNSFKZ-UHFFFAOYSA-N -1 1 338.260 4.191 20 0 EIADMM [O-]c1ccc(-c2noc(Cc3coc4cc(F)ccc34)n2)cc1F ZINC000445486540 1028635897 /nfs/dbraw/zinc/63/58/97/1028635897.db2.gz NYLUBSXRMXFTSH-UHFFFAOYSA-N -1 1 328.274 4.057 20 0 EIADMM CC(C)(C)n1cc(-c2noc(-c3ccc4ccccc4c3[O-])n2)cn1 ZINC000445626691 1028791878 /nfs/dbraw/zinc/79/18/78/1028791878.db2.gz AOILGPMXZXWJLG-UHFFFAOYSA-N -1 1 334.379 4.214 20 0 EIADMM CCC(CC)n1ncc(-c2nc(-c3ccc([O-])c(F)c3)no2)c1C ZINC000278304446 1028857108 /nfs/dbraw/zinc/85/71/08/1028857108.db2.gz XUEYMYCRXFUSNI-UHFFFAOYSA-N -1 1 330.363 4.114 20 0 EIADMM Cc1cccc(S(=O)(=O)[N-]c2ccc(COC3CCCC3)cc2)c1 ZINC000583841528 1029262907 /nfs/dbraw/zinc/26/29/07/1029262907.db2.gz YWCXBUUPCWORGA-UHFFFAOYSA-N -1 1 345.464 4.255 20 0 EIADMM Cc1ccc(Cl)c(S(=O)(=O)[N-]c2ccccc2F)c1Cl ZINC000614732429 1029276070 /nfs/dbraw/zinc/27/60/70/1029276070.db2.gz NPFAKZKSQOBXHT-UHFFFAOYSA-N -1 1 334.199 4.242 20 0 EIADMM CCC1(CC)[C@H](OC)C[C@H]1[N@@H+](C)Cc1cccc(C(=O)[O-])c1Cl ZINC000583877689 1029312364 /nfs/dbraw/zinc/31/23/64/1029312364.db2.gz VHBVXGZHTDHYCV-HUUCEWRRSA-N -1 1 339.863 4.064 20 0 EIADMM O=C([N-]c1nc(-c2ccccc2)ns1)c1coc(-c2ccccc2)n1 ZINC000152201650 1029342503 /nfs/dbraw/zinc/34/25/03/1029342503.db2.gz FOQWMPCQYPWPLI-UHFFFAOYSA-N -1 1 348.387 4.112 20 0 EIADMM COc1cc(CN(C)[C@@H](C)c2cc(C(=O)[O-])c(C)o2)ccc1SC ZINC000583999581 1029483079 /nfs/dbraw/zinc/48/30/79/1029483079.db2.gz PMHBQIUUSFDFTR-NSHDSACASA-N -1 1 349.452 4.210 20 0 EIADMM CC(C)[C@H]1CN([C@@H](C(=O)[O-])c2ccc(Cl)cc2Cl)CCS1 ZINC000565107294 1029651437 /nfs/dbraw/zinc/65/14/37/1029651437.db2.gz UWKJFFZYGVIZLD-ZIAGYGMSSA-N -1 1 348.295 4.193 20 0 EIADMM Cc1nc(-c2ccc(NCc3cccc(Cl)c3)nc2)[n-]c(=O)c1C ZINC000301172327 1029681306 /nfs/dbraw/zinc/68/13/06/1029681306.db2.gz KMJIPDUMTFBZKJ-UHFFFAOYSA-N -1 1 340.814 4.127 20 0 EIADMM Cc1nc(-c2ccc(NCc3ccc(Cl)cc3)nc2)[n-]c(=O)c1C ZINC000301197238 1029684878 /nfs/dbraw/zinc/68/48/78/1029684878.db2.gz ZPXKDPWYTUQHCE-UHFFFAOYSA-N -1 1 340.814 4.127 20 0 EIADMM CCOc1cc(C(=O)N2CCC[C@@H]3CCCC[C@@H]32)cc(Cl)c1[O-] ZINC000186427278 1029727480 /nfs/dbraw/zinc/72/74/80/1029727480.db2.gz UUBAELSQEHKCSM-WFASDCNBSA-N -1 1 337.847 4.239 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc(-c3ccco3)cc2F)s1 ZINC000447271697 1029956978 /nfs/dbraw/zinc/95/69/78/1029956978.db2.gz ACLKHKGIVYXORA-UHFFFAOYSA-N -1 1 337.397 4.256 20 0 EIADMM Cc1c(=O)[n-]c(SC[C@H]2CCO[C@@H](C)C2)nc1-c1ccccc1 ZINC000447284279 1029964952 /nfs/dbraw/zinc/96/49/52/1029964952.db2.gz FCYOOEIKUAGYJY-JSGCOSHPSA-N -1 1 330.453 4.065 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1CC=C(c2ccc(O)cc2)CC1 ZINC000183539230 1030010625 /nfs/dbraw/zinc/01/06/25/1030010625.db2.gz ZRVAAXNYIUACNY-UHFFFAOYSA-N -1 1 345.398 4.181 20 0 EIADMM Cc1nc(-c2ccc(NC(=O)c3c(F)ccc([O-])c3F)cc2)oc1C ZINC000685424442 1030302591 /nfs/dbraw/zinc/30/25/91/1030302591.db2.gz RTUFDGTVGRCFKP-UHFFFAOYSA-N -1 1 344.317 4.195 20 0 EIADMM COc1cc(C(=O)N2CC[C@H](C)[C@@H]3CCCC[C@@H]32)cc(Cl)c1[O-] ZINC000526949753 1030341018 /nfs/dbraw/zinc/34/10/18/1030341018.db2.gz KVWHIHJUBHCEFC-WHOFXGATSA-N -1 1 337.847 4.095 20 0 EIADMM O=C(c1cncc([O-])c1)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000171909906 1030424857 /nfs/dbraw/zinc/42/48/57/1030424857.db2.gz RSQHLIZPCXBNJS-OAHLLOKOSA-N -1 1 337.206 4.071 20 0 EIADMM CCOc1cc(C(=O)Nc2sc(CC)nc2C)cc(Cl)c1[O-] ZINC000428544905 1030491866 /nfs/dbraw/zinc/49/18/66/1030491866.db2.gz YKFLJKLHSRHITB-UHFFFAOYSA-N -1 1 340.832 4.024 20 0 EIADMM C[N@@H+](Cc1cccc(O)c1Cl)[C@H]1CCCN(c2ccccc2)C1 ZINC000508645792 1030511987 /nfs/dbraw/zinc/51/19/87/1030511987.db2.gz PEJNVNZVPSJLDS-KRWDZBQOSA-N -1 1 330.859 4.146 20 0 EIADMM O=C([O-])c1cccc(CN2CCC(=Cc3ccc(F)c(F)c3)CC2)c1 ZINC000263405520 1030853566 /nfs/dbraw/zinc/85/35/66/1030853566.db2.gz JPWAJXXAUMXHOY-UHFFFAOYSA-N -1 1 343.373 4.342 20 0 EIADMM O=C([O-])[C@H]1CCCN1Cc1ccc(-c2cccc(C(F)(F)F)c2)o1 ZINC000263429803 1030863632 /nfs/dbraw/zinc/86/36/32/1030863632.db2.gz RUGNNGMYANWPSI-CQSZACIVSA-N -1 1 339.313 4.014 20 0 EIADMM N#Cc1ccc(S(=O)(=O)[N-]c2ccc3ccccc3c2)cc1Cl ZINC000321672482 1030965925 /nfs/dbraw/zinc/96/59/25/1030965925.db2.gz QAZLPDNLFJNWOM-UHFFFAOYSA-N -1 1 342.807 4.166 20 0 EIADMM C[N@@H+](Cc1ccc(C(=O)[O-])cc1Br)C1CCCCCC1 ZINC000226720393 1031104210 /nfs/dbraw/zinc/10/42/10/1031104210.db2.gz OPHKLXZPOWZVSH-UHFFFAOYSA-N -1 1 340.261 4.302 20 0 EIADMM CC/C(C)=C\c1nc(-c2cc(Br)c([O-])c(OC)c2)no1 ZINC000453176424 1031650653 /nfs/dbraw/zinc/65/06/53/1031650653.db2.gz MRYMBJWVVFCTIR-YVMONPNESA-N -1 1 339.189 4.027 20 0 EIADMM CC1(CC(=O)N2CCC(C(=O)c3ccc([O-])cc3)CC2)CCCCC1 ZINC000134204572 1031993739 /nfs/dbraw/zinc/99/37/39/1031993739.db2.gz ULMNGOMCWUZGTB-UHFFFAOYSA-N -1 1 343.467 4.174 20 0 EIADMM CCc1ccc(S(=O)(=O)[N-]c2c(C)c(F)ccc2Cl)s1 ZINC000433166191 1033968742 /nfs/dbraw/zinc/96/87/42/1033968742.db2.gz XBXUEOQVDBNPQZ-UHFFFAOYSA-N -1 1 333.837 4.212 20 0 EIADMM COC(=O)c1[n-]c(=N[C@H](C)c2cc(Cl)ccc2Cl)sc1C ZINC000433780541 1034909458 /nfs/dbraw/zinc/90/94/58/1034909458.db2.gz BDUYEAMXRDDVOA-SSDOTTSWSA-N -1 1 345.251 4.140 20 0 EIADMM CC(C)C[C@@H]1CCCN(C(=O)c2ccc(Br)c([O-])c2)C1 ZINC000490581493 1035551964 /nfs/dbraw/zinc/55/19/64/1035551964.db2.gz BEIRJPFHRMSHCQ-LBPRGKRZSA-N -1 1 340.261 4.053 20 0 EIADMM CC(C)N(Cc1nc(=O)c2sccc2[n-]1)[C@@H](C)c1ccsc1 ZINC000420997757 1035931849 /nfs/dbraw/zinc/93/18/49/1035931849.db2.gz AODPHXAFFKKKMY-NSHDSACASA-N -1 1 333.482 4.430 20 0 EIADMM Cc1cc([C@H](C)N2CCC(Oc3ccc(C)cc3)CC2)oc1C(=O)[O-] ZINC000572249565 1036457251 /nfs/dbraw/zinc/45/72/51/1036457251.db2.gz PPVMRSMFBOYKNI-HNNXBMFYSA-N -1 1 343.423 4.199 20 0 EIADMM C[C@H]1CCc2nc(NC(=O)Nc3ccc([O-])c(Cl)c3)sc2C1 ZINC000486160910 1036519600 /nfs/dbraw/zinc/51/96/00/1036519600.db2.gz WCWLHVUXJWACKF-QMMMGPOBSA-N -1 1 337.832 4.271 20 0 EIADMM O=C(CSc1nnc(CCC2CCCCC2)o1)c1ccc([O-])cc1 ZINC000589273850 1036727342 /nfs/dbraw/zinc/72/73/42/1036727342.db2.gz JEJPZCNBFWDPPK-UHFFFAOYSA-N -1 1 346.452 4.263 20 0 EIADMM COc1cccc(S(=O)(=O)[N-]c2cc(Cl)c(C)c(Cl)c2)c1 ZINC000589435948 1036800089 /nfs/dbraw/zinc/80/00/89/1036800089.db2.gz RAYKYKGPVIGDSX-UHFFFAOYSA-N -1 1 346.235 4.111 20 0 EIADMM CCCCC[C@@H]1CCCN1c1ccc(-c2nc(C)c(C)c(=O)[n-]2)cn1 ZINC000486893672 1036882161 /nfs/dbraw/zinc/88/21/61/1036882161.db2.gz BSXXGUQPAIVJBY-QGZVFWFLSA-N -1 1 340.471 4.410 20 0 EIADMM CC[C@H](CC(F)(F)F)C(=O)Nc1cccc([O-])c1Br ZINC000908706974 1036921221 /nfs/dbraw/zinc/92/12/21/1036921221.db2.gz GKINZSIMKJDBHJ-SSDOTTSWSA-N -1 1 340.139 4.072 20 0 EIADMM CCSc1cccc([N-]S(=O)(=O)c2ccc(F)c(Cl)c2)c1 ZINC000603680841 1036944166 /nfs/dbraw/zinc/94/41/66/1036944166.db2.gz UWWVPEFEZMXWMK-UHFFFAOYSA-N -1 1 345.848 4.392 20 0 EIADMM CC(C)c1ccccc1OCCC(=O)Nc1cc([O-])c(F)cc1F ZINC000909984569 1037224320 /nfs/dbraw/zinc/22/43/20/1037224320.db2.gz PUHROQNWWJJACW-UHFFFAOYSA-N -1 1 335.350 4.201 20 0 EIADMM O=C(Cc1ccccc1OC1CCCC1)Nc1cc([O-])c(F)cc1F ZINC000909988182 1037252825 /nfs/dbraw/zinc/25/28/25/1037252825.db2.gz YQNBGXOCAYCJSC-UHFFFAOYSA-N -1 1 347.361 4.173 20 0 EIADMM Cc1[n-][nH]c(=O)c1NC(=O)C1(Cc2cccc(Cl)c2)CCCCC1 ZINC000615217964 1037350803 /nfs/dbraw/zinc/35/08/03/1037350803.db2.gz JAECFDFAAQPALT-UHFFFAOYSA-N -1 1 347.846 4.209 20 0 EIADMM Cc1ccc(OC(F)F)c(CSc2nc(C(F)F)cc(=O)[n-]2)c1 ZINC000488266699 1037466263 /nfs/dbraw/zinc/46/62/63/1037466263.db2.gz STZILIYQNSAATQ-UHFFFAOYSA-N -1 1 348.321 4.322 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1CCCO[C@@H](c2ccccc2)C1 ZINC000591791719 1037582967 /nfs/dbraw/zinc/58/29/67/1037582967.db2.gz JZVARMRMFWBPNN-HXUWFJFHSA-N -1 1 347.414 4.149 20 0 EIADMM O=C(N[C@@H](c1ccc(Cl)cc1)C1CCCC1)c1cncc([O-])c1 ZINC000605182557 1037691288 /nfs/dbraw/zinc/69/12/88/1037691288.db2.gz FHBQTONICWPWLD-QGZVFWFLSA-N -1 1 330.815 4.102 20 0 EIADMM CC[C@H](C)N(CC(=O)[O-])Cc1ccc(-c2nc3ccccc3s2)o1 ZINC000414673372 1037775379 /nfs/dbraw/zinc/77/53/79/1037775379.db2.gz DKQIUFNOZBABGW-LBPRGKRZSA-N -1 1 344.436 4.241 20 0 EIADMM Cc1ccc(C(C)C)cc1O[C@H](C)C(=O)Nc1c([O-])cccc1F ZINC000605439128 1037788337 /nfs/dbraw/zinc/78/83/37/1037788337.db2.gz VCYMVCYWEGSWIN-CYBMUJFWSA-N -1 1 331.387 4.369 20 0 EIADMM Cc1ccc([C@@H](C)NC(=O)c2ccc(Br)c([O-])c2)s1 ZINC000231328726 1038226738 /nfs/dbraw/zinc/22/67/38/1038226738.db2.gz QXZHIXIXLVMHDD-SECBINFHSA-N -1 1 340.242 4.016 20 0 EIADMM O=S(=O)([N-]c1ccc(COC2CCCC2)cc1)c1ccc(F)cc1 ZINC000606827950 1038266732 /nfs/dbraw/zinc/26/67/32/1038266732.db2.gz DUOROSMLFQYUPO-UHFFFAOYSA-N -1 1 349.427 4.086 20 0 EIADMM Cc1cc(Nc2c([O-])c(Br)ccc2Cl)cnc1F ZINC001212192358 1038301328 /nfs/dbraw/zinc/30/13/28/1038301328.db2.gz GFHKVLHCOPCNJO-UHFFFAOYSA-N -1 1 331.572 4.394 20 0 EIADMM CC[C@]1(C)CCCN(Cn2c(Cc3cccs3)n[n-]c2=S)C1 ZINC000173421730 1038323580 /nfs/dbraw/zinc/32/35/80/1038323580.db2.gz FYEHDFITHORKBA-MRXNPFEDSA-N -1 1 336.530 4.063 20 0 EIADMM CCOc1ccc(S(=O)(=O)[N-]c2ccccc2C(F)F)c(C)c1 ZINC000424072455 1038459725 /nfs/dbraw/zinc/45/97/25/1038459725.db2.gz XOUQTKUEIJSVRB-UHFFFAOYSA-N -1 1 341.379 4.132 20 0 EIADMM CC[C@H](c1ccccc1)S(=O)(=O)c1nc(C)c(-c2ccccc2)[nH]1 ZINC000490439012 1038641900 /nfs/dbraw/zinc/64/19/00/1038641900.db2.gz AHZUMXXPWHDAEO-QGZVFWFLSA-N -1 1 340.448 4.310 20 0 EIADMM CC(C)Cc1ccc(C(=O)CCC(=O)Nc2c([O-])cccc2F)cc1 ZINC000608365802 1038803012 /nfs/dbraw/zinc/80/30/12/1038803012.db2.gz JWBBTLDRJXIXMD-UHFFFAOYSA-N -1 1 343.398 4.331 20 0 EIADMM C[C@H](Oc1ccc(Cl)c(Cl)c1)C(=O)Nc1c([O-])cccc1F ZINC000608365632 1038804181 /nfs/dbraw/zinc/80/41/81/1038804181.db2.gz OXHDZXQRUDSWKL-QMMMGPOBSA-N -1 1 344.169 4.244 20 0 EIADMM Cc1c(F)cccc1-c1ccc(CN2CCC[C@H](C)[C@H]2C(=O)[O-])o1 ZINC000424417970 1038843659 /nfs/dbraw/zinc/84/36/59/1038843659.db2.gz MWZDPZJTFORSQV-SGTLLEGYSA-N -1 1 331.387 4.079 20 0 EIADMM CCOc1cc([N-]S(=O)(=O)c2cccc(C(C)C)c2)ccc1OC ZINC000460447654 1038845980 /nfs/dbraw/zinc/84/59/80/1038845980.db2.gz YLENCFPCHYZTFX-UHFFFAOYSA-N -1 1 349.452 4.018 20 0 EIADMM O=C(Nc1ccccc1-c1nc2ccccc2[nH]1)c1ccccc1[O-] ZINC000121231309 1039330564 /nfs/dbraw/zinc/33/05/64/1039330564.db2.gz REYYVHMTOIQFKU-UHFFFAOYSA-N -1 1 329.359 4.188 20 0 EIADMM Cc1ccc([C@H]2OCCC[C@H]2C(=O)Nc2ccc([O-])c(F)c2F)cc1 ZINC000456780952 1039600093 /nfs/dbraw/zinc/60/00/93/1039600093.db2.gz JHWDKAFXIWZHOC-FZKQIMNGSA-N -1 1 347.361 4.085 20 0 EIADMM O=C(Nc1cccc(-c2ccc3ccccc3c2)n1)c1cncc([O-])c1 ZINC000555868568 1039772739 /nfs/dbraw/zinc/77/27/39/1039772739.db2.gz AXRRGAYFQKEANL-UHFFFAOYSA-N -1 1 341.370 4.255 20 0 EIADMM Cc1cc(-c2nc(-c3ccc([O-])cc3Cl)no2)nn1[C@H](C)C1CC1 ZINC000556002692 1039857128 /nfs/dbraw/zinc/85/71/28/1039857128.db2.gz ISUSBFPMOFONFV-SNVBAGLBSA-N -1 1 344.802 4.239 20 0 EIADMM COc1cc(C(=O)N2C[C@@H](C)C[C@H]2c2ccccc2)cc(Cl)c1[O-] ZINC000553337670 1040146956 /nfs/dbraw/zinc/14/69/56/1040146956.db2.gz RMEYYGNPJBKMFW-LRDDRELGSA-N -1 1 345.826 4.278 20 0 EIADMM O=C(Nc1ccc(Cl)cc1[O-])c1ccn(-c2ccc(Cl)cc2)n1 ZINC000535306730 1040176416 /nfs/dbraw/zinc/17/64/16/1040176416.db2.gz HKRBGPDZMNYWAE-UHFFFAOYSA-N -1 1 348.189 4.137 20 0 EIADMM CSc1ccc([O-])c(C(=O)Nc2c(F)cccc2N2CCCC2)c1 ZINC000668021503 1040219500 /nfs/dbraw/zinc/21/95/00/1040219500.db2.gz JHZAGRGKDMKWKB-UHFFFAOYSA-N -1 1 346.427 4.106 20 0 EIADMM CC(C)c1ccccc1[N-]S(=O)(=O)c1ccc2ncsc2c1 ZINC000479501188 1040409996 /nfs/dbraw/zinc/40/99/96/1040409996.db2.gz KSYIRZNMOKJIGG-UHFFFAOYSA-N -1 1 332.450 4.221 20 0 EIADMM COc1cc(C(=O)N(CC(C)C)c2ccccc2)cc(Cl)c1[O-] ZINC000553755082 1040493151 /nfs/dbraw/zinc/49/31/51/1040493151.db2.gz WPTXAHCIWGCLTB-UHFFFAOYSA-N -1 1 333.815 4.357 20 0 EIADMM Cc1cc(Br)c([O-])c(NC(=O)[C@H](C)c2ccccc2)c1 ZINC000477490090 1040541953 /nfs/dbraw/zinc/54/19/53/1040541953.db2.gz FBLAFZKXLGTNMI-LLVKDONJSA-N -1 1 334.213 4.205 20 0 EIADMM Cc1nc(SCc2csc(-c3ccsc3)n2)[n-]c(=O)c1C ZINC000539616261 1040602197 /nfs/dbraw/zinc/60/21/97/1040602197.db2.gz NDKFCNJKWINLEN-UHFFFAOYSA-N -1 1 335.479 4.276 20 0 EIADMM COc1ccc(/C=C/c2nc(-c3ccc([O-])cc3Cl)no2)cc1 ZINC000445450793 1040767356 /nfs/dbraw/zinc/76/73/56/1040767356.db2.gz WRPCUTZQMSKADO-RUDMXATFSA-N -1 1 328.755 4.275 20 0 EIADMM Cc1cc2cc[nH]c2cc1[N-]S(=O)(=O)c1ccc2ccccc2c1 ZINC000436156347 1040909643 /nfs/dbraw/zinc/90/96/43/1040909643.db2.gz VXEQHCQXDZTIFK-UHFFFAOYSA-N -1 1 336.416 4.430 20 0 EIADMM O=C([O-])c1csc(CN2CCC[C@H](CCCc3ccccc3)C2)n1 ZINC000515660319 1040963832 /nfs/dbraw/zinc/96/38/32/1040963832.db2.gz WAJIVYLPIZNXQE-INIZCTEOSA-N -1 1 344.480 4.076 20 0 EIADMM O=c1cc(C2CC2)nc(SCc2cc(F)cc3cccnc32)[n-]1 ZINC000436244872 1040992608 /nfs/dbraw/zinc/99/26/08/1040992608.db2.gz SCZARGZVCUDQCA-UHFFFAOYSA-N -1 1 327.384 4.039 20 0 EIADMM CCCn1ccc2ccc([N-]S(=O)(=O)c3ccccc3C)cc21 ZINC000460833572 1040995849 /nfs/dbraw/zinc/99/58/49/1040995849.db2.gz UCKUFQACYATSGV-UHFFFAOYSA-N -1 1 328.437 4.161 20 0 EIADMM CCc1cccc([N-]S(=O)(=O)c2ccc(CC(F)(F)F)cc2)c1 ZINC000480216428 1041088214 /nfs/dbraw/zinc/08/82/14/1041088214.db2.gz VRQLWKOPVGQVBF-UHFFFAOYSA-N -1 1 343.370 4.155 20 0 EIADMM COc1cc(C(=O)N2CCC[C@H](c3ccccc3)C2)cc(Cl)c1[O-] ZINC000554411545 1041092858 /nfs/dbraw/zinc/09/28/58/1041092858.db2.gz JOBPUQHONYITGY-AWEZNQCLSA-N -1 1 345.826 4.074 20 0 EIADMM Cc1cc(CN[C@H](CC(=O)[O-])c2cc(Cl)cc(Cl)c2)sn1 ZINC000904004559 1041267834 /nfs/dbraw/zinc/26/78/34/1041267834.db2.gz MWDJPPZOLFYGBV-CYBMUJFWSA-N -1 1 345.251 4.064 20 0 EIADMM Cc1ccccc1[C@]1(F)CCN(C(=O)c2ccc(Cl)cc2[O-])C1 ZINC000436513145 1041298466 /nfs/dbraw/zinc/29/84/66/1041298466.db2.gz LMRGQHIYGHXELL-SFHVURJKSA-N -1 1 333.790 4.065 20 0 EIADMM O=C1CCCc2cc(-c3nc(-c4ccc([O-])cc4Cl)no3)ccc21 ZINC000436522908 1041305343 /nfs/dbraw/zinc/30/53/43/1041305343.db2.gz YGTCGFZXGWRNSJ-UHFFFAOYSA-N -1 1 340.766 4.282 20 0 EIADMM CCCCN(CCCC)C(=O)c1cc(Cl)c([O-])c(OCC)c1 ZINC000436524901 1041308040 /nfs/dbraw/zinc/30/80/40/1041308040.db2.gz LEUKETMTSCXWED-UHFFFAOYSA-N -1 1 327.852 4.487 20 0 EIADMM COc1ccc(C(=O)Nc2cccc(Cl)c2OC(C)C)c([O-])c1 ZINC000436534990 1041317917 /nfs/dbraw/zinc/31/79/17/1041317917.db2.gz KAXSZDMCJWZOIW-UHFFFAOYSA-N -1 1 335.787 4.094 20 0 EIADMM Cc1nc(-c2cccc(NC(=O)c3ccc4ccccc4c3[O-])c2)no1 ZINC000436548984 1041322803 /nfs/dbraw/zinc/32/28/03/1041322803.db2.gz DQMPRTONLFOWHE-UHFFFAOYSA-N -1 1 345.358 4.156 20 0 EIADMM CCN(C(=O)c1cc(Cl)c([O-])c(OC)c1)c1cc(C)cc(C)c1 ZINC000436549573 1041326229 /nfs/dbraw/zinc/32/62/29/1041326229.db2.gz XOOTYWZHVBMXDX-UHFFFAOYSA-N -1 1 333.815 4.338 20 0 EIADMM O=C(c1cc(Cl)ccc1[O-])N1CCC[C@H](Cc2ccccc2)C1 ZINC000436554933 1041328008 /nfs/dbraw/zinc/32/80/08/1041328008.db2.gz KUQGEMBZYVOZDH-OAHLLOKOSA-N -1 1 329.827 4.141 20 0 EIADMM O=C(Nc1ccc(Cn2cnc3ccccc32)cc1)c1ccccc1[O-] ZINC000436537461 1041331699 /nfs/dbraw/zinc/33/16/99/1041331699.db2.gz HEYSLSYNVFFZJU-UHFFFAOYSA-N -1 1 343.386 4.043 20 0 EIADMM CC[C@H](C)[C@@H](C)N(C(=O)c1ccc(Br)cc1[O-])C1CC1 ZINC000436563050 1041343802 /nfs/dbraw/zinc/34/38/02/1041343802.db2.gz CJOMSGFUBGJPID-WDEREUQCSA-N -1 1 340.261 4.194 20 0 EIADMM C[C@@H]1CN(C(=O)c2ccc3ccccc3c2[O-])[C@H](c2ccccc2)CO1 ZINC000436577319 1041344480 /nfs/dbraw/zinc/34/44/80/1041344480.db2.gz TVRSFVFKGKEEOT-QRWLVFNGSA-N -1 1 347.414 4.148 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1CC[C@H](c2cccc(F)c2)C1 ZINC000436568516 1041347464 /nfs/dbraw/zinc/34/74/64/1041347464.db2.gz UEXFIPMBESXQON-KRWDZBQOSA-N -1 1 335.378 4.314 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1CCc2c(F)cc(F)cc2C1 ZINC000436594234 1041353629 /nfs/dbraw/zinc/35/36/29/1041353629.db2.gz DRSJZNSFBRRXPM-UHFFFAOYSA-N -1 1 339.341 4.022 20 0 EIADMM O=C(c1cc(F)ccc1[O-])N1CCCC[C@H]1c1ccc(F)cc1F ZINC000436599802 1041358119 /nfs/dbraw/zinc/35/81/19/1041358119.db2.gz CGDRVRCIWVVXEG-INIZCTEOSA-N -1 1 335.325 4.177 20 0 EIADMM COc1ccc(C(=O)Nc2ccc(CCC(F)(F)F)cc2)c([O-])c1 ZINC000436585829 1041359701 /nfs/dbraw/zinc/35/97/01/1041359701.db2.gz QZGLVVQSRLFXKW-UHFFFAOYSA-N -1 1 339.313 4.148 20 0 EIADMM CC1(C2CC2)CCN(C(=O)c2ccc(C(F)(F)F)cc2[O-])CC1 ZINC000436601219 1041367902 /nfs/dbraw/zinc/36/79/02/1041367902.db2.gz CETXWYHMPYPIEU-UHFFFAOYSA-N -1 1 327.346 4.063 20 0 EIADMM Cc1nc(S[C@@H](C)C(=O)Nc2ccccc2C(C)C)[n-]c(=O)c1C ZINC000538517334 1041401476 /nfs/dbraw/zinc/40/14/76/1041401476.db2.gz VQBRCTRWDNKXBQ-ZDUSSCGKSA-N -1 1 345.468 4.042 20 0 EIADMM CC(C)(C)c1csc(CNC(=O)c2ccc3ccccc3c2[O-])n1 ZINC000436673622 1041410945 /nfs/dbraw/zinc/41/09/45/1041410945.db2.gz RQDLZYJKYNOTQK-UHFFFAOYSA-N -1 1 340.448 4.229 20 0 EIADMM CSCc1ccccc1[N-]S(=O)(=O)c1ccc(C)c(Cl)c1 ZINC000546779710 1041417782 /nfs/dbraw/zinc/41/77/82/1041417782.db2.gz RQMRNIMJXZJMJK-UHFFFAOYSA-N -1 1 341.885 4.312 20 0 EIADMM Cc1cccc(C2=CCN(C(=O)c3cc(Cl)ccc3[O-])CC2)c1 ZINC000436697617 1041428962 /nfs/dbraw/zinc/42/89/62/1041428962.db2.gz JWMGSWPDPUVLHX-UHFFFAOYSA-N -1 1 327.811 4.284 20 0 EIADMM CC(C)c1nc(CCNC(=O)c2cc3ccccc3cc2[O-])cs1 ZINC000436720526 1041443010 /nfs/dbraw/zinc/44/30/10/1041443010.db2.gz FNBDQQNPZHYNRU-UHFFFAOYSA-N -1 1 340.448 4.098 20 0 EIADMM COc1ccc([C@@H](C)N(C)C(=O)c2ccc3ccccc3c2[O-])cc1 ZINC000436759189 1041455496 /nfs/dbraw/zinc/45/54/96/1041455496.db2.gz USIVVXDVVXEVRH-CQSZACIVSA-N -1 1 335.403 4.387 20 0 EIADMM Cc1ccc(OCCN(C)C(=O)c2ccc3ccccc3c2[O-])cc1 ZINC000436756351 1041455964 /nfs/dbraw/zinc/45/59/64/1041455964.db2.gz CKTHVDAMSNUUHW-UHFFFAOYSA-N -1 1 335.403 4.005 20 0 EIADMM Cc1ccc([C@@H](C)N(C)C(=O)c2ccc(Br)cc2[O-])cc1 ZINC000436756279 1041456466 /nfs/dbraw/zinc/45/64/66/1041456466.db2.gz PJJDWNWOSCLYLA-GFCCVEGCSA-N -1 1 348.240 4.296 20 0 EIADMM O=C(NCCc1nc2ccccc2s1)c1ccc2ccccc2c1[O-] ZINC000436764561 1041474586 /nfs/dbraw/zinc/47/45/86/1041474586.db2.gz LXQROUISATYIMS-UHFFFAOYSA-N -1 1 348.427 4.128 20 0 EIADMM C[C@@H](c1ccccc1F)N(C)C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436765275 1041475485 /nfs/dbraw/zinc/47/54/85/1041475485.db2.gz WNCOXRCKEPJJMG-JTQLQIEISA-N -1 1 341.304 4.383 20 0 EIADMM O=C(NCC1(c2cccc(F)c2F)CCCC1)c1ccc([O-])cc1F ZINC000436819036 1041487381 /nfs/dbraw/zinc/48/73/81/1041487381.db2.gz MEXCHRITHJBHFN-UHFFFAOYSA-N -1 1 349.352 4.051 20 0 EIADMM CCc1ccc(C(=O)N(c2ccc(OC)cc2)[C@H](C)C2CC2)c([O-])c1 ZINC000436827182 1041504131 /nfs/dbraw/zinc/50/41/31/1041504131.db2.gz RUCGXCAYPGKWEG-CQSZACIVSA-N -1 1 339.435 4.409 20 0 EIADMM O=C(c1ccc([O-])cc1F)N1CCC(=Cc2ccc(F)c(F)c2)CC1 ZINC000436824645 1041505083 /nfs/dbraw/zinc/50/50/83/1041505083.db2.gz IEEVLEAGYMXQJQ-UHFFFAOYSA-N -1 1 347.336 4.129 20 0 EIADMM C[C@@H](NC(=O)c1cc2ccccc2cc1[O-])c1ccc(Cl)cn1 ZINC000436844466 1041513527 /nfs/dbraw/zinc/51/35/27/1041513527.db2.gz NPRLRHFGBFYOBT-LLVKDONJSA-N -1 1 326.783 4.085 20 0 EIADMM [O-]c1ccc(-c2noc(COc3ccsc3Cl)n2)c(Cl)c1 ZINC000436869029 1041528886 /nfs/dbraw/zinc/52/88/86/1041528886.db2.gz CCELEOUSZGAZCF-UHFFFAOYSA-N -1 1 343.191 4.390 20 0 EIADMM Cc1nc2cc(-c3nc(-c4ccc([O-])cc4Cl)no3)ccc2o1 ZINC000436869521 1041528965 /nfs/dbraw/zinc/52/89/65/1041528965.db2.gz DRJZDAIHDBKMAW-UHFFFAOYSA-N -1 1 327.727 4.212 20 0 EIADMM [O-]c1ccc(-c2noc(-c3ccncc3Oc3ccccc3)n2)c(F)c1 ZINC000436870847 1041530154 /nfs/dbraw/zinc/53/01/54/1041530154.db2.gz GHFMGRPFQPZAFP-UHFFFAOYSA-N -1 1 349.321 4.436 20 0 EIADMM CCOc1cc(-c2noc(-c3cncc(CC)c3)n2)cc(Cl)c1[O-] ZINC000436875991 1041532536 /nfs/dbraw/zinc/53/25/36/1041532536.db2.gz ZOFDIIZAFMTUIB-UHFFFAOYSA-N -1 1 345.786 4.119 20 0 EIADMM O=C(Nc1ccc(Nc2ccccc2)nc1)c1c(F)ccc([O-])c1F ZINC000540547323 1041533513 /nfs/dbraw/zinc/53/35/13/1041533513.db2.gz YHNBGCXUFFBYPS-UHFFFAOYSA-N -1 1 341.317 4.061 20 0 EIADMM CCOc1cc(-c2noc([C@H](OC)[C@H](C)CC)n2)cc(Cl)c1[O-] ZINC000436876381 1041535778 /nfs/dbraw/zinc/53/57/78/1041535778.db2.gz IDMOKTMYNOVNBZ-YMTOWFKASA-N -1 1 340.807 4.228 20 0 EIADMM COc1ccc2cc(-c3noc(-c4cc(F)ccc4[O-])n3)ccc2c1 ZINC000436903198 1041544988 /nfs/dbraw/zinc/54/49/88/1041544988.db2.gz SKSUVCQFTQPNNW-UHFFFAOYSA-N -1 1 336.322 4.410 20 0 EIADMM O=C(c1ccc([O-])cc1F)N1CCC[C@@H](c2ccc(F)cc2)CC1 ZINC000436908573 1041549128 /nfs/dbraw/zinc/54/91/28/1041549128.db2.gz WAEDOUVYRQNPIV-CYBMUJFWSA-N -1 1 331.362 4.080 20 0 EIADMM COc1ccc(-c2nc(-c3ccc4[nH]c(C)c(C)c4c3)no2)c([O-])c1 ZINC000436912740 1041550409 /nfs/dbraw/zinc/55/04/09/1041550409.db2.gz SZYPNPXMEYILHA-UHFFFAOYSA-N -1 1 335.363 4.216 20 0 EIADMM CCCCCN(CCCOC)C(=O)c1ccc2ccccc2c1[O-] ZINC000436919762 1041557884 /nfs/dbraw/zinc/55/78/84/1041557884.db2.gz OWCPUJBLABWERS-UHFFFAOYSA-N -1 1 329.440 4.214 20 0 EIADMM COc1ccc(-c2nc(-c3ccc4nc(C)sc4c3)no2)c([O-])c1 ZINC000436936300 1041565485 /nfs/dbraw/zinc/56/54/85/1041565485.db2.gz ATOOWZYVZMOBFQ-UHFFFAOYSA-N -1 1 339.376 4.036 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cc4cc(Cl)ccn4n3)n2)c(Cl)c1 ZINC000436954689 1041575006 /nfs/dbraw/zinc/57/50/06/1041575006.db2.gz ACKCYPYCXRDQAT-UHFFFAOYSA-N -1 1 347.161 4.064 20 0 EIADMM O=C1CCCCc2cc(-c3nc(-c4ccc([O-])c(F)c4)no3)ccc21 ZINC000436957604 1041575060 /nfs/dbraw/zinc/57/50/60/1041575060.db2.gz YWUCNXZYJSGBNO-UHFFFAOYSA-N -1 1 338.338 4.157 20 0 EIADMM C[C@@H](NC(=O)c1c([O-])cccc1F)c1ccc(-c2cccnc2)cc1 ZINC000436988523 1041583983 /nfs/dbraw/zinc/58/39/83/1041583983.db2.gz LNZPGPUVAVGFJR-CYBMUJFWSA-N -1 1 336.366 4.084 20 0 EIADMM CC(=O)Nc1ccc(-c2noc(-c3ccc4ccccc4c3[O-])n2)cc1 ZINC000436995015 1041585235 /nfs/dbraw/zinc/58/52/35/1041585235.db2.gz GMSWBMFZAAXMFI-UHFFFAOYSA-N -1 1 345.358 4.221 20 0 EIADMM CN(Cc1cc(Cl)ccc1F)C(=O)c1cc(Cl)ccc1[O-] ZINC000437005100 1041589003 /nfs/dbraw/zinc/58/90/03/1041589003.db2.gz RPMOCOFGKPANQM-UHFFFAOYSA-N -1 1 328.170 4.110 20 0 EIADMM Cc1oc(CN(C)[C@H](C)c2ccc(OC(F)F)cc2)cc1C(=O)[O-] ZINC000516656544 1041693324 /nfs/dbraw/zinc/69/33/24/1041693324.db2.gz ICCZVZMPULWEED-SNVBAGLBSA-N -1 1 339.338 4.081 20 0 EIADMM Cc1oc(-c2ccccc2)nc1C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000540959124 1041754131 /nfs/dbraw/zinc/75/41/31/1041754131.db2.gz JIHJJJFCEOPHIR-UHFFFAOYSA-N -1 1 328.755 4.261 20 0 EIADMM O=C(N[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl)c1ccc([O-])cc1F ZINC000437317416 1041754531 /nfs/dbraw/zinc/75/45/31/1041754531.db2.gz SVOTUGXACOMROU-SWLSCSKDSA-N -1 1 340.181 4.124 20 0 EIADMM Cc1ccccc1S(=O)(=O)[N-]c1ccc(C(=O)C(C)(C)C)cc1 ZINC000425954341 1042067547 /nfs/dbraw/zinc/06/75/47/1042067547.db2.gz ZDJXQTOWKUVYRF-UHFFFAOYSA-N -1 1 331.437 4.025 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2cccc(CC(F)(F)F)c2)c(C)s1 ZINC000438777086 1042345482 /nfs/dbraw/zinc/34/54/82/1042345482.db2.gz UXNOCGFUNHCLSP-UHFFFAOYSA-N -1 1 349.399 4.271 20 0 EIADMM Cc1c(F)cccc1S(=O)(=O)[N-]c1ccc(Cl)c(Cl)c1 ZINC000438789020 1042347675 /nfs/dbraw/zinc/34/76/75/1042347675.db2.gz HCOKJWDHLJZUCG-UHFFFAOYSA-N -1 1 334.199 4.242 20 0 EIADMM Cc1ccccc1OCCCSc1nc(C(F)(F)F)cc(=O)[n-]1 ZINC000518337251 1042480212 /nfs/dbraw/zinc/48/02/12/1042480212.db2.gz OMZSKERFLPAVNH-UHFFFAOYSA-N -1 1 344.358 4.071 20 0 EIADMM Cc1cc2cc(C(=O)Nc3ccc(-c4cc(=O)[nH][n-]4)cc3)oc2cc1C ZINC000439065213 1042489624 /nfs/dbraw/zinc/48/96/24/1042489624.db2.gz IYAQDQLSBWGRER-UHFFFAOYSA-N -1 1 347.374 4.398 20 0 EIADMM COc1cc(C(=O)NCc2ccc3sccc3c2)cc(Cl)c1[O-] ZINC000426480154 1042758375 /nfs/dbraw/zinc/75/83/75/1042758375.db2.gz QEBPBDKWNODWRJ-UHFFFAOYSA-N -1 1 347.823 4.199 20 0 EIADMM COc1cc(C(=O)N2CC[C@@H](C(C)(C)C)C[C@H]2C)cc(Cl)c1[O-] ZINC000493179467 1042837301 /nfs/dbraw/zinc/83/73/01/1042837301.db2.gz HQFKTWKADIEOHH-DGCLKSJQSA-N -1 1 339.863 4.341 20 0 EIADMM COc1cc(/C=C\C(=O)c2ccc(C)c([N+](=O)[O-])c2)cc(Cl)c1[O-] ZINC000111689749 1042931471 /nfs/dbraw/zinc/93/14/71/1042931471.db2.gz NBELNZLNKHCZQN-XQRVVYSFSA-N -1 1 347.754 4.167 20 0 EIADMM O=S(=O)([N-]c1cccc(Cl)c1F)c1ccc(Cl)cc1F ZINC000007387693 1042935980 /nfs/dbraw/zinc/93/59/80/1042935980.db2.gz MJEZJYAOUKUDKT-UHFFFAOYSA-N -1 1 338.162 4.072 20 0 EIADMM C[C@H](c1ccc(Cl)c(Cl)c1)N1CCC2(C[C@@H]2C(=O)[O-])CC1 ZINC000405359317 1042953129 /nfs/dbraw/zinc/95/31/29/1042953129.db2.gz NBSFLEINEZKZQO-ZYHUDNBSSA-N -1 1 328.239 4.241 20 0 EIADMM CCSc1cccc(CNCc2ccc(C(=O)[O-])c(C3CC3)n2)c1 ZINC000417702036 1042992397 /nfs/dbraw/zinc/99/23/97/1042992397.db2.gz KFKCJEWLXDTGCN-UHFFFAOYSA-N -1 1 342.464 4.059 20 0 EIADMM CCSc1ccccc1C(=O)N=c1cc(-c2ccc(C)s2)[n-][nH]1 ZINC000520677731 1043001319 /nfs/dbraw/zinc/00/13/19/1043001319.db2.gz USZYZKPLLKNLBA-UHFFFAOYSA-N -1 1 343.477 4.233 20 0 EIADMM COc1cc(C2(C(=O)Nc3ccc([O-])c(Cl)c3)CCC2)ccc1C ZINC000509151204 1043078235 /nfs/dbraw/zinc/07/82/35/1043078235.db2.gz BCUKZJXMQJCSMH-UHFFFAOYSA-N -1 1 345.826 4.423 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@@H]1C[C@]12CCCc1ccccc12 ZINC000509153331 1043082669 /nfs/dbraw/zinc/08/26/69/1043082669.db2.gz GILRYDZOUHIQGL-KXBFYZLASA-N -1 1 327.811 4.278 20 0 EIADMM CSc1ccc(O[C@@H](C)C(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000132049850 1043103907 /nfs/dbraw/zinc/10/39/07/1043103907.db2.gz JVKVKZSANQSQBZ-JTQLQIEISA-N -1 1 337.828 4.174 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1cc(-c2ccccc2)ns1 ZINC000509163287 1043151882 /nfs/dbraw/zinc/15/18/82/1043151882.db2.gz DUEACNFOZLUBMK-UHFFFAOYSA-N -1 1 330.796 4.421 20 0 EIADMM CCCN(Cc1cccc([O-])c1Cl)[C@@H](C)C(=O)Nc1ccccc1 ZINC000507950431 1043207612 /nfs/dbraw/zinc/20/76/12/1043207612.db2.gz KJGSHQWVKMPHOW-AWEZNQCLSA-N -1 1 346.858 4.285 20 0 EIADMM Cn1c2ccccc2c(Cl)c1C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000509178675 1043207643 /nfs/dbraw/zinc/20/76/43/1043207643.db2.gz NMQPJSCHUXWSLJ-UHFFFAOYSA-N -1 1 335.190 4.443 20 0 EIADMM COCCCOc1ccc(Nc2cc(F)c([O-])c(Cl)c2)cc1 ZINC001214489164 1043215342 /nfs/dbraw/zinc/21/53/42/1043215342.db2.gz VVVNQDDDECJOPO-UHFFFAOYSA-N -1 1 325.767 4.344 20 0 EIADMM COC(=O)c1cc(Cl)cc(Nc2cc(F)c([O-])c(Cl)c2)c1O ZINC001214489696 1043243298 /nfs/dbraw/zinc/24/32/98/1043243298.db2.gz HSBLLSOTVWGDHX-UHFFFAOYSA-N -1 1 346.141 4.074 20 0 EIADMM C[C@@H](C(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)c1ccc(Cl)s1 ZINC000428039277 1043301110 /nfs/dbraw/zinc/30/11/10/1043301110.db2.gz DGKIXYCALSOTEB-SECBINFHSA-N -1 1 347.827 4.239 20 0 EIADMM CC[C@@H](CC(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)c1ccccc1 ZINC000508355049 1043382792 /nfs/dbraw/zinc/38/27/92/1043382792.db2.gz ODYQKHGMKOPXEV-AWEZNQCLSA-N -1 1 335.407 4.305 20 0 EIADMM CO[C@@H](C)c1cccc([N-]S(=O)(=O)c2ccc3ccccc3c2)c1 ZINC000171013711 1043389814 /nfs/dbraw/zinc/38/98/14/1043389814.db2.gz QIZCBHZHCRECNQ-AWEZNQCLSA-N -1 1 341.432 4.348 20 0 EIADMM C[C@H](OC(=O)c1ccc(Cl)c(Cl)c1[O-])C(=O)c1ccccc1 ZINC000730360922 1043502801 /nfs/dbraw/zinc/50/28/01/1043502801.db2.gz SLAKFMFTTUSSMJ-VIFPVBQESA-N -1 1 339.174 4.127 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1CC[C@](F)(c2ccccc2)C1 ZINC000521072706 1043516401 /nfs/dbraw/zinc/51/64/01/1043516401.db2.gz QVKBOAJFEDXVJS-OAQYLSRUSA-N -1 1 335.378 4.256 20 0 EIADMM CN(Cc1ccc(F)cc1Cl)C(=O)c1c([O-])cccc1Cl ZINC000730591584 1043566474 /nfs/dbraw/zinc/56/64/74/1043566474.db2.gz ZAIWVOLPUHVXTE-UHFFFAOYSA-N -1 1 328.170 4.110 20 0 EIADMM CSc1ccccc1S(=O)(=O)[N-]c1cc(Cl)cc(F)c1F ZINC000442241073 1043577764 /nfs/dbraw/zinc/57/77/64/1043577764.db2.gz PKUNSVFSKZRSIJ-UHFFFAOYSA-N -1 1 349.811 4.141 20 0 EIADMM CC[C@H](Sc1ccccc1)C(=O)N=c1cc(-c2cccs2)[n-][nH]1 ZINC000521181812 1043621686 /nfs/dbraw/zinc/62/16/86/1043621686.db2.gz ZMKMQEDUKNLPDU-AWEZNQCLSA-N -1 1 343.477 4.070 20 0 EIADMM Cc1nc2ccccc2c(C)c1CC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000171881377 1043694567 /nfs/dbraw/zinc/69/45/67/1043694567.db2.gz NHSIEGGHMBHCHK-UHFFFAOYSA-N -1 1 340.810 4.392 20 0 EIADMM Cc1ccc(-c2nnc([N-]C(=O)c3ncoc3C(C)C)s2)c(C)c1 ZINC000731979830 1043857588 /nfs/dbraw/zinc/85/75/88/1043857588.db2.gz NXRWNTQMDCOSAJ-UHFFFAOYSA-N -1 1 342.424 4.186 20 0 EIADMM CCOc1cc(C(=O)Nc2ccc3ccoc3c2)cc(Cl)c1[O-] ZINC000442923710 1043899133 /nfs/dbraw/zinc/89/91/33/1043899133.db2.gz NAODYOQDPZBECI-UHFFFAOYSA-N -1 1 331.755 4.443 20 0 EIADMM COc1cc(C(=O)N2CCCCC[C@H]2CC(C)C)cc(Cl)c1[O-] ZINC000442965805 1043929563 /nfs/dbraw/zinc/92/95/63/1043929563.db2.gz JEGONWZGVZYVCD-AWEZNQCLSA-N -1 1 339.863 4.485 20 0 EIADMM COc1cc(C(=O)N[C@H](c2ccccc2C)C(C)C)cc(Cl)c1[O-] ZINC000442974105 1043937239 /nfs/dbraw/zinc/93/72/39/1043937239.db2.gz PABQKNVLWRDOJH-KRWDZBQOSA-N -1 1 347.842 4.490 20 0 EIADMM COc1cc(C(=O)N(C)[C@H](C)Cc2ccc(C)cc2)cc(Cl)c1[O-] ZINC000442986021 1043952410 /nfs/dbraw/zinc/95/24/10/1043952410.db2.gz YFBMVNOEDLPLSF-CYBMUJFWSA-N -1 1 347.842 4.066 20 0 EIADMM CCC[C@H](C)[C@H]1CCCN1C(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC000443042933 1043977663 /nfs/dbraw/zinc/97/76/63/1043977663.db2.gz CSLXPQVOBNNCJN-SMDDNHRTSA-N -1 1 325.836 4.095 20 0 EIADMM COc1cc(C(=O)NCC(C)(C)C2CCCC2)cc(Cl)c1[O-] ZINC000443063537 1043985329 /nfs/dbraw/zinc/98/53/29/1043985329.db2.gz WUWGJLSOFHWLRC-UHFFFAOYSA-N -1 1 325.836 4.000 20 0 EIADMM COc1cc(C(=O)N(CC(C)C)CC(C)(C)C)cc(Cl)c1[O-] ZINC000443058208 1043994237 /nfs/dbraw/zinc/99/42/37/1043994237.db2.gz JTQCQJIJUFRFJW-UHFFFAOYSA-N -1 1 327.852 4.199 20 0 EIADMM COc1cc(-c2nc(-c3cc(F)ccc3C)no2)cc(Cl)c1[O-] ZINC000443210259 1044082005 /nfs/dbraw/zinc/08/20/05/1044082005.db2.gz IBYUVUOIGVDAQB-UHFFFAOYSA-N -1 1 334.734 4.219 20 0 EIADMM CC[C@H](C)Oc1ccc(NC(=O)c2cc(Cl)c([O-])c(OC)c2)cc1 ZINC000443317480 1044180079 /nfs/dbraw/zinc/18/00/79/1044180079.db2.gz XUZYZFLNAXBZTR-NSHDSACASA-N -1 1 349.814 4.484 20 0 EIADMM COc1cc(C(=O)N[C@H](C)c2cc3ccccc3o2)cc(Cl)c1[O-] ZINC000443389996 1044245279 /nfs/dbraw/zinc/24/52/79/1044245279.db2.gz SOUAMOUFXQHICZ-SNVBAGLBSA-N -1 1 345.782 4.291 20 0 EIADMM Cc1csc(-c2cccc(S(=O)(=O)[N-]c3ccc(F)cc3)c2)n1 ZINC000443402213 1044260665 /nfs/dbraw/zinc/26/06/65/1044260665.db2.gz XFXRLEASPZJFQM-UHFFFAOYSA-N -1 1 348.424 4.058 20 0 EIADMM Cc1ccnc(F)c1Nc1c([O-])c(Br)ccc1Cl ZINC001212561596 1044326968 /nfs/dbraw/zinc/32/69/68/1044326968.db2.gz ZXVWPHITOLPNAK-UHFFFAOYSA-N -1 1 331.572 4.394 20 0 EIADMM O=C(Nc1c([O-])cccc1F)c1ccc(Br)c(Cl)c1 ZINC000675708074 1044445248 /nfs/dbraw/zinc/44/52/48/1044445248.db2.gz HUZJYWPHVBONIJ-UHFFFAOYSA-N -1 1 344.567 4.200 20 0 EIADMM C[C@H](c1ccc2ccccc2c1)N(C(=O)c1ncccc1[O-])C1CC1 ZINC000495137450 1044712204 /nfs/dbraw/zinc/71/22/04/1044712204.db2.gz KJBAXBGNIPOEOI-CQSZACIVSA-N -1 1 332.403 4.306 20 0 EIADMM CCC(=O)c1cccc([N-]S(=O)(=O)c2cccc(C(F)F)c2)c1 ZINC000780394636 1044825475 /nfs/dbraw/zinc/82/54/75/1044825475.db2.gz JEGTUHXMUSWMIR-UHFFFAOYSA-N -1 1 339.363 4.018 20 0 EIADMM CC1(C)C[C@H](O)c2cccc(NCc3cccc([O-])c3Cl)c2O1 ZINC000922918343 1044860242 /nfs/dbraw/zinc/86/02/42/1044860242.db2.gz RBKJQTORIBZERI-HNNXBMFYSA-N -1 1 333.815 4.252 20 0 EIADMM CCC(CC)c1nnc([N-]C(=O)c2cc(-c3ccccc3)on2)s1 ZINC000053165629 1044948225 /nfs/dbraw/zinc/94/82/25/1044948225.db2.gz XDYJWKCHCIWVHR-UHFFFAOYSA-N -1 1 342.424 4.349 20 0 EIADMM O=C(N[C@H]1C[C@H]1c1c(F)cccc1Cl)c1c([O-])cccc1Cl ZINC000740928964 1045242727 /nfs/dbraw/zinc/24/27/27/1045242727.db2.gz VPJIMAZRADCMCA-PELKAZGASA-N -1 1 340.181 4.124 20 0 EIADMM CCOc1cc(C(=O)N(CC)c2ccc(C)cc2)cc(Cl)c1[O-] ZINC000762574547 1045297424 /nfs/dbraw/zinc/29/74/24/1045297424.db2.gz LNRAXMIJKAJFIF-UHFFFAOYSA-N -1 1 333.815 4.419 20 0 EIADMM Cc1cc(C(=O)Nc2c([O-])cccc2F)c(C)n1Cc1ccccc1 ZINC000089541387 1045340272 /nfs/dbraw/zinc/34/02/72/1045340272.db2.gz MPIQNERBYAGRMT-UHFFFAOYSA-N -1 1 338.382 4.250 20 0 EIADMM CC(C)c1oc(-c2ccccc2)nc1C(=O)[N-]c1c(F)ccnc1F ZINC001129367167 1045540018 /nfs/dbraw/zinc/54/00/18/1045540018.db2.gz GUKFHRFXOFTQLE-UHFFFAOYSA-N -1 1 343.333 4.391 20 0 EIADMM O=C(Nc1nc(/C=C\c2ccccc2)cs1)c1ccc([O-])c(F)c1 ZINC000768168103 1045733588 /nfs/dbraw/zinc/73/35/88/1045733588.db2.gz SWICIHYWKXNFCW-VURMDHGXSA-N -1 1 340.379 4.411 20 0 EIADMM Cc1cc(C(=O)CCC(=O)Nc2ccc([O-])c(Cl)c2)c(C)s1 ZINC000067739003 1045745753 /nfs/dbraw/zinc/74/57/53/1045745753.db2.gz FMVMIRCYLLAURC-UHFFFAOYSA-N -1 1 337.828 4.326 20 0 EIADMM Cc1ccccc1[N-]S(=O)(=O)c1ccc(OC(F)F)c(Cl)c1 ZINC000032585479 1045825604 /nfs/dbraw/zinc/82/56/04/1045825604.db2.gz YEBJOJDEXGNVLV-UHFFFAOYSA-N -1 1 347.770 4.051 20 0 EIADMM O=S(=O)(/C=C/c1cccc(Cl)c1)[N-]c1cc(Cl)ccc1O ZINC000768880511 1045853198 /nfs/dbraw/zinc/85/31/98/1045853198.db2.gz CVNBJWWUXCLGLD-VOTSOKGWSA-N -1 1 344.219 4.112 20 0 EIADMM O=C([N-][C@@H](c1ccccc1)C(F)(F)F)C(F)(F)c1ccccc1 ZINC000916390172 1046009466 /nfs/dbraw/zinc/00/94/66/1046009466.db2.gz RSAMQXMOYZJWPL-ZDUSSCGKSA-N -1 1 329.268 4.198 20 0 EIADMM CC(=O)Nc1ccc(NCc2cccc([O-])c2Cl)cc1Cl ZINC000328270333 1046018846 /nfs/dbraw/zinc/01/88/46/1046018846.db2.gz WUQSZZNINHLKKG-UHFFFAOYSA-N -1 1 325.195 4.270 20 0 EIADMM C[C@@H](c1cc(F)ccc1F)N(C)C(=O)c1c([O-])cccc1Cl ZINC000769671747 1046041828 /nfs/dbraw/zinc/04/18/28/1046041828.db2.gz DLIUIOYVLMDKHI-VIFPVBQESA-N -1 1 325.742 4.157 20 0 EIADMM O=C(c1c([O-])cccc1Cl)N1CCC[C@H]1Cc1cccc(F)c1 ZINC000769707161 1046051132 /nfs/dbraw/zinc/05/11/32/1046051132.db2.gz XOFYXEJRMCUFDG-AWEZNQCLSA-N -1 1 333.790 4.032 20 0 EIADMM O=C(Nc1cccc(CC[C@@H](O)c2ccccc2)c1)c1ccccc1[O-] ZINC000769970254 1046112256 /nfs/dbraw/zinc/11/22/56/1046112256.db2.gz IMCCIGPHVOJTMC-HXUWFJFHSA-N -1 1 347.414 4.311 20 0 EIADMM CCCC(=CC(=O)N1CCC(C(=O)c2ccc([O-])cc2)CC1)CCC ZINC000770779055 1046269459 /nfs/dbraw/zinc/26/94/59/1046269459.db2.gz CSXOUYBQJLWCMD-UHFFFAOYSA-N -1 1 343.467 4.340 20 0 EIADMM CC[C@H](C)Oc1ccccc1/C=C\C(=O)Nc1c([O-])cccc1F ZINC000770862213 1046276788 /nfs/dbraw/zinc/27/67/88/1046276788.db2.gz LMULTUKKAJLJPQ-HHQWOOOKSA-N -1 1 329.371 4.361 20 0 EIADMM O=C([N-][C@@H](C1CCCC1)C(F)(F)F)C(F)(F)Cc1ccccc1 ZINC000793625230 1046315822 /nfs/dbraw/zinc/31/58/22/1046315822.db2.gz OCKLKAUDKPMXLL-ZDUSSCGKSA-N -1 1 335.316 4.102 20 0 EIADMM CCc1cc(=O)[n-]c(SCCOc2ccc(Cl)cc2Cl)n1 ZINC000428704413 1046568441 /nfs/dbraw/zinc/56/84/41/1046568441.db2.gz XZYROXQLLIUBQB-UHFFFAOYSA-N -1 1 345.251 4.223 20 0 EIADMM CCN(Cc1c[nH]c2ccccc12)C(=O)c1c([O-])cccc1Cl ZINC000785775972 1046748783 /nfs/dbraw/zinc/74/87/83/1046748783.db2.gz JPMZCNOCQQJHQX-UHFFFAOYSA-N -1 1 328.799 4.189 20 0 EIADMM O=C(Cc1cccc(C(F)(F)F)c1)Nc1ccc([O-])c(Cl)c1 ZINC000067738969 1046770249 /nfs/dbraw/zinc/77/02/49/1046770249.db2.gz ATAYQTLHHLJIQF-UHFFFAOYSA-N -1 1 329.705 4.246 20 0 EIADMM CCc1cc(=O)[nH]c(C[NH2+][C@H](C)c2ccc(Oc3ccccc3)cc2)n1 ZINC000537060732 1046910659 /nfs/dbraw/zinc/91/06/59/1046910659.db2.gz PFQHKHPWILPJGW-OAHLLOKOSA-N -1 1 349.434 4.388 20 0 EIADMM O=c1cc(C(F)F)nc(SC[C@@H]2[C@@H](c3ccccc3)C2(F)F)[n-]1 ZINC000917746364 1047102542 /nfs/dbraw/zinc/10/25/42/1047102542.db2.gz NDSOFNBKXWHSPI-BXKDBHETSA-N -1 1 344.333 4.261 20 0 EIADMM CCOc1cc(-c2noc(-c3ccc4ccccc4c3[O-])n2)ccc1O ZINC000445428163 1047136820 /nfs/dbraw/zinc/13/68/20/1047136820.db2.gz URIMTEVNEPIQSO-UHFFFAOYSA-N -1 1 348.358 4.367 20 0 EIADMM COc1cc(C(=O)N[C@H](C)c2cc(C)cc(C)c2)cc(Cl)c1[O-] ZINC000460202394 1047159323 /nfs/dbraw/zinc/15/93/23/1047159323.db2.gz ONRNTLSNULTEEP-GFCCVEGCSA-N -1 1 333.815 4.162 20 0 EIADMM COc1cc(C(=O)NC(C)(C)Cc2ccccc2C)cc(Cl)c1[O-] ZINC000460189164 1047169820 /nfs/dbraw/zinc/16/98/20/1047169820.db2.gz UZWYZZJCAPTJBN-UHFFFAOYSA-N -1 1 347.842 4.114 20 0 EIADMM O=C(C[C@@H](c1ccccc1)C(F)(F)F)Nc1nc(Cl)ccc1[O-] ZINC000789930510 1047486918 /nfs/dbraw/zinc/48/69/18/1047486918.db2.gz TXQYRGYFCJRHOC-JTQLQIEISA-N -1 1 344.720 4.115 20 0 EIADMM CC(C)c1ccccc1S(=O)(=O)[N-]c1ccc([C@@H]2CCOC2)cc1 ZINC000556266475 1047645084 /nfs/dbraw/zinc/64/50/84/1047645084.db2.gz AETBDWBDRXVKGI-MRXNPFEDSA-N -1 1 345.464 4.115 20 0 EIADMM CCCN(C(=O)c1ccc([O-])c(F)c1)[C@H]1C[C@H](OCC)C12CCCC2 ZINC001136843890 1047846772 /nfs/dbraw/zinc/84/67/72/1047846772.db2.gz CXLVNGSMMWCBAP-ROUUACIJSA-N -1 1 349.446 4.121 20 0 EIADMM CCCN(C(=O)c1ccc([O-])c(F)c1)[C@@H]1C[C@H](OCC)C12CCCC2 ZINC001136843888 1047847347 /nfs/dbraw/zinc/84/73/47/1047847347.db2.gz CXLVNGSMMWCBAP-MSOLQXFVSA-N -1 1 349.446 4.121 20 0 EIADMM Cc1cccc(-c2ccc(CNC(=O)c3cccc([O-])c3F)cc2)c1 ZINC001136917851 1047897261 /nfs/dbraw/zinc/89/72/61/1047897261.db2.gz WNQDJFQRISWYLS-UHFFFAOYSA-N -1 1 335.378 4.437 20 0 EIADMM [O-]c1ccc(-c2nc(-c3cccnc3Oc3ccccc3)no2)c(F)c1 ZINC000131944242 1048171215 /nfs/dbraw/zinc/17/12/15/1048171215.db2.gz MKHQZWFXEZQSHR-UHFFFAOYSA-N -1 1 349.321 4.436 20 0 EIADMM [O-]c1cccc(CNc2ccc(OC[C@@H]3CCCO3)cc2)c1Cl ZINC000815127225 1048341461 /nfs/dbraw/zinc/34/14/61/1048341461.db2.gz ZLRSSNFPRAMURF-INIZCTEOSA-N -1 1 333.815 4.216 20 0 EIADMM Cc1nc(C(C)C)oc1C(=O)[N-]c1nc(-c2ccc(F)cc2)ns1 ZINC000815587853 1048525433 /nfs/dbraw/zinc/52/54/33/1048525433.db2.gz VUORKBIVNOCLEL-UHFFFAOYSA-N -1 1 346.387 4.016 20 0 EIADMM O=C(Nc1ccc(N2CCCC2)c(Cl)c1)c1ccc(F)c([O-])c1 ZINC001144248447 1048529059 /nfs/dbraw/zinc/52/90/59/1048529059.db2.gz NFFNBIZVIMZTCT-UHFFFAOYSA-N -1 1 334.778 4.037 20 0 EIADMM CC[C@H](C(=O)[O-])N(C)Cc1ccc(-c2cccc(C(F)(F)F)c2)o1 ZINC000844935982 1048554792 /nfs/dbraw/zinc/55/47/92/1048554792.db2.gz GSMARUQTNVGNME-CQSZACIVSA-N -1 1 341.329 4.260 20 0 EIADMM CC(C)Oc1ccc(CSc2nc(C(F)F)cc(=O)[n-]2)cc1 ZINC000809987162 1048590636 /nfs/dbraw/zinc/59/06/36/1048590636.db2.gz UMNJVBJFPGAIID-UHFFFAOYSA-N -1 1 326.368 4.199 20 0 EIADMM O=C(NCCc1ccc(C(F)(F)F)cc1)c1c([O-])cccc1Cl ZINC000920426842 1048672237 /nfs/dbraw/zinc/67/22/37/1048672237.db2.gz KVWXWBGMGJQYRL-UHFFFAOYSA-N -1 1 343.732 4.037 20 0 EIADMM O=C(NCc1ccc(-c2ccccc2)o1)c1c([O-])cccc1Cl ZINC000920456579 1048676770 /nfs/dbraw/zinc/67/67/70/1048676770.db2.gz YZOASYCWDAWSLA-UHFFFAOYSA-N -1 1 327.767 4.236 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N1CC[C@H](CSc2ccccc2)C1 ZINC000075200038 1048702680 /nfs/dbraw/zinc/70/26/80/1048702680.db2.gz YIMHYNHSFQLKKH-ZDUSSCGKSA-N -1 1 347.867 4.300 20 0 EIADMM [O-]c1cc(F)c(CN2CCC(c3nc4ccccc4o3)CC2)cc1F ZINC001144646926 1048769680 /nfs/dbraw/zinc/76/96/80/1048769680.db2.gz QKOKGXJEHOVSMF-UHFFFAOYSA-N -1 1 344.361 4.191 20 0 EIADMM O=C([O-])c1ccsc1CN1CCC[C@H]1c1ccc(Cl)s1 ZINC001144678404 1048799976 /nfs/dbraw/zinc/79/99/76/1048799976.db2.gz ZAJCAOKFWRFTGK-JTQLQIEISA-N -1 1 327.858 4.498 20 0 EIADMM CCCOC(=O)c1ccc(NC(=O)c2cc3ccccc3cc2[O-])cc1 ZINC001135745039 1048880844 /nfs/dbraw/zinc/88/08/44/1048880844.db2.gz BGVRZFOCFRDHTC-UHFFFAOYSA-N -1 1 349.386 4.365 20 0 EIADMM CCOc1ccc([C@H]2CCCN2C(=O)c2ccc(Cl)cc2[O-])cc1 ZINC001135791514 1048886108 /nfs/dbraw/zinc/88/61/08/1048886108.db2.gz POALSXBQHWWGPY-QGZVFWFLSA-N -1 1 345.826 4.422 20 0 EIADMM CC(C)(C)c1ccccc1OCCNC(=O)c1c([O-])cccc1Cl ZINC001144940946 1048897568 /nfs/dbraw/zinc/89/75/68/1048897568.db2.gz JAOHWOKSWFUIKB-UHFFFAOYSA-N -1 1 347.842 4.152 20 0 EIADMM O=C(NCCCOC1CCCCC1)c1ccc2ccccc2c1[O-] ZINC001135919155 1048977165 /nfs/dbraw/zinc/97/71/65/1048977165.db2.gz XBOLAFYKOSMOIJ-UHFFFAOYSA-N -1 1 327.424 4.015 20 0 EIADMM O=C(N[C@@H](c1cccs1)C1CC1)c1c([O-])cnc2c(F)cccc21 ZINC001136056273 1049058565 /nfs/dbraw/zinc/05/85/65/1049058565.db2.gz UPDGBCHUIYZZAM-MRXNPFEDSA-N -1 1 342.395 4.022 20 0 EIADMM O=C(N[C@H](c1cccs1)C1CC1)c1c([O-])cnc2c(F)cccc21 ZINC001136056271 1049059413 /nfs/dbraw/zinc/05/94/13/1049059413.db2.gz UPDGBCHUIYZZAM-INIZCTEOSA-N -1 1 342.395 4.022 20 0 EIADMM O=C(Cc1ccc([O-])c(Cl)c1)NCc1cc(Cl)cc(Cl)c1 ZINC001147135854 1049098043 /nfs/dbraw/zinc/09/80/43/1049098043.db2.gz AFYRAOSDOTZRBQ-UHFFFAOYSA-N -1 1 344.625 4.211 20 0 EIADMM CC[C@@H](NC(=O)Cc1ccc([O-])c(Cl)c1)c1cc(F)ccc1F ZINC001147218315 1049112877 /nfs/dbraw/zinc/11/28/77/1049112877.db2.gz OKORABFPIFPDAP-OAHLLOKOSA-N -1 1 339.769 4.134 20 0 EIADMM CC(C)(C)c1ccc(C(=O)Nc2cccc(C(F)(F)F)c2[O-])cn1 ZINC001147806677 1049214344 /nfs/dbraw/zinc/21/43/44/1049214344.db2.gz ZWAFVNMYENHZRT-UHFFFAOYSA-N -1 1 338.329 4.356 20 0 EIADMM O=C(N[C@@H]1CCSc2c(F)cccc21)c1cc(Cl)ccc1[O-] ZINC001136193465 1049264848 /nfs/dbraw/zinc/26/48/48/1049264848.db2.gz VMQHWIVCVJPUFP-CYBMUJFWSA-N -1 1 337.803 4.152 20 0 EIADMM CC[C@@H](C)c1ccc(S(=O)(=O)[N-]c2ccc3[nH]ccc3c2)cc1 ZINC000078677288 1049268950 /nfs/dbraw/zinc/26/89/50/1049268950.db2.gz QQWOJFJCDAVWIM-CYBMUJFWSA-N -1 1 328.437 4.482 20 0 EIADMM O=C(Nc1cccc2c1COC2)c1cccc(-c2ccccc2)c1[O-] ZINC001148869295 1049390456 /nfs/dbraw/zinc/39/04/56/1049390456.db2.gz HMPTYDSOJUDDDM-UHFFFAOYSA-N -1 1 331.371 4.342 20 0 EIADMM COc1c(O)cccc1NC(=O)c1cccc(-c2ccccc2)c1[O-] ZINC001148870492 1049390598 /nfs/dbraw/zinc/39/05/98/1049390598.db2.gz YBFZMAVSZHSHDN-UHFFFAOYSA-N -1 1 335.359 4.026 20 0 EIADMM O=C(c1cccc(-c2ccccc2)c1[O-])N1CCC(=O)[C@@H]2CCCC[C@H]21 ZINC001148860901 1049391437 /nfs/dbraw/zinc/39/14/37/1049391437.db2.gz APCVSYONGQQLOW-IEBWSBKVSA-N -1 1 349.430 4.033 20 0 EIADMM O=C(Nc1ncnc2sccc21)c1cccc(-c2ccccc2)c1[O-] ZINC001148861086 1049391750 /nfs/dbraw/zinc/39/17/50/1049391750.db2.gz KCUIYTLHWTVDSJ-UHFFFAOYSA-N -1 1 347.399 4.316 20 0 EIADMM C[C@]1(Cc2noc(Cc3ccc([O-])c(Cl)c3)n2)CC1(Cl)Cl ZINC000867026704 1049435164 /nfs/dbraw/zinc/43/51/64/1049435164.db2.gz ZCGXPDXZWYIDRH-ZDUSSCGKSA-N -1 1 347.629 4.146 20 0 EIADMM COc1cnc(C=Cc2ccc(-c3ccc(F)cc3)s2)[n-]c1=O ZINC000821009282 1049594459 /nfs/dbraw/zinc/59/44/59/1049594459.db2.gz YSMKGDALNAVBAD-VQHVLOKHSA-N -1 1 328.368 4.229 20 0 EIADMM CC(C)[C@@H]1CC[C@@H](C)C[C@H]1CNC(=O)Cc1ccc([O-])c(Cl)c1 ZINC001136488292 1049675953 /nfs/dbraw/zinc/67/59/53/1049675953.db2.gz KEKCURNHOTXDGB-KBMXLJTQSA-N -1 1 337.891 4.413 20 0 EIADMM O=C(N[C@@H](c1ccccc1)[C@H]1CCCO1)c1ccc2ccccc2c1[O-] ZINC001136524623 1049714576 /nfs/dbraw/zinc/71/45/76/1049714576.db2.gz IREJJLYPLXWCIE-UXHICEINSA-N -1 1 347.414 4.196 20 0 EIADMM O=C(Nc1nc2ccccc2n1-c1ccccc1)c1cc(F)ccc1[O-] ZINC001136554512 1049740346 /nfs/dbraw/zinc/74/03/46/1049740346.db2.gz HBPDNJMYBGBQFQ-UHFFFAOYSA-N -1 1 347.349 4.123 20 0 EIADMM C[C@@H](Oc1cccc(C(C)(C)C)c1)C(=O)Nc1cccc(F)c1[O-] ZINC001171632731 1049764387 /nfs/dbraw/zinc/76/43/87/1049764387.db2.gz MPBQAGQSPYTSBG-GFCCVEGCSA-N -1 1 331.387 4.235 20 0 EIADMM CC(C)c1ccc2c(c1)CN(Cc1cc(=O)oc3cc(O)ccc13)CC2 ZINC001171820611 1049803026 /nfs/dbraw/zinc/80/30/26/1049803026.db2.gz PZXDSJHNKOWQQH-UHFFFAOYSA-N -1 1 349.430 4.180 20 0 EIADMM O=C(Nc1ccc(Oc2ccc(F)cc2)cn1)c1cc(F)ccc1[O-] ZINC001136678097 1049823033 /nfs/dbraw/zinc/82/30/33/1049823033.db2.gz NKVQXSUDAJNZFM-UHFFFAOYSA-N -1 1 342.301 4.110 20 0 EIADMM O=c1ccn(-c2ccc(Nc3ccc(C(F)(F)F)cc3O)cc2)[n-]1 ZINC001212633749 1049833679 /nfs/dbraw/zinc/83/36/79/1049833679.db2.gz BMVLZWMTJQDXEW-UHFFFAOYSA-N -1 1 335.285 4.046 20 0 EIADMM Cc1cnc(C(=O)NCc2ccccc2Oc2ccccc2C)c([O-])c1 ZINC001136708889 1049841736 /nfs/dbraw/zinc/84/17/36/1049841736.db2.gz QKQOYPZTUQVBHT-UHFFFAOYSA-N -1 1 348.402 4.126 20 0 EIADMM O=C(Nc1ccc([O-])c(F)c1F)[C@@H]1CCC[C@H]1Cc1ccccc1 ZINC000616100557 1049846083 /nfs/dbraw/zinc/84/60/83/1049846083.db2.gz JVPQYRMIFKNUGK-UONOGXRCSA-N -1 1 331.362 4.268 20 0 EIADMM CC[C@@H](NC(=O)c1cc(C)cc(C=O)c1[O-])c1ccc(Cl)s1 ZINC001136806690 1049893623 /nfs/dbraw/zinc/89/36/23/1049893623.db2.gz WRHIPJHWLZNJCO-GFCCVEGCSA-N -1 1 337.828 4.109 20 0 EIADMM CC(=O)Nc1c(C)ccc(NC(=O)c2ccc(C(C)C)cc2[O-])c1C ZINC000617246406 1049968796 /nfs/dbraw/zinc/96/87/96/1049968796.db2.gz PVWJNOVCJJLZCU-UHFFFAOYSA-N -1 1 340.423 4.343 20 0 EIADMM Cc1cc(Cl)ccc1-c1noc(-c2ncc(C(F)(F)F)[n-]2)n1 ZINC001212690065 1050228463 /nfs/dbraw/zinc/22/84/63/1050228463.db2.gz VUZCVOOTPONSRJ-UHFFFAOYSA-N -1 1 328.681 4.107 20 0 EIADMM Cc1cc(Cl)ccc1-c1noc(-c2nc(C(F)(F)F)c[n-]2)n1 ZINC001212690065 1050228470 /nfs/dbraw/zinc/22/84/70/1050228470.db2.gz VUZCVOOTPONSRJ-UHFFFAOYSA-N -1 1 328.681 4.107 20 0 EIADMM O=C(NCc1cccc(-c2ccc(F)cc2)c1)c1ccc([O-])c(F)c1 ZINC001186234598 1050264959 /nfs/dbraw/zinc/26/49/59/1050264959.db2.gz VLEXRCLCOHWIBO-UHFFFAOYSA-N -1 1 339.341 4.267 20 0 EIADMM O=C(Nc1cc(-c2ccccc2)cc(Cl)n1)c1ccc([O-])c(F)c1 ZINC001186209580 1050271675 /nfs/dbraw/zinc/27/16/75/1050271675.db2.gz YNRAVHKLYKMOLB-UHFFFAOYSA-N -1 1 342.757 4.499 20 0 EIADMM CC(C)c1oncc1[N-]C(=O)c1csc(-c2c(F)cccc2F)n1 ZINC001177843537 1050312324 /nfs/dbraw/zinc/31/23/24/1050312324.db2.gz FKEBNLYPGQJGGP-UHFFFAOYSA-N -1 1 349.362 4.452 20 0 EIADMM [O-]c1ccc(-c2noc(CSCc3ccc(F)cc3)n2)cc1F ZINC000618413229 1050370269 /nfs/dbraw/zinc/37/02/69/1050370269.db2.gz REHLOGYHAUVKER-UHFFFAOYSA-N -1 1 334.347 4.154 20 0 EIADMM [O-]c1c(Br)ccc(Cl)c1Nc1cc(F)cc(CO)c1 ZINC001212751694 1050544940 /nfs/dbraw/zinc/54/49/40/1050544940.db2.gz VDUCYTDSCVZFCV-UHFFFAOYSA-N -1 1 346.583 4.183 20 0 EIADMM COc1cc(OC)c(Nc2cc(Cl)c([O-])cc2Cl)c(OC)c1 ZINC001173909934 1050621050 /nfs/dbraw/zinc/62/10/50/1050621050.db2.gz DTAFLPXVXBOSMJ-UHFFFAOYSA-N -1 1 344.194 4.468 20 0 EIADMM [O-]C(c1ccc(Nc2ccoc2)cc1)(C(F)(F)F)C(F)(F)F ZINC001173935222 1050655044 /nfs/dbraw/zinc/65/50/44/1050655044.db2.gz WPIHTYQKQVQVKR-UHFFFAOYSA-N -1 1 325.208 4.335 20 0 EIADMM Cc1ccc(NC(=O)Nc2cccc([O-])c2Br)cc1F ZINC001187991487 1050665021 /nfs/dbraw/zinc/66/50/21/1050665021.db2.gz PNFGUJSHFBLXJO-UHFFFAOYSA-N -1 1 339.164 4.246 20 0 EIADMM COc1ccc(C)cc1Nc1ccc(F)c(Br)c1[O-] ZINC001173987106 1050665677 /nfs/dbraw/zinc/66/56/77/1050665677.db2.gz UZBBXJMRGMMERK-UHFFFAOYSA-N -1 1 326.165 4.354 20 0 EIADMM [O-]C(c1cccc(NC2=CCCC2)c1)(C(F)(F)F)C(F)(F)F ZINC001173998084 1050671614 /nfs/dbraw/zinc/67/16/14/1050671614.db2.gz FJHPYGDHFUJJKW-UHFFFAOYSA-N -1 1 325.252 4.479 20 0 EIADMM CN(C)C(=O)c1ccc(Nc2ccc(Cl)c(Cl)c2[O-])cc1 ZINC001174007527 1050677066 /nfs/dbraw/zinc/67/70/66/1050677066.db2.gz YNQXHSUQPXCPEE-UHFFFAOYSA-N -1 1 325.195 4.144 20 0 EIADMM CCCC[C@@H](CCC)C[N-]S(=O)(=O)c1cc2cc(F)ccc2o1 ZINC001188017352 1050679360 /nfs/dbraw/zinc/67/93/60/1050679360.db2.gz OUMNWGLVEAYQBJ-CYBMUJFWSA-N -1 1 341.448 4.457 20 0 EIADMM Cc1ccc([S@@](C)(=O)=NC(=O)c2cc3sccc3c([O-])c2)cc1 ZINC001179389844 1050688258 /nfs/dbraw/zinc/68/82/58/1050688258.db2.gz VFHFMLFFADTCDT-HSZRJFAPSA-N -1 1 345.445 4.212 20 0 EIADMM CCc1c(Cl)cc(Nc2ccc(C(N)=O)cc2)c([O-])c1Cl ZINC001174051757 1050690269 /nfs/dbraw/zinc/69/02/69/1050690269.db2.gz WNGKKMQMHCQABL-UHFFFAOYSA-N -1 1 325.195 4.104 20 0 EIADMM O=C(NC1CCCCC1)c1ccc(Nc2cc(F)c([O-])cc2F)cc1 ZINC001174081460 1050754772 /nfs/dbraw/zinc/75/47/72/1050754772.db2.gz OGDZXOHNNDIHFT-UHFFFAOYSA-N -1 1 346.377 4.477 20 0 EIADMM Cc1c(Cl)cc(Nc2cccc(C(=O)N(C)C)c2)c([O-])c1Cl ZINC001174088315 1050762827 /nfs/dbraw/zinc/76/28/27/1050762827.db2.gz QQNWNQMRGYRPQI-UHFFFAOYSA-N -1 1 339.222 4.453 20 0 EIADMM O=S(=O)([N-]c1cccc(F)c1)c1ccc(-c2ccc(F)cc2)cc1 ZINC001188420442 1050762945 /nfs/dbraw/zinc/76/29/45/1050762945.db2.gz RDJXKFVNFLMLSC-UHFFFAOYSA-N -1 1 345.370 4.433 20 0 EIADMM COc1cc(F)ccc1Nc1ccc(F)c(Br)c1[O-] ZINC001174130314 1050773767 /nfs/dbraw/zinc/77/37/67/1050773767.db2.gz MBINYXADWMKBTL-UHFFFAOYSA-N -1 1 330.128 4.185 20 0 EIADMM Cc1ccc(Cl)cc1NC(=O)Nc1cc2ccc([O-])cc2oc1=O ZINC001188702749 1050827429 /nfs/dbraw/zinc/82/74/29/1050827429.db2.gz MTOLYWNWZHKGEC-UHFFFAOYSA-N -1 1 344.754 4.104 20 0 EIADMM CCCn1cc(Nc2c(Cl)ccc(Br)c2[O-])cn1 ZINC001174222843 1050852398 /nfs/dbraw/zinc/85/23/98/1050852398.db2.gz LCBCXEPLFNXBGT-UHFFFAOYSA-N -1 1 330.613 4.158 20 0 EIADMM O=C(NC[C@@H]1CCC=CCCC1)c1ccc(Br)cc1[O-] ZINC001180306809 1050947393 /nfs/dbraw/zinc/94/73/93/1050947393.db2.gz JEXDXZTXROHICY-GFCCVEGCSA-N -1 1 338.245 4.021 20 0 EIADMM CCCCOc1ccc(NC(=O)Nc2cc(F)c([O-])cc2F)cc1 ZINC001189315279 1050961364 /nfs/dbraw/zinc/96/13/64/1050961364.db2.gz XIUXJCVXBLMCAP-UHFFFAOYSA-N -1 1 336.338 4.493 20 0 EIADMM CCc1ccccc1[N-]S(=O)(=O)c1ccc(F)c2ccccc21 ZINC001189385785 1050975785 /nfs/dbraw/zinc/97/57/85/1050975785.db2.gz QKNWKCSPXJSGDJ-UHFFFAOYSA-N -1 1 329.396 4.342 20 0 EIADMM O=C(Nc1ccc(Cl)cc1[O-])c1occc1COc1ccccc1 ZINC000153459719 1051045864 /nfs/dbraw/zinc/04/58/64/1051045864.db2.gz CZZRTNOOACCFJT-UHFFFAOYSA-N -1 1 343.766 4.470 20 0 EIADMM O=C(CNC(=O)Nc1ccccc1-c1ccccc1)c1ccc([O-])cc1 ZINC001189735339 1051055896 /nfs/dbraw/zinc/05/58/96/1051055896.db2.gz NJYUUFLJUIRJBU-UHFFFAOYSA-N -1 1 346.386 4.064 20 0 EIADMM [O-]c1c(Cl)c(Cl)ccc1Nc1cnn([C@@H]2CCCCO2)c1 ZINC001174603769 1051102119 /nfs/dbraw/zinc/10/21/19/1051102119.db2.gz FOMAQSLRNVGHPQ-LBPRGKRZSA-N -1 1 328.199 4.338 20 0 EIADMM O=C(NCc1ccc(Cl)cc1Cl)Nc1cc(F)c([O-])cc1F ZINC001190098633 1051113642 /nfs/dbraw/zinc/11/36/42/1051113642.db2.gz NOQOEIPCBMHUGH-UHFFFAOYSA-N -1 1 347.148 4.299 20 0 EIADMM COc1cc([O-])c(C(=O)Nc2c(C)ccc3ccccc32)c(OC)c1 ZINC001190112843 1051122965 /nfs/dbraw/zinc/12/29/65/1051122965.db2.gz FUQJIYAIMNDIII-UHFFFAOYSA-N -1 1 337.375 4.123 20 0 EIADMM Cc1noc(-c2ccccc2)c1NC(=O)Nc1ccc([O-])c(F)c1F ZINC001190365042 1051159991 /nfs/dbraw/zinc/15/99/91/1051159991.db2.gz REGZZYRRSJJFBY-UHFFFAOYSA-N -1 1 345.305 4.278 20 0 EIADMM CC(=O)c1ccc([N-]S(=O)(=O)c2ccc(C3CC3)cc2)cc1Cl ZINC001190507425 1051198631 /nfs/dbraw/zinc/19/86/31/1051198631.db2.gz VOUBOTWRJLDHML-UHFFFAOYSA-N -1 1 349.839 4.221 20 0 EIADMM CSc1ccc([O-])c(C(=O)Nc2cc(F)cc(OC(F)F)c2)c1 ZINC001174886540 1051204041 /nfs/dbraw/zinc/20/40/41/1051204041.db2.gz MGRUWZCTRWKJMM-UHFFFAOYSA-N -1 1 343.326 4.107 20 0 EIADMM Cc1ccc(Nc2cc(S(C)(=O)=O)ccc2[O-])c2ccccc12 ZINC001174986611 1051305962 /nfs/dbraw/zinc/30/59/62/1051305962.db2.gz GGUFPEJQVJOOSX-UHFFFAOYSA-N -1 1 327.405 4.001 20 0 EIADMM C[C@H](NC(=O)c1ccc([O-])cc1F)c1nc(-c2ccccc2)cs1 ZINC000154872410 1051344771 /nfs/dbraw/zinc/34/47/71/1051344771.db2.gz WKDCAATXVPZZHI-NSHDSACASA-N -1 1 342.395 4.146 20 0 EIADMM Cc1ccc(F)cc1NC(=O)Nc1cccc([O-])c1Br ZINC001191419620 1051452539 /nfs/dbraw/zinc/45/25/39/1051452539.db2.gz DVSWCNUCKQRNEW-UHFFFAOYSA-N -1 1 339.164 4.246 20 0 EIADMM O=S(=O)([N-][C@@H](C1CCC1)C1CCCC1)c1cc(Cl)ccc1F ZINC001191720193 1051519970 /nfs/dbraw/zinc/51/99/70/1051519970.db2.gz OBCSTJFRLCFZHQ-MRXNPFEDSA-N -1 1 345.867 4.116 20 0 EIADMM Cc1c2c[nH]nc2ccc1Nc1ccc(F)c(Br)c1[O-] ZINC001175467407 1051600615 /nfs/dbraw/zinc/60/06/15/1051600615.db2.gz SYDHXKQUOVJCFZ-UHFFFAOYSA-N -1 1 336.164 4.222 20 0 EIADMM O=C(Nc1cccc(C(F)(F)F)c1[O-])c1c[nH]c(-c2ccccc2)n1 ZINC001192215356 1051667672 /nfs/dbraw/zinc/66/76/72/1051667672.db2.gz IXNKCSUTYWDJKG-UHFFFAOYSA-N -1 1 347.296 4.053 20 0 EIADMM Cc1cc(Cl)ccc1S(=O)(=O)[N-]c1ccc(-c2ncco2)cc1 ZINC000157735032 1051669107 /nfs/dbraw/zinc/66/91/07/1051669107.db2.gz LCRLPKPCWINKMX-UHFFFAOYSA-N -1 1 348.811 4.104 20 0 EIADMM CC(C)(C)c1ccc(C(=O)Nc2cc(Cl)nnc2Cl)c([O-])c1 ZINC001192314403 1051689825 /nfs/dbraw/zinc/68/98/25/1051689825.db2.gz OQUIQPITEFFEKZ-UHFFFAOYSA-N -1 1 340.210 4.039 20 0 EIADMM CSc1ccc(Nc2ccc(F)c(Br)c2[O-])cn1 ZINC001175657330 1051713906 /nfs/dbraw/zinc/71/39/06/1051713906.db2.gz IJJLDMGGCDIPBS-UHFFFAOYSA-N -1 1 329.194 4.154 20 0 EIADMM Cc1ccc(OCc2ccccc2)c(-n2[n-]c(=O)c3ccc(N)cc32)c1 ZINC001175719978 1051739485 /nfs/dbraw/zinc/73/94/85/1051739485.db2.gz ULWMVEVAIILPDI-UHFFFAOYSA-N -1 1 345.402 4.201 20 0 EIADMM CCc1ccc(C(=O)Nc2nc3c(ccc(F)c3C)s2)c([O-])c1 ZINC001182997933 1051758961 /nfs/dbraw/zinc/75/89/61/1051758961.db2.gz YOAVHGMJOAFQCO-UHFFFAOYSA-N -1 1 330.384 4.264 20 0 EIADMM Nc1ccccc1N(C(=O)c1c(F)ccc([O-])c1F)c1ccccc1 ZINC001192541518 1051763663 /nfs/dbraw/zinc/76/36/63/1051763663.db2.gz XNIAPLDSBLXXSW-UHFFFAOYSA-N -1 1 340.329 4.231 20 0 EIADMM [O-]c1c(Br)ccc(Cl)c1Nc1cnn(C2CC2)c1 ZINC001175964587 1051851735 /nfs/dbraw/zinc/85/17/35/1051851735.db2.gz ZHOLYCUXLPDBHC-UHFFFAOYSA-N -1 1 328.597 4.083 20 0 EIADMM C[C@H](NC(=O)c1ccc(Br)c([O-])c1)[C@@H]1CCC[C@@H](C)C1 ZINC001183706133 1051886759 /nfs/dbraw/zinc/88/67/59/1051886759.db2.gz FKJKXSQSIIEZIB-GRYCIOLGSA-N -1 1 340.261 4.099 20 0 EIADMM O=S(=O)(/C=C/c1cccc(Cl)c1)Nc1ccc([O-])c(Cl)c1 ZINC000184244793 1051888152 /nfs/dbraw/zinc/88/81/52/1051888152.db2.gz WOCNSBPXYWUGIP-VOTSOKGWSA-N -1 1 344.219 4.112 20 0 EIADMM Cc1cccc(Cl)c1NC(=O)Nc1cc(=O)n(-c2ccccc2)[n-]1 ZINC001183718526 1051888452 /nfs/dbraw/zinc/88/84/52/1051888452.db2.gz GPFMWQUZPDQEFN-UHFFFAOYSA-N -1 1 342.786 4.184 20 0 EIADMM CC(C)OC(=O)Nc1cc(Br)c(C(F)(F)F)cc1[O-] ZINC001193495625 1051932918 /nfs/dbraw/zinc/93/29/18/1051932918.db2.gz CFWTWAQLTJBIRU-UHFFFAOYSA-N -1 1 342.111 4.130 20 0 EIADMM CC(C)(C)[C@H]1CC[C@H](C(=O)Nc2cc(=O)n(-c3ccccc3)[n-]2)CC1 ZINC001184214643 1051967034 /nfs/dbraw/zinc/96/70/34/1051967034.db2.gz HVLVCYQJEWOOFW-SHTZXODSSA-N -1 1 341.455 4.369 20 0 EIADMM CC(C)(C)[C@H]1CC[C@H](C(=O)Nc2ccc(-n3ccc(=O)[n-]3)cc2)CC1 ZINC001184221404 1051971572 /nfs/dbraw/zinc/97/15/72/1051971572.db2.gz PMKPITJNKFNOFD-SHTZXODSSA-N -1 1 341.455 4.369 20 0 EIADMM Cc1ccc(F)cc1[N-]S(=O)(=O)c1ccc(C)c2ccccc21 ZINC001193824145 1052004392 /nfs/dbraw/zinc/00/43/92/1052004392.db2.gz CNSDRRPFUCJHQV-UHFFFAOYSA-N -1 1 329.396 4.397 20 0 EIADMM O=C(NC[C@@H]1CCC=CCCC1)c1ccc(Br)c([O-])c1 ZINC001184450509 1052014809 /nfs/dbraw/zinc/01/48/09/1052014809.db2.gz KICWQIOWNZDPJJ-GFCCVEGCSA-N -1 1 338.245 4.021 20 0 EIADMM O=C(NC[C@@H]1CCC=CCCC1)c1c([O-])cnc2ccc(Cl)cc21 ZINC001184452430 1052015465 /nfs/dbraw/zinc/01/54/65/1052015465.db2.gz SJHBUDBIUHWGSG-CYBMUJFWSA-N -1 1 344.842 4.460 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2ccc(Cl)cc2)cc1-c1ncco1 ZINC000164674628 1052037569 /nfs/dbraw/zinc/03/75/69/1052037569.db2.gz KGBBLYDMJCEIOV-UHFFFAOYSA-N -1 1 348.811 4.104 20 0 EIADMM O=C([O-])c1ccc2c(c1)CN(CCCCc1cccc(Cl)c1)C2 ZINC000622001932 1052070164 /nfs/dbraw/zinc/07/01/64/1052070164.db2.gz OKFPAMPWHSAPND-UHFFFAOYSA-N -1 1 329.827 4.377 20 0 EIADMM Cc1c(O)cccc1[N-]S(=O)(=O)c1ccc(-c2cccs2)cc1 ZINC001194169743 1052093653 /nfs/dbraw/zinc/09/36/53/1052093653.db2.gz UCJWKHXKIZGUJJ-UHFFFAOYSA-N -1 1 345.445 4.230 20 0 EIADMM O=S(=O)([N-]c1ccc(F)cc1)c1cccc2c(Cl)cccc21 ZINC001194404887 1052141873 /nfs/dbraw/zinc/14/18/73/1052141873.db2.gz XELBTIBPTDSMOX-UHFFFAOYSA-N -1 1 335.787 4.433 20 0 EIADMM C[C@@H]1CC(C)(C)C[C@](C)([N-]S(=O)(=O)c2ccc(C(F)F)o2)C1 ZINC001194409278 1052142014 /nfs/dbraw/zinc/14/20/14/1052142014.db2.gz NHESJQAMVBZLHO-MEBBXXQBSA-N -1 1 335.416 4.100 20 0 EIADMM Cc1cc(C)cc([N-]S(=O)(=O)c2cccc3c(Cl)nccc32)c1 ZINC001194454949 1052148872 /nfs/dbraw/zinc/14/88/72/1052148872.db2.gz JZVBAXVGXOYBMW-UHFFFAOYSA-N -1 1 346.839 4.306 20 0 EIADMM O=c1oc2cc([O-])ccc2cc1Nc1ccc(OC(F)(F)F)cc1 ZINC001176641121 1052149775 /nfs/dbraw/zinc/14/97/75/1052149775.db2.gz FEFHRWHHDDEFQA-UHFFFAOYSA-N -1 1 337.253 4.141 20 0 EIADMM CCCOC(=O)c1ccc(Nc2c(F)cc(F)c([O-])c2F)cc1 ZINC001176670782 1052157651 /nfs/dbraw/zinc/15/76/51/1052157651.db2.gz KQYCTOVMYIRLIG-UHFFFAOYSA-N -1 1 325.286 4.120 20 0 EIADMM Cc1cc(C)c(Nc2c(F)cc(F)c([O-])c2F)c(Br)n1 ZINC001176664668 1052158244 /nfs/dbraw/zinc/15/82/44/1052158244.db2.gz UHFSMUIEBKTFMZ-UHFFFAOYSA-N -1 1 347.134 4.327 20 0 EIADMM CC1(C)Cc2c(Nc3c(F)cc(F)c([O-])c3F)cccc2NC1=O ZINC001176673227 1052160036 /nfs/dbraw/zinc/16/00/36/1052160036.db2.gz UVMBYIGFBHZRQQ-UHFFFAOYSA-N -1 1 336.313 4.074 20 0 EIADMM CC1(C)CC(=O)Nc2c(Nc3c(F)cc(F)c([O-])c3F)cccc21 ZINC001176673550 1052161916 /nfs/dbraw/zinc/16/19/16/1052161916.db2.gz KBQZZAHIFUJWOD-UHFFFAOYSA-N -1 1 336.313 4.173 20 0 EIADMM O=C(Nc1ccc(F)c(F)c1)Nc1cccc(C(F)(F)F)c1[O-] ZINC001185098928 1052167815 /nfs/dbraw/zinc/16/78/15/1052167815.db2.gz BTNTXJRYCVFPCP-UHFFFAOYSA-N -1 1 332.228 4.333 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2ccc(-c3cnco3)cc2)cc1Cl ZINC001185185448 1052189630 /nfs/dbraw/zinc/18/96/30/1052189630.db2.gz LDUOUIPVYXOWPR-UHFFFAOYSA-N -1 1 348.811 4.104 20 0 EIADMM O=S(=O)([N-]c1cc(O)ccc1Cl)c1cc2ccccc2s1 ZINC001185462803 1052245336 /nfs/dbraw/zinc/24/53/36/1052245336.db2.gz OPFHDJLFDAWMPD-UHFFFAOYSA-N -1 1 339.825 4.061 20 0 EIADMM O=C(c1csc(=NC2CC2)[n-]1)N1CCC[C@H]1CCC1CCCCC1 ZINC000622447451 1052280823 /nfs/dbraw/zinc/28/08/23/1052280823.db2.gz INQZWNGTYPWSQU-INIZCTEOSA-N -1 1 347.528 4.104 20 0 EIADMM CCc1ccc(C(=O)N(CC2CC2)c2ccc(OC)cc2)c([O-])c1 ZINC000622646602 1052369582 /nfs/dbraw/zinc/36/95/82/1052369582.db2.gz MDIUEFPFAUUTQM-UHFFFAOYSA-N -1 1 325.408 4.020 20 0 EIADMM Cc1nc(C(F)(F)F)ccc1C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000171881206 1052458223 /nfs/dbraw/zinc/45/82/23/1052458223.db2.gz BMHLVLFPJONNQI-UHFFFAOYSA-N -1 1 330.693 4.020 20 0 EIADMM CCc1onc(C)c1[N-]C(=O)c1csc(-c2c(F)cccc2F)n1 ZINC000179013165 1052718690 /nfs/dbraw/zinc/71/86/90/1052718690.db2.gz OHGYKMBADAHPGO-UHFFFAOYSA-N -1 1 349.362 4.199 20 0 EIADMM O=c1cc(CSc2ccnc3ccccc32)c2ccc([O-])cc2o1 ZINC000109199513 1053095708 /nfs/dbraw/zinc/09/57/08/1053095708.db2.gz FEFIRQKYFXDFEF-UHFFFAOYSA-N -1 1 335.384 4.339 20 0 EIADMM O=c1ccn(-c2ccc(NCc3ccccc3N3CCCCC3)cc2)[n-]1 ZINC000864041937 1053187977 /nfs/dbraw/zinc/18/79/77/1053187977.db2.gz WWMGDLOUGWUJHG-UHFFFAOYSA-N -1 1 348.450 4.180 20 0 EIADMM Cc1ccc(Cl)c(S(=O)(=O)[N-]C(C)(C)/C=C\Cl)c1Cl ZINC001195042851 1053240838 /nfs/dbraw/zinc/24/08/38/1053240838.db2.gz OTIMCUDQKFKEGF-SREVYHEPSA-N -1 1 342.675 4.111 20 0 EIADMM CC(C)=CC[C@@H](NCc1ccc(-c2ccc(Cl)cc2)o1)C(=O)[O-] ZINC000864528231 1053306969 /nfs/dbraw/zinc/30/69/69/1053306969.db2.gz MCLCKPQXOSJDKN-MRXNPFEDSA-N -1 1 333.815 4.499 20 0 EIADMM Cc1cncc2cccc([N-]S(=O)(=O)c3cccc(C(C)C)c3)c12 ZINC001195156846 1053307260 /nfs/dbraw/zinc/30/72/60/1053307260.db2.gz UNOAXMFMBHAQKA-UHFFFAOYSA-N -1 1 340.448 4.467 20 0 EIADMM COc1ccccc1OC(=O)Nc1cc(Cl)c(Cl)cc1[O-] ZINC001195265031 1053350887 /nfs/dbraw/zinc/35/08/87/1053350887.db2.gz POAWLXBYDZLYMF-UHFFFAOYSA-N -1 1 328.151 4.319 20 0 EIADMM CCC[C@H](Cc1ccccc1)N(CCC)C(=O)c1nc(C)ccc1[O-] ZINC001195325416 1053360597 /nfs/dbraw/zinc/36/05/97/1053360597.db2.gz CJLATRUOVLWVSK-GOSISDBHSA-N -1 1 340.467 4.359 20 0 EIADMM COc1ccc(-c2ccccc2NC(=O)c2nc(C)ccc2[O-])cc1 ZINC001195325737 1053361110 /nfs/dbraw/zinc/36/11/10/1053361110.db2.gz HBDRPBMHNXFVRM-UHFFFAOYSA-N -1 1 334.375 4.024 20 0 EIADMM O=C(Nc1cc(C2CCCCC2)ccc1O)c1cc([O-])cnc1Cl ZINC001195306176 1053371443 /nfs/dbraw/zinc/37/14/43/1053371443.db2.gz NVLRPPCOEPGHDB-UHFFFAOYSA-N -1 1 346.814 4.446 20 0 EIADMM Cc1cccc(Cl)c1S(=O)(=O)[N-]c1cc(Cl)ccc1F ZINC001195308457 1053372300 /nfs/dbraw/zinc/37/23/00/1053372300.db2.gz NXGBLQXINFUUOD-UHFFFAOYSA-N -1 1 334.199 4.242 20 0 EIADMM COc1ccc(NC(=S)Nc2cc([O-])c(Cl)cc2F)cc1 ZINC001195703491 1053464397 /nfs/dbraw/zinc/46/43/97/1053464397.db2.gz IZXUJYAEJLYQKV-UHFFFAOYSA-N -1 1 326.780 4.002 20 0 EIADMM Cc1nc(SCc2cncc(C(F)(F)F)c2)[n-]c(=O)c1C1CC1 ZINC000865373118 1053486238 /nfs/dbraw/zinc/48/62/38/1053486238.db2.gz GRHCATGBJKAGMD-UHFFFAOYSA-N -1 1 341.358 4.074 20 0 EIADMM Cc1ccc(CN2CCC(c3ccccc3C(=O)[O-])CC2)c(Cl)n1 ZINC000852728170 1053605674 /nfs/dbraw/zinc/60/56/74/1053605674.db2.gz XYPPPKNXGMQTRO-UHFFFAOYSA-N -1 1 344.842 4.121 20 0 EIADMM O=C(NCc1ccc(OC(F)F)cc1)c1ccc2ccccc2c1[O-] ZINC000011512798 1053614719 /nfs/dbraw/zinc/61/47/19/1053614719.db2.gz WXMQZAJUJFENJX-UHFFFAOYSA-N -1 1 343.329 4.077 20 0 EIADMM CCc1cc2c(CNc3ccc4[nH]ccc4c3)cc(=O)oc2cc1[O-] ZINC000113307311 1053918174 /nfs/dbraw/zinc/91/81/74/1053918174.db2.gz VJIPJPHYVLOSSM-UHFFFAOYSA-N -1 1 334.375 4.154 20 0 EIADMM Cc1ccc(Cl)cc1S(=O)(=O)[N-]c1cccc(Cl)c1C ZINC000031665645 1054071988 /nfs/dbraw/zinc/07/19/88/1054071988.db2.gz LIPFKOWQVXEEFS-UHFFFAOYSA-N -1 1 330.236 4.411 20 0 EIADMM COc1c(C)ccc(F)c1C(=O)Nc1cccc(C(F)(F)F)c1[O-] ZINC001198267997 1054104039 /nfs/dbraw/zinc/10/40/39/1054104039.db2.gz KJXJSTHXZKKHBA-UHFFFAOYSA-N -1 1 343.276 4.119 20 0 EIADMM Clc1ccc([N-]c2nnc(Br)s2)c(Cl)c1 ZINC000081663251 1054128927 /nfs/dbraw/zinc/12/89/27/1054128927.db2.gz SXSHFYRRXFTFBZ-UHFFFAOYSA-N -1 1 325.018 4.351 20 0 EIADMM [O-]c1cc(C(F)(F)F)cc(Cl)c1NC(=S)NC1CCCC1 ZINC001198553860 1054195197 /nfs/dbraw/zinc/19/51/97/1054195197.db2.gz IUDATYJDCBZSGD-UHFFFAOYSA-N -1 1 338.782 4.293 20 0 EIADMM CCCCOc1ccc([N-]S(=O)(=O)c2ccc3occc3c2)cc1 ZINC001198855790 1054279026 /nfs/dbraw/zinc/27/90/26/1054279026.db2.gz KAOKFAJAQBXXDV-UHFFFAOYSA-N -1 1 345.420 4.413 20 0 EIADMM CC(C)c1cc(F)ccc1[N-]S(=O)(=O)c1ccc2occc2c1 ZINC001198858878 1054284811 /nfs/dbraw/zinc/28/48/11/1054284811.db2.gz KDZVTORWIFESNB-UHFFFAOYSA-N -1 1 333.384 4.496 20 0 EIADMM O=C(c1cc([O-])c2ccccc2c1)N1C[C@H]2CCC(=O)c3cccc1c32 ZINC000472520871 1054346504 /nfs/dbraw/zinc/34/65/04/1054346504.db2.gz WHEDAOVFJRQHPU-CQSZACIVSA-N -1 1 343.382 4.266 20 0 EIADMM Cc1cc(C)c(C)c(S(=O)(=O)[N-]c2ccc3scnc3c2)c1C ZINC000060353911 1054675924 /nfs/dbraw/zinc/67/59/24/1054675924.db2.gz KLBBZHDVWFHWLO-UHFFFAOYSA-N -1 1 346.477 4.331 20 0 EIADMM O=C(NCc1ccc([O-])c(Cl)c1)N(Cc1ccc(F)cc1)C1CC1 ZINC000876393192 1054893784 /nfs/dbraw/zinc/89/37/84/1054893784.db2.gz IFWSJUSHMCKYSJ-UHFFFAOYSA-N -1 1 348.805 4.059 20 0 EIADMM [O-]c1c(Cl)cc(Br)cc1Nc1cnn(C(F)F)c1 ZINC001201750752 1054894712 /nfs/dbraw/zinc/89/47/12/1054894712.db2.gz OBRAWEGGJIDSAM-UHFFFAOYSA-N -1 1 338.539 4.143 20 0 EIADMM C[C@@H](CN(C)C(=O)c1cc(Br)ccc1[O-])c1ccccc1 ZINC000066459799 1055004379 /nfs/dbraw/zinc/00/43/79/1055004379.db2.gz PLBNCMSBQRYNLD-LBPRGKRZSA-N -1 1 348.240 4.030 20 0 EIADMM O=C(/C=C\C1CCOCC1)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000862294507 1055047433 /nfs/dbraw/zinc/04/74/33/1055047433.db2.gz LPNODHGKXUKOTK-WAYWQWQTSA-N -1 1 331.799 4.120 20 0 EIADMM CCOc1ccccc1NC(=O)Nc1cccc(C(F)(F)F)c1[O-] ZINC001202151899 1055076347 /nfs/dbraw/zinc/07/63/47/1055076347.db2.gz YDOBOJMICWTLCE-UHFFFAOYSA-N -1 1 340.301 4.454 20 0 EIADMM CCCc1nc(C(=O)[N-]c2nnc(-c3cccc(Cl)c3)s2)co1 ZINC000509506880 1055092108 /nfs/dbraw/zinc/09/21/08/1055092108.db2.gz KFYFZGJMOQLPHZ-UHFFFAOYSA-N -1 1 348.815 4.051 20 0 EIADMM Cc1noc2nc(C(C)C)cc(C(=O)Nc3ccc([O-])c(Cl)c3)c12 ZINC000111665917 1055226448 /nfs/dbraw/zinc/22/64/48/1055226448.db2.gz GKOVTDJNZJPJRA-UHFFFAOYSA-N -1 1 345.786 4.266 20 0 EIADMM C[C@@H](c1cc(Cl)ccc1Cl)N1CCC2(C[C@H]2C(=O)[O-])CC1 ZINC000405363105 1056386429 /nfs/dbraw/zinc/38/64/29/1056386429.db2.gz RDHKOLISWRBMNM-GWCFXTLKSA-N -1 1 328.239 4.241 20 0 EIADMM CC(C)Cn1cc([N-]c2nn3cc(-c4ccccc4)nc3s2)cn1 ZINC000742424691 1058616186 /nfs/dbraw/zinc/61/61/86/1058616186.db2.gz AFGLBPPYRPMSQX-UHFFFAOYSA-N -1 1 338.440 4.054 20 0 EIADMM C[C@H](Sc1ccc(Cl)cc1)C(=O)Nc1c([O-])cccc1F ZINC000743416685 1058989280 /nfs/dbraw/zinc/98/92/80/1058989280.db2.gz RMSPRZAXQLSOCZ-VIFPVBQESA-N -1 1 325.792 4.304 20 0 EIADMM O=C(c1c([O-])cccc1Cl)N1CC[C@@H](CSc2ccccc2)C1 ZINC000743751843 1059105462 /nfs/dbraw/zinc/10/54/62/1059105462.db2.gz CWAWSXAONVAOIN-CYBMUJFWSA-N -1 1 347.867 4.300 20 0 EIADMM Cc1ccc(F)c(C(=O)[N-]c2nnc(C3CCCCC3)s2)c1F ZINC000766320609 1059569371 /nfs/dbraw/zinc/56/93/71/1059569371.db2.gz QFYFILIVVWTWDV-UHFFFAOYSA-N -1 1 337.395 4.425 20 0 EIADMM CCC[C@H](C(=O)OCCc1cc(C(C)=O)ccc1[O-])c1ccccc1 ZINC000744575093 1059587907 /nfs/dbraw/zinc/58/79/07/1059587907.db2.gz YXCBUDKDGJNJMN-IBGZPJMESA-N -1 1 340.419 4.264 20 0 EIADMM O=C([N-]c1nnc(C2CCCCC2)s1)c1coc(C2CCC2)n1 ZINC000766371980 1060320254 /nfs/dbraw/zinc/32/02/54/1060320254.db2.gz AUJAEAISIGYLCY-UHFFFAOYSA-N -1 1 332.429 4.094 20 0 EIADMM O=C(NCc1ccnc2ccccc12)c1ccc2ccccc2c1[O-] ZINC001169020767 1060599412 /nfs/dbraw/zinc/59/94/12/1060599412.db2.gz UAYUIVRWSCBIEO-UHFFFAOYSA-N -1 1 328.371 4.024 20 0 EIADMM O=C(Cc1ccc([O-])c(Cl)c1)N[C@@H]1CCc2ccc(Cl)cc21 ZINC001169299072 1060760726 /nfs/dbraw/zinc/76/07/26/1060760726.db2.gz CUHSFLYIRDLNAN-OAHLLOKOSA-N -1 1 336.218 4.045 20 0 EIADMM O=C(C[C@H](Cc1ccccc1)c1ccccc1)[N-]OCC(F)(F)F ZINC000766762066 1060868965 /nfs/dbraw/zinc/86/89/65/1060868965.db2.gz IIFLLTRPZJPFHJ-INIZCTEOSA-N -1 1 337.341 4.013 20 0 EIADMM CCc1cc(=O)[n-]c(SCc2ccc(Cl)nc2C(F)(F)F)n1 ZINC000767062439 1061094253 /nfs/dbraw/zinc/09/42/53/1061094253.db2.gz JOXBWPASZFIQRC-UHFFFAOYSA-N -1 1 349.765 4.104 20 0 EIADMM O=C(Nc1c([O-])cc(Br)cc1Cl)[C@H]1CCCC12CC2 ZINC000529363317 1032328195 /nfs/dbraw/zinc/32/81/95/1032328195.db2.gz BKBOYIVQFHZPAV-SECBINFHSA-N -1 1 344.636 4.327 20 0 EIADMM C[C@@H]1CC(=O)CC[C@H]1C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000529539435 1032444885 /nfs/dbraw/zinc/44/48/85/1032444885.db2.gz SFHBYBDVDWIKAR-ZYHUDNBSSA-N -1 1 331.799 4.143 20 0 EIADMM CC(C)=CCC[C@@H](C)Nc1ccc(-c2nc(C)c(C)c(=O)[n-]2)cn1 ZINC000450674063 1032647079 /nfs/dbraw/zinc/64/70/79/1032647079.db2.gz MCEMOXNDXNBMHD-CYBMUJFWSA-N -1 1 326.444 4.408 20 0 EIADMM C[C@@H](NCc1cccc([O-])c1Cl)c1nc(-c2ccncc2)cs1 ZINC000339270908 1018726214 /nfs/dbraw/zinc/72/62/14/1018726214.db2.gz IUWRLSVYUIBDQJ-LLVKDONJSA-N -1 1 345.855 4.415 20 0 EIADMM CC[C@H](C)c1nc(C)c(CC(=O)Nc2ccc([O-])c(Cl)c2)c(C)n1 ZINC000654936293 1019030282 /nfs/dbraw/zinc/03/02/82/1019030282.db2.gz VGVBPTMXIQWWIX-JTQLQIEISA-N -1 1 347.846 4.147 20 0 EIADMM O=C([O-])c1cccc(CNCc2ccc(-c3c(F)cccc3F)o2)c1 ZINC000683176394 1019102801 /nfs/dbraw/zinc/10/28/01/1019102801.db2.gz IXYHJOLLPRZGMD-UHFFFAOYSA-N -1 1 343.329 4.213 20 0 EIADMM CCc1cccc(C)c1[N-]S(=O)(=O)c1ccc(F)c(Cl)c1 ZINC000016101233 1020085566 /nfs/dbraw/zinc/08/55/66/1020085566.db2.gz XCQXOEKDPAMPKM-UHFFFAOYSA-N -1 1 327.808 4.151 20 0 EIADMM O=C(Nc1nc(-c2ccc3ccccc3c2)cs1)c1cncc([O-])c1 ZINC000339935444 1020138583 /nfs/dbraw/zinc/13/85/83/1020138583.db2.gz HHBQXGDYYZDJFM-UHFFFAOYSA-N -1 1 347.399 4.316 20 0 EIADMM CC(C)N(CCc1ccccc1)C(=O)Cc1ccc([O-])c(Cl)c1 ZINC001625852760 1020291045 /nfs/dbraw/zinc/29/10/45/1020291045.db2.gz PPGHPPGREKXHDH-UHFFFAOYSA-N -1 1 331.843 4.068 20 0 EIADMM O=c1cc(C(F)(F)F)nc(SCc2cccc3cccnc32)[n-]1 ZINC000109714052 1020302945 /nfs/dbraw/zinc/30/29/45/1020302945.db2.gz ASPKQACNVWEFIE-UHFFFAOYSA-N -1 1 337.326 4.042 20 0 EIADMM [O-]c1ccc(-c2noc([C@@H]3CCc4c3cccc4Cl)n2)cc1F ZINC000683594604 1020951572 /nfs/dbraw/zinc/95/15/72/1020951572.db2.gz ZJCWANFBOLAYJE-GFCCVEGCSA-N -1 1 330.746 4.313 20 0 EIADMM Cc1c(Cl)c(Cl)ccc1Nc1cc(S(C)(=O)=O)ccc1[O-] ZINC001210460754 1021104107 /nfs/dbraw/zinc/10/41/07/1021104107.db2.gz GIDARKFDNLPECS-UHFFFAOYSA-N -1 1 346.235 4.155 20 0 EIADMM C[C@H](O)c1cccc(Nc2ccc(F)c(Br)c2[O-])c1 ZINC001210512771 1021148948 /nfs/dbraw/zinc/14/89/48/1021148948.db2.gz VGMQJFRVVPAHDY-QMMMGPOBSA-N -1 1 326.165 4.091 20 0 EIADMM CC(C)[C@@H]1CN([C@@H](C(=O)[O-])c2cccc(Cl)c2Cl)CCS1 ZINC000580085805 1021627632 /nfs/dbraw/zinc/62/76/32/1021627632.db2.gz UJGQBJBZZLPPMX-GXTWGEPZSA-N -1 1 348.295 4.193 20 0 EIADMM O=C([O-])CCC1CCN(Cc2cc(-c3ccccc3Cl)on2)CC1 ZINC000580084778 1021628441 /nfs/dbraw/zinc/62/84/41/1021628441.db2.gz YULMGKYYUVCKQB-UHFFFAOYSA-N -1 1 348.830 4.072 20 0 EIADMM O=C([O-])[C@H](NCc1ccc(Cl)cc1F)c1ccc(Cl)cc1 ZINC000756332202 1022070625 /nfs/dbraw/zinc/07/06/25/1022070625.db2.gz FUGDCCCDRUEWDC-CQSZACIVSA-N -1 1 328.170 4.048 20 0 EIADMM CCCCc1nc(CSc2nc(C(F)F)cc(=O)[n-]2)cs1 ZINC000580604304 1022291954 /nfs/dbraw/zinc/29/19/54/1022291954.db2.gz DTYWZFZPPCSTIM-UHFFFAOYSA-N -1 1 331.413 4.211 20 0 EIADMM CCN(C(=O)c1ncc2ccccc2c1[O-])[C@@H](C)Cc1ccsc1 ZINC000613701757 1022802480 /nfs/dbraw/zinc/80/24/80/1022802480.db2.gz NLKNVWGMIWUHPW-ZDUSSCGKSA-N -1 1 340.448 4.095 20 0 EIADMM CCSc1cccc(F)c1[N-]S(=O)(=O)c1cc(C)sc1C ZINC000581164581 1022863377 /nfs/dbraw/zinc/86/33/77/1022863377.db2.gz VJIWWMWMWDLNBF-UHFFFAOYSA-N -1 1 345.486 4.417 20 0 EIADMM COc1ccc(S(=O)(=O)[N-]c2cccc(F)c2C)c2ccccc12 ZINC000467078449 1022969031 /nfs/dbraw/zinc/96/90/31/1022969031.db2.gz HQETZYNIEGMZBM-UHFFFAOYSA-N -1 1 345.395 4.097 20 0 EIADMM C[C@@H](c1ccco1)N(C(=O)c1ccc(C(F)(F)F)cc1[O-])C1CC1 ZINC000182020978 1023284785 /nfs/dbraw/zinc/28/47/85/1023284785.db2.gz IEZGRDDMKBFDEC-JTQLQIEISA-N -1 1 339.313 4.370 20 0 EIADMM C[C@@H](Oc1ccc2c(c1)CCC2)c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000580274418 1023341538 /nfs/dbraw/zinc/34/15/38/1023341538.db2.gz IUWPDKICEFXLEE-LLVKDONJSA-N -1 1 340.354 4.210 20 0 EIADMM O=C([O-])[C@@H]1C[C@@H](NCc2cc(Cl)sc2Cl)c2ccccc21 ZINC000417633919 1023382810 /nfs/dbraw/zinc/38/28/10/1023382810.db2.gz VAWWUSXCSOHMGX-VXGBXAGGSA-N -1 1 342.247 4.458 20 0 EIADMM CCSc1ccccc1C(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC000613668220 1023488372 /nfs/dbraw/zinc/48/83/72/1023488372.db2.gz ZYOOGPPOZPWNMM-UHFFFAOYSA-N -1 1 339.420 4.147 20 0 EIADMM Nc1ccc(SCc2cc(=O)oc3cc([O-])ccc23)c(Cl)c1 ZINC000314242662 1023588543 /nfs/dbraw/zinc/58/85/43/1023588543.db2.gz IXWGHJOFVSJFJZ-UHFFFAOYSA-N -1 1 333.796 4.027 20 0 EIADMM Cc1nc(-c2ccc(S(=O)(=O)[N-]c3ccc(Cl)cc3)cc2)co1 ZINC000110095929 1033147565 /nfs/dbraw/zinc/14/75/65/1033147565.db2.gz BAERMRVWFHYXBA-UHFFFAOYSA-N -1 1 348.811 4.104 20 0 EIADMM O=C([O-])CC[C@H]1CCCN(Cc2cc(Cl)ccc2OC(F)F)C1 ZINC000390893753 1023615162 /nfs/dbraw/zinc/61/51/62/1023615162.db2.gz BPNCFIPFTYJBRR-LLVKDONJSA-N -1 1 347.789 4.018 20 0 EIADMM CC[C@@H](C)Oc1ccc([N-]S(=O)(=O)c2cc(C)sc2C)cc1 ZINC000511697422 1023829347 /nfs/dbraw/zinc/82/93/47/1023829347.db2.gz JYWSWWTXRQRLPM-LLVKDONJSA-N -1 1 339.482 4.343 20 0 EIADMM Cc1ccc(C)c(S(=O)(=O)[N-]c2ccc(COC(C)C)cc2)c1 ZINC000511710250 1023835916 /nfs/dbraw/zinc/83/59/16/1023835916.db2.gz LUPMQJYOBCFTBD-UHFFFAOYSA-N -1 1 333.453 4.029 20 0 EIADMM C[C@@H](Nc1ccc(NC(=O)c2cncc([O-])c2)cc1)c1ccccc1 ZINC000109955818 1023848191 /nfs/dbraw/zinc/84/81/91/1023848191.db2.gz ONZGGASIZDVLHE-CQSZACIVSA-N -1 1 333.391 4.213 20 0 EIADMM O=C(NC1(c2ccc(Cl)cc2)CCCC1)c1cc(F)ccc1[O-] ZINC001626241241 1023922311 /nfs/dbraw/zinc/92/23/11/1023922311.db2.gz IGPBBVFPRHVSCD-UHFFFAOYSA-N -1 1 333.790 4.384 20 0 EIADMM CC(C)N(CCC(=O)[O-])Cc1csc(-c2ccc(Cl)cc2)n1 ZINC000652478544 1024847985 /nfs/dbraw/zinc/84/79/85/1024847985.db2.gz JGADJLUJKBBQQR-UHFFFAOYSA-N -1 1 338.860 4.149 20 0 EIADMM CCc1ccc(-c2nc(CN(C[C@H](C)C(=O)[O-])C3CC3)cs2)cc1 ZINC000652489445 1024855711 /nfs/dbraw/zinc/85/57/11/1024855711.db2.gz PQMUQIGXEBWXPU-ZDUSSCGKSA-N -1 1 344.480 4.058 20 0 EIADMM O=S(=O)([N-]c1cc(Cl)ccc1F)c1ccc(Cl)cc1F ZINC000007403705 1025396915 /nfs/dbraw/zinc/39/69/15/1025396915.db2.gz GPRVGQRDRAAMNJ-UHFFFAOYSA-N -1 1 338.162 4.072 20 0 EIADMM O=C([N-]c1nc(-c2ccccc2Cl)ns1)c1ccc(Cl)o1 ZINC000110382053 1033290905 /nfs/dbraw/zinc/29/09/05/1033290905.db2.gz SZRVBZDMNSMWIK-UHFFFAOYSA-N -1 1 340.191 4.357 20 0 EIADMM O=C(NCCCCOCc1ccccc1)c1ccc2ccccc2c1[O-] ZINC000390817944 1025534465 /nfs/dbraw/zinc/53/44/65/1025534465.db2.gz PPAJNCDCZMCGEZ-UHFFFAOYSA-N -1 1 349.430 4.272 20 0 EIADMM O=C(Nc1nc(-c2cccnc2)cs1)c1cc2ccccc2cc1[O-] ZINC000006969230 1025803599 /nfs/dbraw/zinc/80/35/99/1025803599.db2.gz PHGSOCQLLNETBI-UHFFFAOYSA-N -1 1 347.399 4.316 20 0 EIADMM Cn1c2ccccc2nc1-c1ccc(NC(=O)c2ccccc2[O-])cc1 ZINC000110583809 1026002483 /nfs/dbraw/zinc/00/24/83/1026002483.db2.gz QGTZNUWOHXSYOM-UHFFFAOYSA-N -1 1 343.386 4.198 20 0 EIADMM Cc1sc2[n-]c(-c3nccc(C)n3)nc(=O)c2c1-c1ccccc1 ZINC000432510563 1026239132 /nfs/dbraw/zinc/23/91/32/1026239132.db2.gz QZBRQZDRTKJTBR-UHFFFAOYSA-N -1 1 334.404 4.138 20 0 EIADMM O=C(CCSc1ccccc1F)Nc1ccc([O-])c(Cl)c1 ZINC000111667049 1026315425 /nfs/dbraw/zinc/31/54/25/1026315425.db2.gz GLDWOSLOXGUZGE-UHFFFAOYSA-N -1 1 325.792 4.306 20 0 EIADMM O=C([O-])C[C@@H](NCc1ccc(-c2ccccc2F)o1)c1ccsc1 ZINC000426683415 1026473481 /nfs/dbraw/zinc/47/34/81/1026473481.db2.gz RWBKAPMEYGQEKW-MRXNPFEDSA-N -1 1 345.395 4.453 20 0 EIADMM O=C([O-])c1ccc(CNCc2ccc(-c3ccccc3)cc2F)cc1 ZINC000426714551 1026496992 /nfs/dbraw/zinc/49/69/92/1026496992.db2.gz MYTBGNKADLDXOS-UHFFFAOYSA-N -1 1 335.378 4.481 20 0 EIADMM COc1ccc(-c2ccccc2)cc1CNCc1ccc(C(=O)[O-])cc1 ZINC000426708605 1026506923 /nfs/dbraw/zinc/50/69/23/1026506923.db2.gz LFEXNCDNRYPPGJ-UHFFFAOYSA-N -1 1 347.414 4.350 20 0 EIADMM O=C([O-])c1coc(CNCc2ccc(Sc3ccccc3)cc2)c1 ZINC000426708962 1026507616 /nfs/dbraw/zinc/50/76/16/1026507616.db2.gz OYQZFVJLKMLOMF-UHFFFAOYSA-N -1 1 339.416 4.419 20 0 EIADMM Cc1ccc([C@@H](CC(=O)[O-])NCc2ccc(C(F)(F)F)cc2C)o1 ZINC000426776752 1026552333 /nfs/dbraw/zinc/55/23/33/1026552333.db2.gz HLOXHAUTESUHSS-CQSZACIVSA-N -1 1 341.329 4.221 20 0 EIADMM CCCSC[C@@H](NCc1cc(-c2ccccc2)cs1)C(=O)[O-] ZINC000426767033 1026558671 /nfs/dbraw/zinc/55/86/71/1026558671.db2.gz JPMZXRCLVJQBAB-MRXNPFEDSA-N -1 1 335.494 4.101 20 0 EIADMM Cc1ccc([C@H](CC(=O)[O-])NCc2ccc(F)c(C(F)(F)F)c2)o1 ZINC000426765343 1026559079 /nfs/dbraw/zinc/55/90/79/1026559079.db2.gz MSHPZEUQXCWDIA-ZDUSSCGKSA-N -1 1 345.292 4.052 20 0 EIADMM O=C([O-])[C@@H](NCc1cccc(OC2CCCC2)c1)c1ccccc1F ZINC000426766552 1026560395 /nfs/dbraw/zinc/56/03/95/1026560395.db2.gz FNANLBRLIKAQKJ-IBGZPJMESA-N -1 1 343.398 4.063 20 0 EIADMM CC(C)(C)c1ncc(CN[C@H](CCCc2ccccc2)C(=O)[O-])s1 ZINC000426795893 1026566649 /nfs/dbraw/zinc/56/66/49/1026566649.db2.gz ZDQPDVHDCLLRKD-MRXNPFEDSA-N -1 1 346.496 4.006 20 0 EIADMM O=C([O-])C[C@H](NCc1ccc(F)cc1Cl)c1cccc(Cl)c1 ZINC000426821656 1026578368 /nfs/dbraw/zinc/57/83/68/1026578368.db2.gz VRZAVRUFVOLEEI-HNNXBMFYSA-N -1 1 342.197 4.438 20 0 EIADMM CN(Cc1cccc([O-])c1Cl)Cc1ccccc1N1CCCC1 ZINC000507034634 1026598044 /nfs/dbraw/zinc/59/80/44/1026598044.db2.gz CZMKZEWZYZXWEB-UHFFFAOYSA-N -1 1 330.859 4.278 20 0 EIADMM C[C@H]1CCCN(Cc2csc(-c3cccc(C(=O)[O-])c3)n2)[C@H]1C ZINC000582425796 1026624122 /nfs/dbraw/zinc/62/41/22/1026624122.db2.gz NXCYXBWQKUGMCF-STQMWFEESA-N -1 1 330.453 4.129 20 0 EIADMM CC(C)c1cnc(NC(=O)c2ccc(C(F)(F)F)c([O-])c2)s1 ZINC000684875003 1026648726 /nfs/dbraw/zinc/64/87/26/1026648726.db2.gz AXYGUXISIJAROK-UHFFFAOYSA-N -1 1 330.331 4.243 20 0 EIADMM [O-]c1ccc(-c2noc(-c3ccc(Oc4ccccc4)cn3)n2)c(F)c1 ZINC000582452524 1026654263 /nfs/dbraw/zinc/65/42/63/1026654263.db2.gz NXMXFLJYLRILOY-UHFFFAOYSA-N -1 1 349.321 4.436 20 0 EIADMM COC(=O)c1c[n-]c(S[C@H](Cc2ccccc2)c2ccccc2)n1 ZINC000432666163 1026698894 /nfs/dbraw/zinc/69/88/94/1026698894.db2.gz REXQENBKJFNMJF-QGZVFWFLSA-N -1 1 338.432 4.272 20 0 EIADMM COc1c(Br)cc(F)cc1Nc1cc(F)c([O-])c(F)c1 ZINC001211712373 1026726962 /nfs/dbraw/zinc/72/69/62/1026726962.db2.gz DUTIHQZMGATECI-UHFFFAOYSA-N -1 1 348.118 4.324 20 0 EIADMM COc1ccccc1[C@@H]1CCN(C(=O)c2cc3ccccc3cc2[O-])C1 ZINC000153009247 1026942004 /nfs/dbraw/zinc/94/20/04/1026942004.db2.gz PCDHQNNUHYPQLD-QGZVFWFLSA-N -1 1 347.414 4.184 20 0 EIADMM O=C(Nc1c([O-])cc(Br)cc1Cl)[C@H]1CC=CCC1 ZINC000519723700 1026960233 /nfs/dbraw/zinc/96/02/33/1026960233.db2.gz DWMVULOVTIZMRP-QMMMGPOBSA-N -1 1 330.609 4.103 20 0 EIADMM CCc1cc(=O)[n-]c(S[C@@H](C)c2ccc(OC(F)(F)F)cc2)n1 ZINC000188090145 1027075200 /nfs/dbraw/zinc/07/52/00/1027075200.db2.gz VRRZWLTWDNLJNT-VIFPVBQESA-N -1 1 344.358 4.084 20 0 EIADMM O=C([O-])[C@@H](CCN(Cc1c(F)cccc1F)C1CC1)c1ccccc1 ZINC000582910095 1027653715 /nfs/dbraw/zinc/65/37/15/1027653715.db2.gz AOIWPKYYYPUZIU-INIZCTEOSA-N -1 1 345.389 4.188 20 0 EIADMM O=C([O-])CC[C@H]1CCCN(Cc2coc(-c3ccc(Cl)cc3)n2)C1 ZINC000261614589 1027683992 /nfs/dbraw/zinc/68/39/92/1027683992.db2.gz BLXCLVWISFCTJJ-CYBMUJFWSA-N -1 1 348.830 4.072 20 0 EIADMM CC(C)c1ccc(C[C@H](C)NC(=O)c2c(F)ccc([O-])c2F)cc1 ZINC000582931729 1027712043 /nfs/dbraw/zinc/71/20/43/1027712043.db2.gz BXZNTXHZWQYKEV-LBPRGKRZSA-N -1 1 333.378 4.155 20 0 EIADMM O=C(c1ccc([O-])cc1F)N1C[C@H](c2ccccc2)c2ccccc21 ZINC000444514143 1027854163 /nfs/dbraw/zinc/85/41/63/1027854163.db2.gz IMZIHCDLTORZCR-GOSISDBHSA-N -1 1 333.362 4.324 20 0 EIADMM O=C(c1cc(F)ccc1[O-])N1C[C@@H](c2ccccc2)c2ccccc21 ZINC000444509727 1027859999 /nfs/dbraw/zinc/85/99/99/1027859999.db2.gz CUOHNILADYMQGN-SFHVURJKSA-N -1 1 333.362 4.324 20 0 EIADMM Cc1ncc(-c2ccc([N-]S(=O)(=O)c3cc(C)ccc3C)cc2)o1 ZINC000029433196 1028198375 /nfs/dbraw/zinc/19/83/75/1028198375.db2.gz QWQYTIPCSSXCPF-UHFFFAOYSA-N -1 1 342.420 4.068 20 0 EIADMM Cc1ncc(-c2ccc([N-]S(=O)(=O)c3ccc(C)cc3C)cc2)o1 ZINC000029433201 1028198538 /nfs/dbraw/zinc/19/85/38/1028198538.db2.gz ILMRFSZIWSSHCZ-UHFFFAOYSA-N -1 1 342.420 4.068 20 0 EIADMM CCOc1cc(-c2noc([C@H]3CC[C@@H](CC)O3)n2)cc(Cl)c1[O-] ZINC000278144464 1028296818 /nfs/dbraw/zinc/29/68/18/1028296818.db2.gz UAWPDDKZELZLPY-ZYHUDNBSSA-N -1 1 338.791 4.124 20 0 EIADMM Cc1cscc1[N-]S(=O)(=O)c1ccc(OC2CCCC2)cc1 ZINC000161609323 1028319700 /nfs/dbraw/zinc/31/97/00/1028319700.db2.gz IKKACQPBHIQKBX-UHFFFAOYSA-N -1 1 337.466 4.179 20 0 EIADMM O=C(Nc1ccc(COCc2ccccc2)cc1)c1ccc(O)cc1[O-] ZINC000150866343 1028399097 /nfs/dbraw/zinc/39/90/97/1028399097.db2.gz GXGUWABBVFPINM-UHFFFAOYSA-N -1 1 349.386 4.067 20 0 EIADMM O=S(=O)([N-]c1cccc2c1CCCC2)c1ccc(C(F)F)cc1 ZINC000583284385 1028413268 /nfs/dbraw/zinc/41/32/68/1028413268.db2.gz BTDJZFGDSFDXIN-UHFFFAOYSA-N -1 1 337.391 4.304 20 0 EIADMM COc1cc(C(=O)N(C)C/C(C)=C\c2ccccc2)cc(Cl)c1[O-] ZINC000427555127 1028453966 /nfs/dbraw/zinc/45/39/66/1028453966.db2.gz JGIJZBQFPHLWNC-LCYFTJDESA-N -1 1 345.826 4.230 20 0 EIADMM CC(C)[C@H]1C[C@H]1C(=O)Nc1c([O-])cc(Br)cc1Cl ZINC000565025045 1028478389 /nfs/dbraw/zinc/47/83/89/1028478389.db2.gz PBQLHYSOPAVMOW-RKDXNWHRSA-N -1 1 332.625 4.039 20 0 EIADMM CCOc1cc(-c2noc(-c3c(C)noc3CC)n2)cc(Cl)c1[O-] ZINC000445412058 1028509041 /nfs/dbraw/zinc/50/90/41/1028509041.db2.gz MABBAZDSYKBJRN-UHFFFAOYSA-N -1 1 349.774 4.020 20 0 EIADMM CCOc1cc(-c2noc(CC[C@@H](C)SC)n2)cc(Cl)c1[O-] ZINC000445429856 1028527457 /nfs/dbraw/zinc/52/74/57/1028527457.db2.gz GLZMUBSBQRQMDY-SECBINFHSA-N -1 1 342.848 4.178 20 0 EIADMM [O-]c1ccc(-c2noc(-c3ccc(C(F)(F)F)cn3)n2)c(Cl)c1 ZINC000445448743 1028537883 /nfs/dbraw/zinc/53/78/83/1028537883.db2.gz MDZGTWLQENBOKI-UHFFFAOYSA-N -1 1 341.676 4.176 20 0 EIADMM [O-]c1ccc(-c2noc(CCSc3ccccc3)n2)c(Cl)c1 ZINC000445449891 1028538816 /nfs/dbraw/zinc/53/88/16/1028538816.db2.gz WLOIDFDEWFHZGR-UHFFFAOYSA-N -1 1 332.812 4.430 20 0 EIADMM [O-]c1ccc(-c2noc([C@@H]3Cc4ccccc4S3)n2)c(Cl)c1 ZINC000445449764 1028538973 /nfs/dbraw/zinc/53/89/73/1028538973.db2.gz PHZZEAQYWWCEJR-AWEZNQCLSA-N -1 1 330.796 4.485 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cc(-c4ccccc4)on3)n2)c(Cl)c1 ZINC000445451011 1028543493 /nfs/dbraw/zinc/54/34/93/1028543493.db2.gz ZMIYWMCJLZQCHM-UHFFFAOYSA-N -1 1 339.738 4.418 20 0 EIADMM COc1ccc(CCCc2nc(-c3ccc([O-])cc3Cl)no2)cc1 ZINC000445443384 1028569686 /nfs/dbraw/zinc/56/96/86/1028569686.db2.gz CCEXLSJVIDPBBU-UHFFFAOYSA-N -1 1 344.798 4.280 20 0 EIADMM C[C@@H](Oc1ccccc1F)c1nc(-c2ccc([O-])cc2Cl)no1 ZINC000445445716 1028575414 /nfs/dbraw/zinc/57/54/14/1028575414.db2.gz KAWIUSBPWZVPTB-SECBINFHSA-N -1 1 334.734 4.375 20 0 EIADMM CCOc1ccc(-c2nc(-c3ccc([O-])cc3F)no2)cc1OCC ZINC000445453662 1028603625 /nfs/dbraw/zinc/60/36/25/1028603625.db2.gz IXCTXOVHVYWXBG-UHFFFAOYSA-N -1 1 344.342 4.046 20 0 EIADMM COc1cc(-c2nc(-c3ccc([O-])cc3F)no2)ccc1OC(C)C ZINC000445454449 1028607190 /nfs/dbraw/zinc/60/71/90/1028607190.db2.gz KXWFPOUWQNICLK-UHFFFAOYSA-N -1 1 344.342 4.044 20 0 EIADMM C[C@@H](CCOc1ccccc1)c1nc(-c2ccc([O-])cc2F)no1 ZINC000445457580 1028613877 /nfs/dbraw/zinc/61/38/77/1028613877.db2.gz TUIRYVLJIZFTLW-LBPRGKRZSA-N -1 1 328.343 4.154 20 0 EIADMM CC(C)OCc1ccc(-c2nc(-c3ccc([O-])c(F)c3)no2)cc1 ZINC000445477940 1028623510 /nfs/dbraw/zinc/62/35/10/1028623510.db2.gz FHFWYYIALZOIBN-UHFFFAOYSA-N -1 1 328.343 4.173 20 0 EIADMM Cn1cc(/C=C/c2nc(-c3ccc([O-])c(F)c3)no2)c2ccccc21 ZINC000445481756 1028627472 /nfs/dbraw/zinc/62/74/72/1028627472.db2.gz QGLZFYYEBZIWEZ-VQHVLOKHSA-N -1 1 335.338 4.243 20 0 EIADMM [O-]c1ccc(-c2noc(-c3csc(-c4cccs4)n3)n2)cc1F ZINC000445481299 1028629827 /nfs/dbraw/zinc/62/98/27/1028629827.db2.gz MRUWNCWLIIJGGH-UHFFFAOYSA-N -1 1 345.380 4.433 20 0 EIADMM Cc1cccc([N-]S(=O)(=O)c2ccc(Cl)cc2F)c1Cl ZINC000524794172 1029224974 /nfs/dbraw/zinc/22/49/74/1029224974.db2.gz KPXYDZZHSSNXLL-UHFFFAOYSA-N -1 1 334.199 4.242 20 0 EIADMM O=C([N-]c1nc2c(s1)CCCCCC2)c1ocnc1C(F)(F)F ZINC000635412186 1029534319 /nfs/dbraw/zinc/53/43/19/1029534319.db2.gz IEANEKUJERLIOG-UHFFFAOYSA-N -1 1 345.346 4.061 20 0 EIADMM Cc1nc(-c2ccc(NCC[C@H](C)c3ccccc3)nc2)[n-]c(=O)c1C ZINC000301420376 1029730938 /nfs/dbraw/zinc/73/09/38/1029730938.db2.gz SBTBYJPAHAXSHZ-AWEZNQCLSA-N -1 1 348.450 4.467 20 0 EIADMM C[C@@H](N(C)Cc1csc(-c2ccc(C(=O)[O-])cc2)n1)C1(C)CC1 ZINC000584356564 1029753085 /nfs/dbraw/zinc/75/30/85/1029753085.db2.gz SWNQEERKZMTOJE-GFCCVEGCSA-N -1 1 330.453 4.129 20 0 EIADMM Cc1nc(-c2ccc(N[C@@H]3CC[C@@H]4CCC[C@@H]4C3)nc2)[n-]c(=O)c1C ZINC000525706933 1029942964 /nfs/dbraw/zinc/94/29/64/1029942964.db2.gz LTRFLBKLPXPZGF-ZMSDIMECSA-N -1 1 338.455 4.242 20 0 EIADMM COc1cc(C(=O)N[C@@H](C)CC2CCCCC2)cc(Cl)c1[O-] ZINC000447313187 1029985189 /nfs/dbraw/zinc/98/51/89/1029985189.db2.gz ANCBVDXMCDSIHS-NSHDSACASA-N -1 1 325.836 4.143 20 0 EIADMM CC(C)(C)c1csc(CSc2nc(C(F)(F)F)cc(=O)[n-]2)n1 ZINC000447348245 1030027174 /nfs/dbraw/zinc/02/71/74/1030027174.db2.gz QZPQJFANLFAITQ-UHFFFAOYSA-N -1 1 349.403 4.247 20 0 EIADMM Cc1cc(C(=O)Nc2cccc(F)c2[O-])ccc1NC(=O)CC(C)C ZINC000530005598 1030049351 /nfs/dbraw/zinc/04/93/51/1030049351.db2.gz MUBBCJZXZNFZBJ-UHFFFAOYSA-N -1 1 344.386 4.077 20 0 EIADMM Cc1ccc(C)c([N-]S(=O)(=O)c2ccc(F)c(C(F)(F)F)c2)c1 ZINC000063911139 1030137995 /nfs/dbraw/zinc/13/79/95/1030137995.db2.gz RFHWVZSGUMAKFG-UHFFFAOYSA-N -1 1 347.333 4.262 20 0 EIADMM O=C(Nc1c([O-])c(Cl)cc(Cl)c1Cl)c1cn[nH]c1C1CC1 ZINC000187387764 1030357645 /nfs/dbraw/zinc/35/76/45/1030357645.db2.gz NLYPFTJDKIQGCJ-UHFFFAOYSA-N -1 1 346.601 4.205 20 0 EIADMM C[C@H](NC(=O)c1c(F)ccc([O-])c1F)c1ccc(C(F)(F)F)cc1 ZINC000685481943 1030359983 /nfs/dbraw/zinc/35/99/83/1030359983.db2.gz MTTAEAUJAVBADL-QMMMGPOBSA-N -1 1 345.267 4.180 20 0 EIADMM CC[C@@H](CN(CC)C(=O)c1c(F)ccc([O-])c1F)c1ccccc1 ZINC000685473043 1030363250 /nfs/dbraw/zinc/36/32/50/1030363250.db2.gz DQVIYEHNZRKIFA-ZDUSSCGKSA-N -1 1 333.378 4.326 20 0 EIADMM CCSc1cccc([N-]S(=O)(=O)c2cccc(C(=O)CC)c2)c1 ZINC000448129637 1030593372 /nfs/dbraw/zinc/59/33/72/1030593372.db2.gz OFLWUQVBGMJXHL-UHFFFAOYSA-N -1 1 349.477 4.192 20 0 EIADMM CC(C)c1ccccc1S(=O)(=O)[N-]c1cccc2ccncc21 ZINC000527287425 1030612727 /nfs/dbraw/zinc/61/27/27/1030612727.db2.gz HRRUNRAALUHTRU-UHFFFAOYSA-N -1 1 326.421 4.159 20 0 EIADMM O=C(c1cccc([O-])c1F)N1CCC(c2cccc(Cl)c2)CC1 ZINC001625962860 1030780339 /nfs/dbraw/zinc/78/03/39/1030780339.db2.gz RDYSFJRJNKPVRS-UHFFFAOYSA-N -1 1 333.790 4.205 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2c(C)c(C)c(C)c(C)c2C)c(C)n1 ZINC000531037598 1030838088 /nfs/dbraw/zinc/83/80/88/1030838088.db2.gz WMQPPRJPAGHPBO-UHFFFAOYSA-N -1 1 332.469 4.041 20 0 EIADMM CC[C@@H](CNC(=O)c1ccc(C(F)(F)F)c([O-])c1)CC(F)(F)F ZINC000665998219 1031149348 /nfs/dbraw/zinc/14/93/48/1031149348.db2.gz DUJPDJHNDZFHFQ-MRVPVSSYSA-N -1 1 343.267 4.119 20 0 EIADMM O=C(CCCCc1nc2ccccc2s1)Nc1ccc(F)cc1[O-] ZINC000531755610 1031531643 /nfs/dbraw/zinc/53/16/43/1031531643.db2.gz JRFVIUNWOMMDSM-UHFFFAOYSA-N -1 1 344.411 4.493 20 0 EIADMM O=C(CCCc1ncc(-c2ccccc2)o1)Nc1ccc(F)cc1[O-] ZINC000531756059 1031537358 /nfs/dbraw/zinc/53/73/58/1031537358.db2.gz UPPKJHNGHWLKOP-UHFFFAOYSA-N -1 1 340.354 4.148 20 0 EIADMM CC(C)c1cccc(S(=O)(=O)[N-]c2cccc3ccncc32)c1 ZINC000531781768 1031599182 /nfs/dbraw/zinc/59/91/82/1031599182.db2.gz WSITVSFWMSWNQR-UHFFFAOYSA-N -1 1 326.421 4.159 20 0 EIADMM CC(C)C1([N-]S(=O)(=O)c2sc3ccccc3c2Cl)CC1 ZINC001211940659 1031857633 /nfs/dbraw/zinc/85/76/33/1031857633.db2.gz NYLCJTGVUKKTPT-UHFFFAOYSA-N -1 1 329.874 4.022 20 0 EIADMM O=C(Nc1ccc(F)cc1[O-])c1cc(Br)ccc1Cl ZINC000532012996 1031974775 /nfs/dbraw/zinc/97/47/75/1031974775.db2.gz XSRXJMLFOAKWEC-UHFFFAOYSA-N -1 1 344.567 4.200 20 0 EIADMM CCOc1ccc([N-]S(=O)(=O)c2cccc(Cl)c2)cc1Cl ZINC000614840588 1032012357 /nfs/dbraw/zinc/01/23/57/1032012357.db2.gz PBAQISIMEAEZJI-UHFFFAOYSA-N -1 1 346.235 4.193 20 0 EIADMM COc1ccc(-c2cc3[n-]c(-c4ccccc4)nc(=O)c3s2)cc1 ZINC000614113725 1033396656 /nfs/dbraw/zinc/39/66/56/1033396656.db2.gz NKMXRQATZYTECU-UHFFFAOYSA-N -1 1 334.400 4.327 20 0 EIADMM Cc1c(F)ccc(Cl)c1[N-]S(=O)(=O)c1ccc(Cl)s1 ZINC000433125452 1033894945 /nfs/dbraw/zinc/89/49/45/1033894945.db2.gz KGYSBDZVJVQPSA-UHFFFAOYSA-N -1 1 340.228 4.303 20 0 EIADMM Cc1cccc(F)c1S(=O)(=O)[N-]c1c(C)c(F)ccc1Cl ZINC000433171284 1033975039 /nfs/dbraw/zinc/97/50/39/1033975039.db2.gz CZLKLSIQBDSQEB-UHFFFAOYSA-N -1 1 331.771 4.036 20 0 EIADMM CCc1cccc(S(=O)(=O)[N-]c2ccc3oc(C4CC4)nc3c2)c1 ZINC000433510745 1034591080 /nfs/dbraw/zinc/59/10/80/1034591080.db2.gz HLVHDOPXKHJXMQ-UHFFFAOYSA-N -1 1 342.420 4.068 20 0 EIADMM CCOC(=O)c1cnc(C(C)=Cc2cccc(C(C)C)c2)[n-]c1=O ZINC000596011126 1035810992 /nfs/dbraw/zinc/81/09/92/1035810992.db2.gz DEAHCOGKAXIOCO-LCYFTJDESA-N -1 1 326.396 4.043 20 0 EIADMM C[C@H](N(C)Cc1csc(-c2cccc(C(=O)[O-])c2)n1)C(C)(C)C ZINC000568890538 1035820922 /nfs/dbraw/zinc/82/09/22/1035820922.db2.gz KYUKLLNDAXAHHQ-LBPRGKRZSA-N -1 1 332.469 4.375 20 0 EIADMM COc1ccc([C@@H](NCc2ccc(/C=C/C(=O)[O-])o2)C2CCC2)cc1 ZINC000905747481 1035873348 /nfs/dbraw/zinc/87/33/48/1035873348.db2.gz AYAMCXYQKALISW-SGWGQVFISA-N -1 1 341.407 4.017 20 0 EIADMM COc1ccc([C@H](NCc2ccc(/C=C/C(=O)[O-])o2)C2CCC2)cc1 ZINC000905747482 1035873716 /nfs/dbraw/zinc/87/37/16/1035873716.db2.gz AYAMCXYQKALISW-YVNCXZRQSA-N -1 1 341.407 4.017 20 0 EIADMM CCC(=O)c1cccc(S(=O)(=O)[N-]c2cccc3ccccc32)c1 ZINC000195654093 1035877758 /nfs/dbraw/zinc/87/77/58/1035877758.db2.gz KLRZPIRGUGYDRZ-UHFFFAOYSA-N -1 1 339.416 4.233 20 0 EIADMM O=C1c2ccc([O-])cc2CC/C1=C\c1cccc(Br)c1 ZINC000060340073 1036032993 /nfs/dbraw/zinc/03/29/93/1036032993.db2.gz WCZFHUHOUZFVFX-MDWZMJQESA-N -1 1 329.193 4.367 20 0 EIADMM CCN(CC[C@@H](C(=O)[O-])c1ccccc1)Cc1c(F)cccc1F ZINC000571453250 1036050393 /nfs/dbraw/zinc/05/03/93/1036050393.db2.gz PAWLFQFAGKAPGW-OAHLLOKOSA-N -1 1 333.378 4.045 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1ccc(OC2CCCC2)nc1 ZINC000513743802 1036203047 /nfs/dbraw/zinc/20/30/47/1036203047.db2.gz BVZBMAWBFUXEIZ-UHFFFAOYSA-N -1 1 332.787 4.014 20 0 EIADMM Cc1onc(-c2cccc(F)c2)c1C(=O)[N-]c1nnc(C(C)C)s1 ZINC000906370518 1036247124 /nfs/dbraw/zinc/24/71/24/1036247124.db2.gz OZCVJZJIBKQIIV-UHFFFAOYSA-N -1 1 346.387 4.016 20 0 EIADMM O=S(=O)([N-]c1ccc(F)cc1)c1ccccc1-c1ccccc1 ZINC000485796189 1036264303 /nfs/dbraw/zinc/26/43/03/1036264303.db2.gz VFXVZOCPUNJMHT-UHFFFAOYSA-N -1 1 327.380 4.294 20 0 EIADMM Cc1ccccc1Nc1nc(CN(CCC(=O)[O-])CC(C)C)cs1 ZINC000571887498 1036266655 /nfs/dbraw/zinc/26/66/55/1036266655.db2.gz AZRAKQBRKMEQDH-UHFFFAOYSA-N -1 1 347.484 4.128 20 0 EIADMM Cc1cc(CN2CCC([C@H](F)c3ccccc3F)CC2)oc1C(=O)[O-] ZINC000572016971 1036393472 /nfs/dbraw/zinc/39/34/72/1036393472.db2.gz PSLDUPGCDNTZIO-KRWDZBQOSA-N -1 1 349.377 4.348 20 0 EIADMM O=C(c1ccc([N-]S(=O)(=O)c2cccc(Cl)c2)cc1)C1CCC1 ZINC000486097519 1036481581 /nfs/dbraw/zinc/48/15/81/1036481581.db2.gz FXBPAZRGUSSEJU-UHFFFAOYSA-N -1 1 349.839 4.124 20 0 EIADMM CC(C)c1cccc(S(=O)(=O)[N-]c2cccc(-c3cn[nH]c3)c2)c1 ZINC000761288516 1036791278 /nfs/dbraw/zinc/79/12/78/1036791278.db2.gz OSZYDOYSIDOMCG-UHFFFAOYSA-N -1 1 341.436 4.001 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1CCC[C@@H](CC(F)(F)F)C1 ZINC000421933916 1036852737 /nfs/dbraw/zinc/85/27/37/1036852737.db2.gz BDGCRSPPZQSPJP-LBPRGKRZSA-N -1 1 337.341 4.350 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)Nc1ccccc1OCC1CC1 ZINC000486934913 1036895856 /nfs/dbraw/zinc/89/58/56/1036895856.db2.gz KRXTVTFZBVDOJO-UHFFFAOYSA-N -1 1 332.787 4.478 20 0 EIADMM O=C(Nc1cccc([O-])c1Br)[C@H]1CCCC[C@H]1C1CC1 ZINC000908706386 1036919906 /nfs/dbraw/zinc/91/99/06/1036919906.db2.gz AJWKQGXHYHBTGO-RYUDHWBXSA-N -1 1 338.245 4.310 20 0 EIADMM O=C(Nc1cccc([O-])c1Br)C1CC2(C1)CCCCC2 ZINC000908710603 1036920174 /nfs/dbraw/zinc/92/01/74/1036920174.db2.gz LHXGHALSIWMUFR-UHFFFAOYSA-N -1 1 338.245 4.454 20 0 EIADMM C[Si](C)(C)CCCC(=O)Nc1cccc([O-])c1Br ZINC000908706491 1036920729 /nfs/dbraw/zinc/92/07/29/1036920729.db2.gz CIBJTTBSCUPVQT-UHFFFAOYSA-N -1 1 330.298 4.212 20 0 EIADMM O=C(Nc1cccc([O-])c1Br)C1CCC(C2CC2)CC1 ZINC000908710955 1036921074 /nfs/dbraw/zinc/92/10/74/1036921074.db2.gz NESBUTZTWSSMPV-UHFFFAOYSA-N -1 1 338.245 4.310 20 0 EIADMM COc1ccc2c(c1NC(=O)Nc1ccc([O-])c(Cl)c1)CCC2 ZINC000487078466 1036982359 /nfs/dbraw/zinc/98/23/59/1036982359.db2.gz YRRROPSDUYYUCB-UHFFFAOYSA-N -1 1 332.787 4.187 20 0 EIADMM CCc1ccccc1S(=O)(=O)[N-]c1cccc(-c2ncc(C)o2)c1 ZINC000488298375 1037493146 /nfs/dbraw/zinc/49/31/46/1037493146.db2.gz PGVUUVXAMNOAQN-UHFFFAOYSA-N -1 1 342.420 4.013 20 0 EIADMM O=C(Nc1c([O-])cccc1F)c1ccc(Br)cc1Cl ZINC000605436984 1037787298 /nfs/dbraw/zinc/78/72/98/1037787298.db2.gz NTUMFHAXQNULBT-UHFFFAOYSA-N -1 1 344.567 4.200 20 0 EIADMM CCCOc1ccc(C(=O)Nc2c([O-])cccc2F)cc1OCCC ZINC000605440683 1037790630 /nfs/dbraw/zinc/79/06/30/1037790630.db2.gz YNCVTHFOADZLBU-UHFFFAOYSA-N -1 1 347.386 4.361 20 0 EIADMM Cc1ccc([C@H](C)NC(=O)c2ccc(Br)c([O-])c2)s1 ZINC000231328728 1038227539 /nfs/dbraw/zinc/22/75/39/1038227539.db2.gz QXZHIXIXLVMHDD-VIFPVBQESA-N -1 1 340.242 4.016 20 0 EIADMM O=S(=O)([N-]c1ccccc1C(F)F)c1ccc2c(c1)CCCC2 ZINC000424070113 1038458781 /nfs/dbraw/zinc/45/87/81/1038458781.db2.gz RJVHWABRGHQNLU-UHFFFAOYSA-N -1 1 337.391 4.304 20 0 EIADMM C[C@H](Oc1cccc(Cl)c1Cl)C(=O)Nc1ccc(F)cc1[O-] ZINC000533971730 1038740417 /nfs/dbraw/zinc/74/04/17/1038740417.db2.gz ZYKQVCXUSGPZMF-QMMMGPOBSA-N -1 1 344.169 4.244 20 0 EIADMM O=C(Nc1c([O-])cccc1F)c1cccc(Oc2nccs2)c1 ZINC000608365558 1038804084 /nfs/dbraw/zinc/80/40/84/1038804084.db2.gz MZYYDOFGSLOGOO-UHFFFAOYSA-N -1 1 330.340 4.032 20 0 EIADMM Cc1cc(F)ccc1-c1ccc(CN2CCC[C@H](C)[C@H]2C(=O)[O-])o1 ZINC000424413534 1038850831 /nfs/dbraw/zinc/85/08/31/1038850831.db2.gz FQTUDYDBSPEOMI-SGTLLEGYSA-N -1 1 331.387 4.079 20 0 EIADMM CCC1(CC)CCCN(c2ccc(-c3nc(C)c(C)c(=O)[n-]3)cn2)C1 ZINC000664406685 1039196370 /nfs/dbraw/zinc/19/63/70/1039196370.db2.gz BXKJFWHDAAANLS-UHFFFAOYSA-N -1 1 340.471 4.268 20 0 EIADMM c1n[n-]c(=NCc2cc(-c3ccccc3)cs2)n1Cc1ccccc1 ZINC000555564636 1039383792 /nfs/dbraw/zinc/38/37/92/1039383792.db2.gz NFMHJPMCNZGFDE-UHFFFAOYSA-N -1 1 346.459 4.089 20 0 EIADMM CSc1ccc([O-])c(C(=O)Nc2c(C)cc(N(C)C)cc2C)c1 ZINC000612864727 1039414937 /nfs/dbraw/zinc/41/49/37/1039414937.db2.gz XWQPCSRYEOCHBO-UHFFFAOYSA-N -1 1 330.453 4.049 20 0 EIADMM O=C(Nc1ccc([O-])c(F)c1F)C1(c2ccc(F)cc2)CCCC1 ZINC000456797091 1039593538 /nfs/dbraw/zinc/59/35/38/1039593538.db2.gz YYCQENOUIADPFZ-UHFFFAOYSA-N -1 1 335.325 4.260 20 0 EIADMM CCCc1c(C(=O)Nc2ccc([O-])c(F)c2F)cnn1C1CCCC1 ZINC000456776673 1039597017 /nfs/dbraw/zinc/59/70/17/1039597017.db2.gz DWGXDMJXXGHTIC-UHFFFAOYSA-N -1 1 349.381 4.187 20 0 EIADMM Cc1ccc(OCCCC(=O)Nc2ccc([O-])c(F)c2F)cc1C ZINC000456791556 1039610703 /nfs/dbraw/zinc/61/07/03/1039610703.db2.gz YNIANLRRZMPVMK-UHFFFAOYSA-N -1 1 335.350 4.085 20 0 EIADMM CC[C@@H](C)c1ccccc1OCC(=O)Nc1ccc([O-])c(F)c1F ZINC000456793771 1039613259 /nfs/dbraw/zinc/61/32/59/1039613259.db2.gz OLWFDSCLTPVIKX-LLVKDONJSA-N -1 1 335.350 4.201 20 0 EIADMM C[C@H](c1ccccc1Cl)N(C)C(=O)c1c[nH]c2ccccc2c1=O ZINC000097106396 1039863566 /nfs/dbraw/zinc/86/35/66/1039863566.db2.gz MNXBLPFSNUFBSW-GFCCVEGCSA-N -1 1 340.810 4.015 20 0 EIADMM CCN(C(=O)c1cc(NC(C)=O)ccc1[O-])c1cccc2ccccc21 ZINC000535094619 1039961363 /nfs/dbraw/zinc/96/13/63/1039961363.db2.gz KDOVYFOEJRBTRW-UHFFFAOYSA-N -1 1 348.402 4.171 20 0 EIADMM COc1cccc([C@H](C)Sc2nc(C(F)(F)F)cc(=O)[n-]2)c1 ZINC000435233649 1040210670 /nfs/dbraw/zinc/21/06/70/1040210670.db2.gz CCHAPIITPOOMGV-QMMMGPOBSA-N -1 1 330.331 4.063 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccnc(-c3ccccc3)c2)c(C)c1 ZINC000479251807 1040226611 /nfs/dbraw/zinc/22/66/11/1040226611.db2.gz VLKOVGVTGGXTBO-UHFFFAOYSA-N -1 1 338.432 4.166 20 0 EIADMM CC(C)CC1(C(=O)Nc2ccc(-c3cc(=O)[nH][n-]3)cc2)CCCC1 ZINC000477127110 1040241698 /nfs/dbraw/zinc/24/16/98/1040241698.db2.gz QKXFOVJTMLFQJA-UHFFFAOYSA-N -1 1 327.428 4.327 20 0 EIADMM Cc1cc(Br)c([O-])c(NC(=O)c2cccc(Cl)c2)c1 ZINC000482732105 1040451862 /nfs/dbraw/zinc/45/18/62/1040451862.db2.gz AUUZKMBKJVJWDA-UHFFFAOYSA-N -1 1 340.604 4.369 20 0 EIADMM Cc1ccc2c(c1)CC[C@@H]2Nc1ccc(-c2nc(C)c(C)c(=O)[n-]2)cn1 ZINC000462386408 1040553729 /nfs/dbraw/zinc/55/37/29/1040553729.db2.gz DHIHTURGYGWJRF-SFHVURJKSA-N -1 1 346.434 4.269 20 0 EIADMM O=C(CO[C@H]1CCCc2ccccc21)Nc1ccc([O-])c(Cl)c1 ZINC000435764835 1040604162 /nfs/dbraw/zinc/60/41/62/1040604162.db2.gz QAVVQUIVJCBXTB-KRWDZBQOSA-N -1 1 331.799 4.078 20 0 EIADMM CCc1ccc(S(=O)(=O)[N-]c2cccc(C(F)(F)F)c2)cc1 ZINC000005133706 1040646382 /nfs/dbraw/zinc/64/63/82/1040646382.db2.gz YPWZLIHEZRXPEM-UHFFFAOYSA-N -1 1 329.343 4.069 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cccc([C@H]4CCOC4)c3)n2)c(Cl)c1 ZINC000445450955 1040769562 /nfs/dbraw/zinc/76/95/62/1040769562.db2.gz YUDBTCCZFWSEQL-ZDUSSCGKSA-N -1 1 342.782 4.267 20 0 EIADMM CCC(C)(C)c1ccc(Oc2nc3c(cnn3C)c(=O)[n-]2)c(Cl)c1 ZINC000537833104 1040844029 /nfs/dbraw/zinc/84/40/29/1040844029.db2.gz DZBKXEJTEFVHPH-UHFFFAOYSA-N -1 1 346.818 4.202 20 0 EIADMM Cc1cc2cc[nH]c2cc1[N-]S(=O)(=O)c1ccc(C(C)C)cc1 ZINC000436166828 1040920189 /nfs/dbraw/zinc/92/01/89/1040920189.db2.gz SORFFTCUUBZKPH-UHFFFAOYSA-N -1 1 328.437 4.401 20 0 EIADMM CCc1cc(=O)[n-]c(SCc2coc(-c3ccc(C)cc3)n2)n1 ZINC000436245775 1040994658 /nfs/dbraw/zinc/99/46/58/1040994658.db2.gz HNIXEORLFKXALX-UHFFFAOYSA-N -1 1 327.409 4.000 20 0 EIADMM COc1ccc(S[C@@H](C)c2nc(-c3ccc([O-])cc3F)no2)cc1 ZINC000445464469 1041028668 /nfs/dbraw/zinc/02/86/68/1041028668.db2.gz TYIWGHIBVCMOJY-JTQLQIEISA-N -1 1 346.383 4.443 20 0 EIADMM O=C([O-])c1ccccc1CN(CCC(F)(F)F)Cc1ccccc1 ZINC000515856591 1041207290 /nfs/dbraw/zinc/20/72/90/1041207290.db2.gz ZXNSPWJGSXWEPX-UHFFFAOYSA-N -1 1 337.341 4.339 20 0 EIADMM COc1ccc([C@@H](CCC(=O)[O-])NCc2cscc2Cl)cc1 ZINC000904004543 1041267395 /nfs/dbraw/zinc/26/73/95/1041267395.db2.gz CVIZQDODZMKQFO-OAHLLOKOSA-N -1 1 339.844 4.106 20 0 EIADMM CC(C)CCC[C@H](NCc1ccc(-c2ccccc2F)o1)C(=O)[O-] ZINC000904037913 1041285958 /nfs/dbraw/zinc/28/59/58/1041285958.db2.gz CXLCIRXHIMHAON-KRWDZBQOSA-N -1 1 333.403 4.455 20 0 EIADMM CN(Cc1c(F)cccc1Cl)C(=O)c1ccc(Cl)cc1[O-] ZINC000436524089 1041308776 /nfs/dbraw/zinc/30/87/76/1041308776.db2.gz FOIATYQXYAGEAC-UHFFFAOYSA-N -1 1 328.170 4.110 20 0 EIADMM O=S(=O)([N-]c1ccc2scnc2c1)c1ccc(C(F)F)cc1 ZINC000554683027 1041319808 /nfs/dbraw/zinc/31/98/08/1041319808.db2.gz XREKIBOLJUYALG-UHFFFAOYSA-N -1 1 340.376 4.035 20 0 EIADMM CCN(C(=O)c1ccc(Cl)cc1[O-])[C@@H](C)Cc1ccc(OC)cc1 ZINC000436553653 1041328715 /nfs/dbraw/zinc/32/87/15/1041328715.db2.gz FXNFVNODZUIVSK-ZDUSSCGKSA-N -1 1 347.842 4.148 20 0 EIADMM CC[C@@H](C)[C@@H](C)N(C(=O)c1cc(Cl)c([O-])c(OC)c1)C1CC1 ZINC000436538545 1041331345 /nfs/dbraw/zinc/33/13/45/1041331345.db2.gz WDQAGCLGTJMULP-GHMZBOCLSA-N -1 1 325.836 4.093 20 0 EIADMM CCCN(C(=O)c1cc(F)ccc1[O-])[C@H](C)c1ccccc1OC ZINC000436539172 1041332935 /nfs/dbraw/zinc/33/29/35/1041332935.db2.gz KHAMSKJAPNXDOK-CYBMUJFWSA-N -1 1 331.387 4.153 20 0 EIADMM O=C(c1cc(F)ccc1[O-])N(CCc1ccccc1)C1CCCC1 ZINC000436539904 1041334377 /nfs/dbraw/zinc/33/43/77/1041334377.db2.gz QEDFMIBWEWJAHO-UHFFFAOYSA-N -1 1 327.399 4.159 20 0 EIADMM O=C(c1cc(F)ccc1[O-])N(C1CC1)[C@@H]1CCCc2ccccc21 ZINC000436541720 1041335274 /nfs/dbraw/zinc/33/52/74/1041335274.db2.gz ZJJPNWWGPOMBOD-GOSISDBHSA-N -1 1 325.383 4.214 20 0 EIADMM C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1cc2ccccc2cc1[O-] ZINC000436545148 1041339432 /nfs/dbraw/zinc/33/94/32/1041339432.db2.gz MQXOOWKGMWMRJK-NHYWBVRUSA-N -1 1 337.341 4.348 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000436557043 1041340562 /nfs/dbraw/zinc/34/05/62/1041340562.db2.gz UXJAGKJUXDGTST-LBPRGKRZSA-N -1 1 336.218 4.329 20 0 EIADMM CCN1CCN(C(=O)c2cc3ccccc3cc2[O-])c2ccccc21 ZINC000436559095 1041341660 /nfs/dbraw/zinc/34/16/60/1041341660.db2.gz SPKWWDLNFWXXND-UHFFFAOYSA-N -1 1 332.403 4.032 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000436557041 1041341841 /nfs/dbraw/zinc/34/18/41/1041341841.db2.gz UXJAGKJUXDGTST-GFCCVEGCSA-N -1 1 336.218 4.329 20 0 EIADMM C[C@H](c1ccc(Cl)cc1)[C@@H](C)N(C)C(=O)c1cc(F)ccc1[O-] ZINC000436573107 1041351964 /nfs/dbraw/zinc/35/19/64/1041351964.db2.gz GZWBCOSXEQWLAE-NWDGAFQWSA-N -1 1 335.806 4.449 20 0 EIADMM Cc1ccc([C@H]2CCC[C@H]2N(C)C(=O)c2cc(F)ccc2[O-])cc1 ZINC000436592557 1041352868 /nfs/dbraw/zinc/35/28/68/1041352868.db2.gz WLWVEPDQYNNPDQ-SJLPKXTDSA-N -1 1 327.399 4.248 20 0 EIADMM O=C(NCc1ncoc1-c1ccccc1)c1ccc2ccccc2c1[O-] ZINC000436580730 1041358619 /nfs/dbraw/zinc/35/86/19/1041358619.db2.gz HNLFFFKNDMIALJ-UHFFFAOYSA-N -1 1 344.370 4.130 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N(Cc1cccc(O)c1)CC1CC1 ZINC000436583283 1041361494 /nfs/dbraw/zinc/36/14/94/1041361494.db2.gz KEXFZVJFNKXWLV-UHFFFAOYSA-N -1 1 347.414 4.303 20 0 EIADMM Cc1c(COc2ccccc2)cccc1NC(=O)c1ccc(O)cc1[O-] ZINC000436625498 1041377923 /nfs/dbraw/zinc/37/79/23/1041377923.db2.gz MQVDELXQIQYRHQ-UHFFFAOYSA-N -1 1 349.386 4.238 20 0 EIADMM COc1cc(-c2noc(-c3ccc([O-])cc3F)n2)ccc1OC(C)C ZINC000436685850 1041421440 /nfs/dbraw/zinc/42/14/40/1041421440.db2.gz CDHICVCXCAZIRN-UHFFFAOYSA-N -1 1 344.342 4.044 20 0 EIADMM [O-]c1ccc(-c2nc(-c3ccc(Oc4cccnc4)cc3)no2)c(F)c1 ZINC000436691529 1041425253 /nfs/dbraw/zinc/42/52/53/1041425253.db2.gz UOMAVUDTPWGLRO-UHFFFAOYSA-N -1 1 349.321 4.436 20 0 EIADMM CN(Cc1ccc(Cl)c(F)c1)C(=O)c1cc(Cl)ccc1[O-] ZINC000436717305 1041441000 /nfs/dbraw/zinc/44/10/00/1041441000.db2.gz SXQSPPZZLUHSKN-UHFFFAOYSA-N -1 1 328.170 4.110 20 0 EIADMM CC(=O)Nc1cccc(NC(=O)c2ccc(C(C)C)cc2[O-])c1C ZINC000436735890 1041446396 /nfs/dbraw/zinc/44/63/96/1041446396.db2.gz DVHXCMXEQGRJAJ-UHFFFAOYSA-N -1 1 326.396 4.035 20 0 EIADMM C[C@H](Oc1ccccc1NC(=O)c1ccc([O-])cc1F)C(F)(F)F ZINC000436746005 1041452339 /nfs/dbraw/zinc/45/23/39/1041452339.db2.gz CJJPGLLLQMCCFI-VIFPVBQESA-N -1 1 343.276 4.113 20 0 EIADMM O=C(c1ccc(C(F)(F)F)cc1[O-])N1CC2C[C@@H]3CC1C[C@H](C2)C3 ZINC000436762198 1041460086 /nfs/dbraw/zinc/46/00/86/1041460086.db2.gz CTKHZYBJSKMEOR-KCXRBIIJSA-N -1 1 339.357 4.062 20 0 EIADMM CN(Cc1ccc(Cl)c(Cl)c1)C(=O)c1cc(F)ccc1[O-] ZINC000436753759 1041465106 /nfs/dbraw/zinc/46/51/06/1041465106.db2.gz GMBJUBZJBQSEQE-UHFFFAOYSA-N -1 1 328.170 4.110 20 0 EIADMM C[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436752409 1041465471 /nfs/dbraw/zinc/46/54/71/1041465471.db2.gz RJJZWEMMSGEYMS-GYSYKLTISA-N -1 1 327.346 4.204 20 0 EIADMM CCOc1ccccc1NC(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436789183 1041481939 /nfs/dbraw/zinc/48/19/39/1041481939.db2.gz DDEHMHBKYBCQOW-UHFFFAOYSA-N -1 1 325.286 4.062 20 0 EIADMM CC(C)c1ccc(C(=O)Nc2nccn2Cc2ccccc2)c([O-])c1 ZINC000436809701 1041490938 /nfs/dbraw/zinc/49/09/38/1041490938.db2.gz PLCFYEJCXVIJIV-UHFFFAOYSA-N -1 1 335.407 4.013 20 0 EIADMM CC[C@@H]1CN(C(=O)c2cc(F)ccc2[O-])c2cccc(Cl)c2O1 ZINC000436829504 1041495749 /nfs/dbraw/zinc/49/57/49/1041495749.db2.gz BGXKSOZJCDWADM-LLVKDONJSA-N -1 1 335.762 4.003 20 0 EIADMM O=C(c1ccc([O-])cc1F)N1CCC([C@@H](F)c2ccccc2F)CC1 ZINC000436842357 1041512343 /nfs/dbraw/zinc/51/23/43/1041512343.db2.gz DBMQEEMLXKZKKV-GOSISDBHSA-N -1 1 349.352 4.233 20 0 EIADMM [O-]c1ccc(-c2noc([C@H]3C[C@@H]3c3ccc(F)cc3F)n2)c(F)c1 ZINC000436875243 1041531271 /nfs/dbraw/zinc/53/12/71/1041531271.db2.gz UEHWAVIIJKWJGC-OLZOCXBDSA-N -1 1 332.281 4.131 20 0 EIADMM C[C@@H](c1cn(C)c2ccccc12)c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000436877112 1041534325 /nfs/dbraw/zinc/53/43/25/1041534325.db2.gz DTCMKXTYTPGEAB-NSHDSACASA-N -1 1 337.354 4.225 20 0 EIADMM C[C@@H](Cc1nc(-c2ccc([O-])cc2F)no1)c1c[nH]c2ccccc21 ZINC000436876627 1041536297 /nfs/dbraw/zinc/53/62/97/1041536297.db2.gz AJBDKMNEMBSLJH-NSHDSACASA-N -1 1 337.354 4.409 20 0 EIADMM [O-]c1c(-c2nc(-c3ccc4c(c3)CCO4)no2)ccc2ccccc21 ZINC000436888106 1041541835 /nfs/dbraw/zinc/54/18/35/1041541835.db2.gz PZRMUBSHPCKIHQ-UHFFFAOYSA-N -1 1 330.343 4.197 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1CCc2c1c(F)ccc2F ZINC000436908955 1041548620 /nfs/dbraw/zinc/54/86/20/1041548620.db2.gz XBSGPYROKGVUHM-UHFFFAOYSA-N -1 1 325.314 4.027 20 0 EIADMM CC(=O)c1cc(F)c([N-]C(=O)c2cc3ccccc3o2)c(F)c1F ZINC000538855811 1041560443 /nfs/dbraw/zinc/56/04/43/1041560443.db2.gz PHICDEFEFAYMGF-UHFFFAOYSA-N -1 1 333.265 4.305 20 0 EIADMM CC[C@H](C)[C@@H](C)N(C(=O)c1cc(Br)ccc1[O-])C1CC1 ZINC000436927259 1041562579 /nfs/dbraw/zinc/56/25/79/1041562579.db2.gz QPJALSXHRUSBSS-WDEREUQCSA-N -1 1 340.261 4.194 20 0 EIADMM COc1ccc2c(c1)CCC[C@@H]2c1noc(-c2cc(F)ccc2[O-])n1 ZINC000436963549 1041571862 /nfs/dbraw/zinc/57/18/62/1041571862.db2.gz OJYULEZCFJHORU-HNNXBMFYSA-N -1 1 340.354 4.058 20 0 EIADMM [O-]c1ccc(-c2noc(-c3ccoc3C(F)(F)F)n2)c(Cl)c1 ZINC000436956049 1041574426 /nfs/dbraw/zinc/57/44/26/1041574426.db2.gz KMZWQJCSPOIFNH-UHFFFAOYSA-N -1 1 330.649 4.374 20 0 EIADMM C[C@@H](CCCc1ccccc1)C(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC000540623464 1041577992 /nfs/dbraw/zinc/57/79/92/1041577992.db2.gz BMFJQCJTVRHQAM-HNNXBMFYSA-N -1 1 349.434 4.380 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N1CC[C@@H](c2cccc(Cl)c2)C1 ZINC000436980992 1041580895 /nfs/dbraw/zinc/58/08/95/1041580895.db2.gz BCACCHNVIADYNV-GFCCVEGCSA-N -1 1 336.218 4.329 20 0 EIADMM COc1ccc([C@H](C)NC(=O)c2ccc3ccccc3c2[O-])cc1F ZINC000437005752 1041590160 /nfs/dbraw/zinc/59/01/60/1041590160.db2.gz UBXFCXGJJZGXJO-LBPRGKRZSA-N -1 1 339.366 4.184 20 0 EIADMM Cc1cc([N-]S(=O)(=O)c2ccc(F)c(C)c2)c2cccnc2c1C ZINC000437322946 1041756439 /nfs/dbraw/zinc/75/64/39/1041756439.db2.gz LPDAPVNYIABACM-UHFFFAOYSA-N -1 1 344.411 4.100 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1ccn(-c2ccc(Cl)cc2)n1 ZINC000541887717 1042165403 /nfs/dbraw/zinc/16/54/03/1042165403.db2.gz JRBIUIALMUCRRI-UHFFFAOYSA-N -1 1 348.189 4.137 20 0 EIADMM CCc1cccc(C)c1[N-]S(=O)(=O)c1ccc(C(=O)C(C)C)cc1 ZINC000438790668 1042345108 /nfs/dbraw/zinc/34/51/08/1042345108.db2.gz FBVNOEMKGKJRBV-UHFFFAOYSA-N -1 1 345.464 4.197 20 0 EIADMM CCSc1nnc([N-]C(=O)c2cnc(-c3ccccc3)s2)s1 ZINC000491538961 1042469033 /nfs/dbraw/zinc/46/90/33/1042469033.db2.gz SULVWHUCMBLJTM-UHFFFAOYSA-N -1 1 348.478 4.026 20 0 EIADMM CCCc1ccc(S(=O)(=O)[N-]c2cccc(CSC)c2)cc1 ZINC000518311327 1042469724 /nfs/dbraw/zinc/46/97/24/1042469724.db2.gz NYJHPKWDZJRDRD-UHFFFAOYSA-N -1 1 335.494 4.303 20 0 EIADMM O=c1cc(C(F)(F)F)nc(SCc2nc3ccccc3s2)[n-]1 ZINC000518336899 1042480245 /nfs/dbraw/zinc/48/02/45/1042480245.db2.gz AXHWNEMODXZAHY-UHFFFAOYSA-N -1 1 343.355 4.103 20 0 EIADMM CC(C)(C)c1ncc(/C=C\C(=O)Nc2ccc([O-])c(F)c2F)s1 ZINC000493095823 1042816153 /nfs/dbraw/zinc/81/61/53/1042816153.db2.gz OCMMKMQUTPZSQE-DAXSKMNVSA-N -1 1 338.379 4.076 20 0 EIADMM Cc1nc(-c2ccccc2)oc1C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000182867711 1043035296 /nfs/dbraw/zinc/03/52/96/1043035296.db2.gz GLLFUGDDCHATAQ-UHFFFAOYSA-N -1 1 328.755 4.261 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1c[nH]nc1-c1ccc(Cl)cc1 ZINC000509163092 1043116151 /nfs/dbraw/zinc/11/61/51/1043116151.db2.gz DAHHGNRYWNGXDO-UHFFFAOYSA-N -1 1 348.189 4.341 20 0 EIADMM CCOc1cc(C(=O)NCc2cccc(Cl)c2)cc(Cl)c1[O-] ZINC000215952008 1043200051 /nfs/dbraw/zinc/20/00/51/1043200051.db2.gz ZWTMYEPFQWQOMC-UHFFFAOYSA-N -1 1 340.206 4.028 20 0 EIADMM Cc1[n-][nH]c(=O)c1NC(=O)CCCCc1ccc(C(C)(C)C)cc1 ZINC000615225781 1043211097 /nfs/dbraw/zinc/21/10/97/1043211097.db2.gz GHSMHMLTGFMSKP-UHFFFAOYSA-N -1 1 329.444 4.073 20 0 EIADMM COCCOc1ccc(Nc2cc(F)c([O-])c(Cl)c2)cc1F ZINC001214489446 1043229050 /nfs/dbraw/zinc/22/90/50/1043229050.db2.gz DXVSEQZJDBYQOI-UHFFFAOYSA-N -1 1 329.730 4.093 20 0 EIADMM Cc1ccc(-c2cc(=NC(=O)c3ccc(C)cc3Cl)[nH][n-]2)s1 ZINC000427888914 1043251033 /nfs/dbraw/zinc/25/10/33/1043251033.db2.gz YOLCMFMSRJCNDY-UHFFFAOYSA-N -1 1 331.828 4.083 20 0 EIADMM O=C(Nc1ccc(-n2cccn2)c(F)c1)c1cc2ccccc2cc1[O-] ZINC001626095756 1043321357 /nfs/dbraw/zinc/32/13/57/1043321357.db2.gz JTYKXXBTIBEEKF-UHFFFAOYSA-N -1 1 347.349 4.123 20 0 EIADMM [O-]c1cccnc1-c1nc(-c2cc(C(F)(F)F)ccc2Cl)no1 ZINC001212480626 1043436285 /nfs/dbraw/zinc/43/62/85/1043436285.db2.gz ADEFRGSRAHUTOH-UHFFFAOYSA-N -1 1 341.676 4.176 20 0 EIADMM Cc1cc(F)ccc1[N-]S(=O)(=O)c1ccc(CC(F)(F)F)cc1 ZINC000189233778 1043496588 /nfs/dbraw/zinc/49/65/88/1043496588.db2.gz LUXSLOIBPWHPJX-UHFFFAOYSA-N -1 1 347.333 4.040 20 0 EIADMM Cc1cc([C@H](C)N2CCC(Oc3cccc(F)c3)CC2)oc1C(=O)[O-] ZINC000530163249 1043630772 /nfs/dbraw/zinc/63/07/72/1043630772.db2.gz FYQMUNWVDGEZRD-ZDUSSCGKSA-N -1 1 347.386 4.030 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)Nc1cc(F)ccc1OC(F)F ZINC000190977726 1043756183 /nfs/dbraw/zinc/75/61/83/1043756183.db2.gz BISLLSXLOYQTNU-UHFFFAOYSA-N -1 1 346.692 4.430 20 0 EIADMM COc1cc(C(=O)Nc2ccc(CSC)cc2)cc(Cl)c1[O-] ZINC000442961399 1043920639 /nfs/dbraw/zinc/92/06/39/1043920639.db2.gz AYQQISCROBKAHK-UHFFFAOYSA-N -1 1 337.828 4.170 20 0 EIADMM COc1cc(C(=O)N[C@@H]2CCC[C@@H]2c2ccccc2)cc(Cl)c1[O-] ZINC000442963976 1043925677 /nfs/dbraw/zinc/92/56/77/1043925677.db2.gz FTKARBUMNKCYBY-GDBMZVCRSA-N -1 1 345.826 4.120 20 0 EIADMM CCCCC[C@H]1CCCN1C(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC000443043025 1043982071 /nfs/dbraw/zinc/98/20/71/1043982071.db2.gz DITSXMQLUWYVDS-ZDUSSCGKSA-N -1 1 325.836 4.239 20 0 EIADMM CCOc1cc(-c2nc(-c3cccc(OC)c3)no2)cc(Cl)c1[O-] ZINC000443086728 1043997597 /nfs/dbraw/zinc/99/75/97/1043997597.db2.gz NRAUOCWXEPNERI-UHFFFAOYSA-N -1 1 346.770 4.170 20 0 EIADMM CCOC(=O)c1c[n-]c(NC(=O)C2(C3CCCCC3)CCCCC2)n1 ZINC001128946392 1044032480 /nfs/dbraw/zinc/03/24/80/1044032480.db2.gz NFNMHBPBASKRMN-UHFFFAOYSA-N -1 1 347.459 4.056 20 0 EIADMM CCC1(CC)CCN(C(=O)c2cc(Cl)c([O-])c(OC)c2)CC1 ZINC000443208016 1044095757 /nfs/dbraw/zinc/09/57/57/1044095757.db2.gz MQYLBBUGLAJZFL-UHFFFAOYSA-N -1 1 325.836 4.097 20 0 EIADMM COc1cc(C(=O)Nc2cccc(COC(C)C)c2)cc(Cl)c1[O-] ZINC000443348764 1044194392 /nfs/dbraw/zinc/19/43/92/1044194392.db2.gz SCEQVZBPGRVEHJ-UHFFFAOYSA-N -1 1 349.814 4.232 20 0 EIADMM COc1cc(C(=O)N(Cc2cccs2)C(C)C)cc(Cl)c1[O-] ZINC000443345238 1044195778 /nfs/dbraw/zinc/19/57/78/1044195778.db2.gz UBBCTVQCOJGNNB-UHFFFAOYSA-N -1 1 339.844 4.167 20 0 EIADMM Cc1csc(-c2cccc(S(=O)(=O)[N-]c3cccc(F)c3)c2)n1 ZINC000443407556 1044249932 /nfs/dbraw/zinc/24/99/32/1044249932.db2.gz PZUSCNCWWHMZDR-UHFFFAOYSA-N -1 1 348.424 4.058 20 0 EIADMM Nc1ccc(-c2nc(C3CCC(c4ccccc4)CC3)no2)c([O-])c1 ZINC000843236702 1044346896 /nfs/dbraw/zinc/34/68/96/1044346896.db2.gz GCAFCEIOOXTYPG-UHFFFAOYSA-N -1 1 335.407 4.466 20 0 EIADMM Cc1cnc(C(=O)N2CCC(c3cccc4ccccc43)CC2)c([O-])c1 ZINC000494839663 1044429750 /nfs/dbraw/zinc/42/97/50/1044429750.db2.gz YFNWZIMKQDQNIQ-UHFFFAOYSA-N -1 1 346.430 4.269 20 0 EIADMM O=C(c1cc(F)ccc1[O-])N(Cc1cccs1)Cc1cccs1 ZINC000093944998 1044444984 /nfs/dbraw/zinc/44/49/84/1044444984.db2.gz IXMUKTUOOZXGAN-UHFFFAOYSA-N -1 1 347.436 4.497 20 0 EIADMM CC(C)(C)CN(CC(=O)[O-])Cc1ccc(-c2cccc(F)c2F)o1 ZINC000665350831 1044488303 /nfs/dbraw/zinc/48/83/03/1044488303.db2.gz FLWJGAIUNKMIRQ-UHFFFAOYSA-N -1 1 337.366 4.158 20 0 EIADMM O=S(=O)(/C=C/c1ccccc1Cl)[N-]c1ccc2ccccc2n1 ZINC000734975698 1044726833 /nfs/dbraw/zinc/72/68/33/1044726833.db2.gz XAHBTPWBWVYFHF-VAWYXSNFSA-N -1 1 344.823 4.301 20 0 EIADMM CN(CCC1CCCCC1)C(=O)c1ccc(Br)c([O-])c1 ZINC000499871588 1044767596 /nfs/dbraw/zinc/76/75/96/1044767596.db2.gz CVAPYBYUSMROKF-UHFFFAOYSA-N -1 1 340.261 4.197 20 0 EIADMM [O-]c1ccc(-c2nc(-c3cccc(Br)c3)no2)c(F)c1 ZINC000230225660 1044810273 /nfs/dbraw/zinc/81/02/73/1044810273.db2.gz HMCAOUSUDGBNLO-UHFFFAOYSA-N -1 1 335.132 4.011 20 0 EIADMM O=C(Nc1c([O-])cccc1F)c1cc(Cl)cc(Br)c1 ZINC000676624845 1044811169 /nfs/dbraw/zinc/81/11/69/1044811169.db2.gz NLBLRKMWJLSQFE-UHFFFAOYSA-N -1 1 344.567 4.200 20 0 EIADMM O=C(Nc1cc(Cl)cc(Cl)c1[O-])c1ccc(O)c(Cl)c1 ZINC000230872396 1044829849 /nfs/dbraw/zinc/82/98/49/1044829849.db2.gz FZEFLRMALPKAIC-UHFFFAOYSA-N -1 1 332.570 4.310 20 0 EIADMM C[C@H](CCNC(=O)c1ccc(Br)c([O-])c1)c1ccccc1 ZINC000231329267 1044844155 /nfs/dbraw/zinc/84/41/55/1044844155.db2.gz XILZYLBEPFMZNO-GFCCVEGCSA-N -1 1 348.240 4.078 20 0 EIADMM CSc1ccc(Cl)cc1[N-]S(=O)(=O)c1ccc(F)c(C)c1 ZINC000303303237 1044981413 /nfs/dbraw/zinc/98/14/13/1044981413.db2.gz QJPQZMGUDKRKJQ-UHFFFAOYSA-N -1 1 345.848 4.310 20 0 EIADMM CCCc1cc(=O)[n-]c(SC[C@H](O)c2ccc3ccccc3c2)n1 ZINC000915057803 1045014563 /nfs/dbraw/zinc/01/45/63/1045014563.db2.gz OSCUSOGTQDBXSL-KRWDZBQOSA-N -1 1 340.448 4.114 20 0 EIADMM CSc1cccc(S(=O)(=O)[N-]c2cccc3ccc(O)cc32)c1 ZINC000509395727 1045095512 /nfs/dbraw/zinc/09/55/12/1045095512.db2.gz FAEXDJYLGNUQDV-UHFFFAOYSA-N -1 1 345.445 4.068 20 0 EIADMM COc1ccc(C[C@@H](C)CN(C)C(=O)c2c([O-])cccc2Cl)cc1 ZINC000762287423 1045165515 /nfs/dbraw/zinc/16/55/15/1045165515.db2.gz KUERDNONZPJBJZ-CYBMUJFWSA-N -1 1 347.842 4.005 20 0 EIADMM CCOc1ccc(N(C)C(=O)c2cc(Cl)c([O-])c(OCC)c2)cc1 ZINC000762606752 1045314959 /nfs/dbraw/zinc/31/49/59/1045314959.db2.gz YKADNAJYJPCMKE-UHFFFAOYSA-N -1 1 349.814 4.120 20 0 EIADMM O=C(CCC1CCCCC1)N1CCC(C(=O)c2ccc([O-])cc2)CC1 ZINC000055315443 1045683293 /nfs/dbraw/zinc/68/32/93/1045683293.db2.gz VIWIHHXNKFZMSV-UHFFFAOYSA-N -1 1 343.467 4.174 20 0 EIADMM O=C([N-]c1ccccc1SC(F)F)c1nc2cccnc2s1 ZINC000791307135 1045718736 /nfs/dbraw/zinc/71/87/36/1045718736.db2.gz NSPQDCKQMDXPFO-UHFFFAOYSA-N -1 1 337.376 4.258 20 0 EIADMM O=C(CSc1nccn1-c1ccc(Cl)cc1)c1ccc([O-])cc1 ZINC000026042443 1045740282 /nfs/dbraw/zinc/74/02/82/1045740282.db2.gz ZWCSJUDPNOSMSC-UHFFFAOYSA-N -1 1 344.823 4.206 20 0 EIADMM Cc1ccc([C@@H]2CCCN2Cc2nc(=O)c3sccc3[n-]2)cc1C ZINC000067984785 1045746875 /nfs/dbraw/zinc/74/68/75/1045746875.db2.gz WNLWUUVJECVLFB-INIZCTEOSA-N -1 1 339.464 4.351 20 0 EIADMM CC(=O)c1cccc([N-]S(=O)(=O)c2ccc(CCC(C)C)cc2)c1 ZINC000032532014 1045822275 /nfs/dbraw/zinc/82/22/75/1045822275.db2.gz HXZQTECUEVJWIH-UHFFFAOYSA-N -1 1 345.464 4.279 20 0 EIADMM [O-]c1c(Br)c(F)ccc1Nc1ccc(O)c(F)c1F ZINC001212013939 1045835429 /nfs/dbraw/zinc/83/54/29/1045835429.db2.gz QMSRMAKFPRJKNS-UHFFFAOYSA-N -1 1 334.091 4.021 20 0 EIADMM O=S(=O)(/C=C\c1cccc(Cl)c1)[N-]c1ccc2ccccc2n1 ZINC000768859627 1045845819 /nfs/dbraw/zinc/84/58/19/1045845819.db2.gz ZDRKLSJBSRJRHO-KHPPLWFESA-N -1 1 344.823 4.301 20 0 EIADMM CC(C)c1cccnc1[N-]S(=O)(=O)/C=C\c1cccc(Cl)c1 ZINC000768864461 1045857091 /nfs/dbraw/zinc/85/70/91/1045857091.db2.gz RFOHRYGLIQISHC-NTMALXAHSA-N -1 1 336.844 4.271 20 0 EIADMM CCOc1ccc([N-]S(=O)(=O)c2ccc3ccccc3c2)cc1F ZINC000614873847 1045899054 /nfs/dbraw/zinc/89/90/54/1045899054.db2.gz USCMUQTXZMSLKE-UHFFFAOYSA-N -1 1 345.395 4.178 20 0 EIADMM COC(=O)Nc1cccc(NC(=O)Nc2ccc([O-])c(Cl)c2)c1C ZINC000496363724 1045916651 /nfs/dbraw/zinc/91/66/51/1045916651.db2.gz PPHOWOVAUSSJCT-UHFFFAOYSA-N -1 1 349.774 4.176 20 0 EIADMM Cc1cc(Br)c([O-])c(NC(=O)[C@H](F)c2ccccc2)c1 ZINC000769620692 1046035947 /nfs/dbraw/zinc/03/59/47/1046035947.db2.gz YEDBTALRVQJIHO-CYBMUJFWSA-N -1 1 338.176 4.112 20 0 EIADMM CCN(C(=O)c1c([O-])cccc1Cl)[C@H](C)c1cccc(OC)c1 ZINC000769691993 1046045890 /nfs/dbraw/zinc/04/58/90/1046045890.db2.gz LNPBUDTYFRVXIU-GFCCVEGCSA-N -1 1 333.815 4.278 20 0 EIADMM COc1cc(C(=O)Nc2cc(C(C)C)c(O)cc2C)cc(Cl)c1[O-] ZINC000154016264 1046049981 /nfs/dbraw/zinc/04/99/81/1046049981.db2.gz YBTNWHTVJSVDOW-UHFFFAOYSA-N -1 1 349.814 4.444 20 0 EIADMM O=C(c1c([O-])cccc1Cl)N1CCC[C@H]1c1ccc(F)c(F)c1 ZINC000769832316 1046091026 /nfs/dbraw/zinc/09/10/26/1046091026.db2.gz QCCLBURLBRJXAO-AWEZNQCLSA-N -1 1 337.753 4.301 20 0 EIADMM Cn1ncc(NC(=O)Nc2ccc([O-])c(Cl)c2)c1-c1ccccc1 ZINC000496870704 1046093365 /nfs/dbraw/zinc/09/33/65/1046093365.db2.gz ZOBPHQDHRJAOFP-UHFFFAOYSA-N -1 1 342.786 4.090 20 0 EIADMM O=C(c1c([O-])cccc1Cl)N1CCCCC[C@@H]1[C@@H]1CCCCC1=O ZINC000769973766 1046117882 /nfs/dbraw/zinc/11/78/82/1046117882.db2.gz HZGLFMILZWUCIK-DZGCQCFKSA-N -1 1 349.858 4.190 20 0 EIADMM CCC(CC)c1nnc([N-]C(=O)c2cc(F)c(F)cc2F)s1 ZINC000124619144 1046252708 /nfs/dbraw/zinc/25/27/08/1046252708.db2.gz NCEKRBWBWINYJJ-UHFFFAOYSA-N -1 1 329.347 4.111 20 0 EIADMM C[C@H]1CC[C@H](C(=O)[O-])CN1Cc1cc(Cl)cc(C(F)(F)F)c1 ZINC000263360486 1046279698 /nfs/dbraw/zinc/27/96/98/1046279698.db2.gz RVGJKMMRDXXMLQ-ONGXEEELSA-N -1 1 335.753 4.044 20 0 EIADMM CN(C(=O)c1ccc(NC(=O)OC(C)(C)C)cc1[O-])C1(C)CCCC1 ZINC000497179245 1046370393 /nfs/dbraw/zinc/37/03/93/1046370393.db2.gz PMIIFRVCFOXKCS-UHFFFAOYSA-N -1 1 348.443 4.144 20 0 EIADMM Cc1cnc(-c2cccc([N-]S(=O)(=O)c3cc(C)ccc3C)c2)o1 ZINC000066814714 1046673785 /nfs/dbraw/zinc/67/37/85/1046673785.db2.gz MCELSKFAKYXUGC-UHFFFAOYSA-N -1 1 342.420 4.068 20 0 EIADMM CC(C)Oc1cc(F)c(F)cc1Nc1cc2ccc([O-])cc2oc1=O ZINC001212225064 1046750179 /nfs/dbraw/zinc/75/01/79/1046750179.db2.gz MORSVIMDCACMCY-UHFFFAOYSA-N -1 1 347.317 4.308 20 0 EIADMM Cc1nc(SCc2ccc(Cl)nc2C(F)(F)F)[n-]c(=O)c1C ZINC000786727760 1046862415 /nfs/dbraw/zinc/86/24/15/1046862415.db2.gz JAPOQFZKTNNMHO-UHFFFAOYSA-N -1 1 349.765 4.159 20 0 EIADMM Cc1nc(-c2ccccc2)sc1NC(=O)c1c(F)ccc([O-])c1F ZINC000537262996 1047069623 /nfs/dbraw/zinc/06/96/23/1047069623.db2.gz JNOKDQGIKBQHIZ-UHFFFAOYSA-N -1 1 346.358 4.355 20 0 EIADMM COc1cc(C(=O)NCC(C)(C)c2ccccc2C)cc(Cl)c1[O-] ZINC000460206136 1047162668 /nfs/dbraw/zinc/16/26/68/1047162668.db2.gz YWYFSIUUTRTHDQ-UHFFFAOYSA-N -1 1 347.842 4.070 20 0 EIADMM Cc1cc(Br)c([O-])c(NC(=O)c2cc(Cl)cs2)c1 ZINC000760489324 1047388525 /nfs/dbraw/zinc/38/85/25/1047388525.db2.gz HNYPHDYLQVQWIH-UHFFFAOYSA-N -1 1 346.633 4.430 20 0 EIADMM O=C(Nc1nc(Cl)ccc1[O-])c1sccc1SC(F)F ZINC000790048446 1047510547 /nfs/dbraw/zinc/51/05/47/1047510547.db2.gz RANWFECLSFDTJW-UHFFFAOYSA-N -1 1 336.772 4.069 20 0 EIADMM Cc1nc(C(=O)Nc2nc(Cl)ccc2[O-])c(-c2ccccc2)s1 ZINC000790047335 1047511292 /nfs/dbraw/zinc/51/12/92/1047511292.db2.gz DZNZWVUOPNFLIZ-UHFFFAOYSA-N -1 1 345.811 4.125 20 0 EIADMM Cc1nc2ccccc2c(C)c1C(=O)Nc1cc(F)cc(F)c1[O-] ZINC001142543120 1047603858 /nfs/dbraw/zinc/60/38/58/1047603858.db2.gz ZSQSZSFVWNAQCC-UHFFFAOYSA-N -1 1 328.318 4.088 20 0 EIADMM CCc1ccc(S(=O)(=O)[N-]c2cc(F)c(F)cc2Cl)s1 ZINC000476394196 1047761852 /nfs/dbraw/zinc/76/18/52/1047761852.db2.gz SRPSZWGFHOCKRE-UHFFFAOYSA-N -1 1 337.800 4.043 20 0 EIADMM CCCN(C(=O)c1ccc([O-])c(F)c1)[C@@H]1C[C@@H](OCC)C12CCCC2 ZINC001136843889 1047846702 /nfs/dbraw/zinc/84/67/02/1047846702.db2.gz CXLVNGSMMWCBAP-QZTJIDSGSA-N -1 1 349.446 4.121 20 0 EIADMM Cc1ccc(C[C@H]2CCCN(C(=O)c3c([O-])cccc3Cl)C2)cc1 ZINC000747901149 1047858849 /nfs/dbraw/zinc/85/88/49/1047858849.db2.gz SLSNJYZQWXLOIY-MRXNPFEDSA-N -1 1 343.854 4.449 20 0 EIADMM Cc1ccc([C@@H]2CCC[C@@H]2N(C)C(=O)c2ccc(F)c([O-])c2)cc1 ZINC001136989530 1048035426 /nfs/dbraw/zinc/03/54/26/1048035426.db2.gz JKDDAAFEMRIPOG-WMZOPIPTSA-N -1 1 327.399 4.248 20 0 EIADMM O=C(N[C@@H]1CCO[C@H](c2ccccc2)C1)c1cc2ccccc2cc1[O-] ZINC000132017219 1048182316 /nfs/dbraw/zinc/18/23/16/1048182316.db2.gz GBELBFYNXFRNKL-NQIIRXRSSA-N -1 1 347.414 4.196 20 0 EIADMM CCCC[C@@H](NC(=O)c1c([O-])cccc1F)c1ccc(OC)cc1 ZINC001144144548 1048448379 /nfs/dbraw/zinc/44/83/79/1048448379.db2.gz YBXGVDIRNXNSCW-MRXNPFEDSA-N -1 1 331.387 4.201 20 0 EIADMM COc1ccc([C@@H]2CCCN2Cc2c(F)cc([O-])cc2F)cc1OC ZINC001144554591 1048724199 /nfs/dbraw/zinc/72/41/99/1048724199.db2.gz BHNYXPNYVYUOIZ-KRWDZBQOSA-N -1 1 349.377 4.025 20 0 EIADMM CN(Cc1cccc(Cl)c1)C(=O)c1c([O-])cnc2c(F)cccc21 ZINC001135475761 1048749720 /nfs/dbraw/zinc/74/97/20/1048749720.db2.gz BVEBQQQNAJZPCN-UHFFFAOYSA-N -1 1 344.773 4.005 20 0 EIADMM [O-]c1cc(F)c(CN2CCSC[C@@H]2c2ccc(F)cc2)cc1F ZINC001144657774 1048778952 /nfs/dbraw/zinc/77/89/52/1048778952.db2.gz HXDRAPGWUULZMZ-MRXNPFEDSA-N -1 1 339.382 4.100 20 0 EIADMM [O-]c1cc(F)c(CN(Cc2ccccc2)Cc2cccnc2)cc1F ZINC001144666770 1048784626 /nfs/dbraw/zinc/78/46/26/1048784626.db2.gz PHOXNIXYFCSBBR-UHFFFAOYSA-N -1 1 340.373 4.268 20 0 EIADMM COc1ccc([C@@H]2CCCN2Cc2cc(F)c([O-])cc2F)cc1OC ZINC001144667142 1048786661 /nfs/dbraw/zinc/78/66/61/1048786661.db2.gz UPTJVULELJDSPS-INIZCTEOSA-N -1 1 349.377 4.025 20 0 EIADMM CSc1ccc([O-])c(C(=O)Nc2ccc(OC(F)(F)F)cc2)c1 ZINC001135555805 1048792778 /nfs/dbraw/zinc/79/27/78/1048792778.db2.gz HHFQZCIKRHZPKD-UHFFFAOYSA-N -1 1 343.326 4.265 20 0 EIADMM O=C([O-])c1ccsc1CN1CCc2cc(C(F)(F)F)ccc2C1 ZINC001144680465 1048801415 /nfs/dbraw/zinc/80/14/15/1048801415.db2.gz OQIISSRVYSROSI-UHFFFAOYSA-N -1 1 341.354 4.023 20 0 EIADMM CN(Cc1sccc1C(=O)[O-])Cc1cc(Cl)cc(Cl)c1 ZINC001144684748 1048804174 /nfs/dbraw/zinc/80/41/74/1048804174.db2.gz NYSXMAKJVXOFBH-UHFFFAOYSA-N -1 1 330.236 4.385 20 0 EIADMM COCCc1ccc(OC(=O)c2cc3cc(Cl)sc3[n-]2)cc1 ZINC000810524639 1048806713 /nfs/dbraw/zinc/80/67/13/1048806713.db2.gz RBYBLXJBTCGNBG-UHFFFAOYSA-N -1 1 335.812 4.291 20 0 EIADMM CCOc1cc(C(=O)N[C@@H]2CCC[C@H](C(C)C)C2)cc(Cl)c1[O-] ZINC001144746160 1048843981 /nfs/dbraw/zinc/84/39/81/1048843981.db2.gz VCOOHACVLJZGBW-GXTWGEPZSA-N -1 1 339.863 4.389 20 0 EIADMM C/C(=C\CN1Cc2cc(Cl)ccc2C[C@H]1c1ccccc1)C(=O)[O-] ZINC000846254029 1048849370 /nfs/dbraw/zinc/84/93/70/1048849370.db2.gz BEQCFVCGGJYJQC-JNMQVBFRSA-N -1 1 341.838 4.470 20 0 EIADMM C[C@@H](OCCCNC(=O)c1cc2ccccc2cc1[O-])c1ccccc1 ZINC001135954194 1049021633 /nfs/dbraw/zinc/02/16/33/1049021633.db2.gz NOTIGYBGNNWJIT-MRXNPFEDSA-N -1 1 349.430 4.443 20 0 EIADMM Cc1cccc(Oc2ccc(NC(=O)c3ccccc3[O-])cn2)c1C ZINC001146839189 1049064227 /nfs/dbraw/zinc/06/42/27/1049064227.db2.gz BVGRDMNUZMPLAG-UHFFFAOYSA-N -1 1 334.375 4.449 20 0 EIADMM C[C@@H]1CC(NC(=O)c2cc(-c3ccc(C=O)o3)ccc2[O-])C[C@@H](C)C1 ZINC001147331814 1049128017 /nfs/dbraw/zinc/12/80/17/1049128017.db2.gz PUQXNQDADZMLAR-STQMWFEESA-N -1 1 341.407 4.019 20 0 EIADMM Cc1ccc2c(c1)[C@@H](NC(=O)c1ccc(C(F)(F)F)c([O-])c1)[C@H](C)C2 ZINC001147340830 1049131196 /nfs/dbraw/zinc/13/11/96/1049131196.db2.gz GGASBDVKZVJECD-DIFFPNOSSA-N -1 1 349.352 4.383 20 0 EIADMM CCCCN(CCCC)C(=O)c1ccc(Br)cc1[O-] ZINC000044490560 1049233921 /nfs/dbraw/zinc/23/39/21/1049233921.db2.gz NDIBZVGUILGGST-UHFFFAOYSA-N -1 1 328.250 4.197 20 0 EIADMM CCN(Cc1ccccc1C)C(=O)c1c([O-])cnc2c(F)cccc21 ZINC001136183385 1049237095 /nfs/dbraw/zinc/23/70/95/1049237095.db2.gz CHKUONMNOQQDIM-UHFFFAOYSA-N -1 1 338.382 4.050 20 0 EIADMM CC[C@@H](Cc1ccc(C)cc1)N(C)C(=O)c1c([O-])cccc1Cl ZINC001148224046 1049282871 /nfs/dbraw/zinc/28/28/71/1049282871.db2.gz JGMYVUCOWHOPMG-HNNXBMFYSA-N -1 1 331.843 4.447 20 0 EIADMM Cc1cc(=O)n(-c2ccc(C(=O)Nc3cc4ccccc4s3)cc2)[n-]1 ZINC001148325935 1049301950 /nfs/dbraw/zinc/30/19/50/1049301950.db2.gz BVDWWRIDKQMFOW-UHFFFAOYSA-N -1 1 349.415 4.266 20 0 EIADMM O=C(Nc1csc2cnccc12)c1ccc(C(F)(F)F)cc1[O-] ZINC001148793877 1049379802 /nfs/dbraw/zinc/37/98/02/1049379802.db2.gz BOTQFWZNTILGTA-UHFFFAOYSA-N -1 1 338.310 4.273 20 0 EIADMM Cc1cc(Cl)c(NC(=O)c2ccc(C(F)(F)F)cc2[O-])cc1O ZINC001148801290 1049381969 /nfs/dbraw/zinc/38/19/69/1049381969.db2.gz XPWIADNGUYJCOQ-UHFFFAOYSA-N -1 1 345.704 4.331 20 0 EIADMM O=C(c1cccc(-c2ccccc2)c1[O-])N1CC[C@@H](c2cccnc2)C1 ZINC001148865925 1049390021 /nfs/dbraw/zinc/39/00/21/1049390021.db2.gz BHNALAKKRYXPNU-GOSISDBHSA-N -1 1 344.414 4.084 20 0 EIADMM Cn1cc2cccc(NC(=O)c3cccc(-c4ccccc4)c3[O-])c2n1 ZINC001148869289 1049391248 /nfs/dbraw/zinc/39/12/48/1049391248.db2.gz HGJYPEAZPVAUFD-UHFFFAOYSA-N -1 1 343.386 4.198 20 0 EIADMM O=C(N[C@H]1CCCC(F)(F)C1)c1cccc(-c2ccccc2)c1[O-] ZINC001148871767 1049393061 /nfs/dbraw/zinc/39/30/61/1049393061.db2.gz DFSULZKKVGNLMP-AWEZNQCLSA-N -1 1 331.362 4.367 20 0 EIADMM CC1(C)C[C@@]1(NC(=O)Cc1ccc([O-])c(Cl)c1)c1ccccc1 ZINC001148896360 1049394262 /nfs/dbraw/zinc/39/42/62/1049394262.db2.gz XZKSUDXKLVWCCM-LJQANCHMSA-N -1 1 329.827 4.030 20 0 EIADMM CN(Cc1cccc2ccccc21)C(=O)c1ncc2ccccc2c1[O-] ZINC001136287728 1049395123 /nfs/dbraw/zinc/39/51/23/1049395123.db2.gz OXEUKZOCGYCFFX-UHFFFAOYSA-N -1 1 342.398 4.366 20 0 EIADMM C[C@@]1(Cc2noc(Cc3ccc([O-])c(Cl)c3)n2)CC1(Cl)Cl ZINC000867026703 1049434504 /nfs/dbraw/zinc/43/45/04/1049434504.db2.gz ZCGXPDXZWYIDRH-CYBMUJFWSA-N -1 1 347.629 4.146 20 0 EIADMM Cc1cc(Cl)cnc1[N-]S(=O)(=O)/C=C\c1cccc(Cl)c1 ZINC000812339274 1049443810 /nfs/dbraw/zinc/44/38/10/1049443810.db2.gz SVBNTSZLYMRCQG-WAYWQWQTSA-N -1 1 343.235 4.109 20 0 EIADMM Cc1ccccc1[C@H]1CCCN1C(=O)Cc1ccc([O-])c(Cl)c1 ZINC001136327081 1049487586 /nfs/dbraw/zinc/48/75/86/1049487586.db2.gz WRIXARIZSRVGLE-QGZVFWFLSA-N -1 1 329.827 4.260 20 0 EIADMM O=C(Nc1ccc2nc(C3CC3)sc2c1)c1cccc([O-])c1F ZINC001136437625 1049629678 /nfs/dbraw/zinc/62/96/78/1049629678.db2.gz MSDFMCKVJWCSOT-UHFFFAOYSA-N -1 1 328.368 4.271 20 0 EIADMM Cc1oc(-c2cccs2)nc1C(=O)[N-]c1nc(C(C)(C)C)ns1 ZINC000068072344 1049720864 /nfs/dbraw/zinc/72/08/64/1049720864.db2.gz WRQQLNVWMNVGIF-UHFFFAOYSA-N -1 1 348.453 4.113 20 0 EIADMM COc1ccc(C(=O)Nc2cccc(F)c2[O-])cc1-c1ccccc1 ZINC001171632645 1049763765 /nfs/dbraw/zinc/76/37/65/1049763765.db2.gz JKTRVYNBQXHALT-UHFFFAOYSA-N -1 1 337.350 4.459 20 0 EIADMM CC(C)(C)OC(=O)Nc1cccc(C(=O)Nc2cccc(F)c2[O-])c1 ZINC001171632722 1049764292 /nfs/dbraw/zinc/76/42/92/1049764292.db2.gz MKEVIOGBLFCADL-UHFFFAOYSA-N -1 1 346.358 4.131 20 0 EIADMM CC(C)[C@@H]1CCC[C@@H](NC(=O)c2cc(Br)ccc2[O-])C1 ZINC001136701878 1049839194 /nfs/dbraw/zinc/83/91/94/1049839194.db2.gz OSSOVKOVCRFPSX-DGCLKSJQSA-N -1 1 340.261 4.099 20 0 EIADMM Cc1ccccc1[C@H](NC(=O)c1cncc([O-])c1)[C@@H]1CCC[C@H](C)C1 ZINC001136731656 1049856627 /nfs/dbraw/zinc/85/66/27/1049856627.db2.gz DEWOABJJNXZISF-YYFZDKIDSA-N -1 1 338.451 4.393 20 0 EIADMM CC[C@H](Cc1ccc(Cl)cc1)NC(=O)c1cc(Cl)ccc1[O-] ZINC001136748177 1049862183 /nfs/dbraw/zinc/86/21/83/1049862183.db2.gz DZFGPVCSTCUZEH-CQSZACIVSA-N -1 1 338.234 4.450 20 0 EIADMM O=C(N=c1cc(-c2cccs2)[n-][nH]1)c1cc(Cl)ccc1Cl ZINC000617365544 1049982417 /nfs/dbraw/zinc/98/24/17/1049982417.db2.gz SUPZMEZUCKDSKY-UHFFFAOYSA-N -1 1 338.219 4.119 20 0 EIADMM Cc1nc([C@H](C)[N@H+]2CC[C@@](C)(C(=O)[O-])C2)oc1-c1ccc(Cl)cc1 ZINC000263571520 1049995719 /nfs/dbraw/zinc/99/57/19/1049995719.db2.gz JMOUNCCPEQSCDO-KPZWWZAWSA-N -1 1 348.830 4.161 20 0 EIADMM COc1cc(C(=O)N2CCCC3(CCCC3)CC2)cc(Cl)c1[O-] ZINC000617565881 1050055370 /nfs/dbraw/zinc/05/53/70/1050055370.db2.gz KJTAHRTVFWTVQZ-UHFFFAOYSA-N -1 1 337.847 4.241 20 0 EIADMM COc1ccc([N-]S(=O)(=O)c2cccc(F)c2C)cc1C(C)C ZINC001185836184 1050168262 /nfs/dbraw/zinc/16/82/62/1050168262.db2.gz HDMVSENGUDOXEZ-UHFFFAOYSA-N -1 1 337.416 4.067 20 0 EIADMM FC(F)(F)c1cnc(-c2nc(-c3ccc4ccccc4c3)no2)[n-]1 ZINC001212689879 1050228520 /nfs/dbraw/zinc/22/85/20/1050228520.db2.gz QYEQHBQVGWVRFT-UHFFFAOYSA-N -1 1 330.269 4.299 20 0 EIADMM FC(F)(F)c1c[n-]c(-c2nc(-c3ccc4ccccc4c3)no2)n1 ZINC001212689879 1050228523 /nfs/dbraw/zinc/22/85/23/1050228523.db2.gz QYEQHBQVGWVRFT-UHFFFAOYSA-N -1 1 330.269 4.299 20 0 EIADMM Cc1cc(Cl)cc(Cl)c1CNC(=O)c1ccc([O-])c(F)c1 ZINC001186237153 1050266014 /nfs/dbraw/zinc/26/60/14/1050266014.db2.gz QSCLHBBCSIXNIS-UHFFFAOYSA-N -1 1 328.170 4.077 20 0 EIADMM COc1cccc(CNC(=O)Nc2cc(Cl)c(Cl)cc2[O-])c1 ZINC001186207729 1050271266 /nfs/dbraw/zinc/27/12/66/1050271266.db2.gz QBSYHZQPMWECPA-UHFFFAOYSA-N -1 1 341.194 4.029 20 0 EIADMM O=C(Nc1cc(-c2ccccc2)cc(Cl)n1)c1ccc([O-])cc1F ZINC001186319419 1050284136 /nfs/dbraw/zinc/28/41/36/1050284136.db2.gz VLLBEMDGVPNWQW-UHFFFAOYSA-N -1 1 342.757 4.499 20 0 EIADMM O=S(=O)([N-][C@H](c1ccccc1)C1CCC1)c1cc2ccccc2o1 ZINC001186679075 1050397274 /nfs/dbraw/zinc/39/72/74/1050397274.db2.gz TWZLHBGLNUFRDB-LJQANCHMSA-N -1 1 341.432 4.253 20 0 EIADMM Nc1cc(Nc2c([O-])c(Br)ccc2Cl)ccc1F ZINC001212347685 1050466627 /nfs/dbraw/zinc/46/66/27/1050466627.db2.gz ZPCOEYKNXJCVSF-UHFFFAOYSA-N -1 1 331.572 4.273 20 0 EIADMM O=C(Nc1cccc(Br)c1)Nc1c(F)cc([O-])cc1F ZINC001187470428 1050548020 /nfs/dbraw/zinc/54/80/20/1050548020.db2.gz ZZEJWJAWVCCFKN-UHFFFAOYSA-N -1 1 343.127 4.077 20 0 EIADMM CS(=O)(=O)c1ccc([O-])c(Nc2ccc(-c3ccccc3)cc2)c1 ZINC001173809691 1050580029 /nfs/dbraw/zinc/58/00/29/1050580029.db2.gz PZGWNHPBHPYXMB-UHFFFAOYSA-N -1 1 339.416 4.206 20 0 EIADMM O=C(Nc1c2ccccc2[nH]c1-c1ccccc1)c1cncc([O-])c1 ZINC001179083139 1050627429 /nfs/dbraw/zinc/62/74/29/1050627429.db2.gz WDZSECFFQLNOLE-UHFFFAOYSA-N -1 1 329.359 4.188 20 0 EIADMM CCS(=O)(=O)c1ccc([O-])c(Nc2ccc(C(C)(C)C)cc2)c1 ZINC001173880826 1050635815 /nfs/dbraw/zinc/63/58/15/1050635815.db2.gz RFGKLXUFFJSWGY-UHFFFAOYSA-N -1 1 333.453 4.227 20 0 EIADMM CN(C)C(=O)c1cccc(Nc2cc(Cl)cc(Cl)c2[O-])c1 ZINC001174086018 1050760811 /nfs/dbraw/zinc/76/08/11/1050760811.db2.gz ITJZQTSXWLYLHA-UHFFFAOYSA-N -1 1 325.195 4.144 20 0 EIADMM O=C(Nc1ccc(-n2cccc2)cc1)c1ccc([O-])c(C(F)(F)F)c1 ZINC001188562782 1050792393 /nfs/dbraw/zinc/79/23/93/1050792393.db2.gz IRVARVPBKRUMIN-UHFFFAOYSA-N -1 1 346.308 4.454 20 0 EIADMM CC1CCN(C(=O)c2ccc(Nc3cc(F)c([O-])cc3F)cc2)CC1 ZINC001174159678 1050800673 /nfs/dbraw/zinc/80/06/73/1050800673.db2.gz JCPOLYOOLKORHH-UHFFFAOYSA-N -1 1 346.377 4.286 20 0 EIADMM O=C(c1cccc(Nc2cc(F)c([O-])cc2F)c1)N1CCCCC1 ZINC001174175694 1050816714 /nfs/dbraw/zinc/81/67/14/1050816714.db2.gz RLVKBZRJTANVER-UHFFFAOYSA-N -1 1 332.350 4.040 20 0 EIADMM Cc1ccc(Cl)cc1NC(=O)Nc1ccc(-n2ccc(=O)[n-]2)cc1 ZINC001188734731 1050837052 /nfs/dbraw/zinc/83/70/52/1050837052.db2.gz FPYLKBAAULMNLD-UHFFFAOYSA-N -1 1 342.786 4.184 20 0 EIADMM O=C([N-]c1ccccc1SC(F)F)c1ccc([N+](=O)[O-])s1 ZINC000070748516 1050839329 /nfs/dbraw/zinc/83/93/29/1050839329.db2.gz GVVBDSUSIBHTKS-UHFFFAOYSA-N -1 1 330.337 4.223 20 0 EIADMM CN(Cc1csc(Br)c1)Cc1ccc([O-])c(F)c1F ZINC001179966026 1050850912 /nfs/dbraw/zinc/85/09/12/1050850912.db2.gz DIKABRUMBPTJOU-UHFFFAOYSA-N -1 1 348.212 4.126 20 0 EIADMM O=C(Nc1cccc(C(F)(F)F)c1[O-])c1cccc(-c2cnco2)c1 ZINC001188957063 1050871719 /nfs/dbraw/zinc/87/17/19/1050871719.db2.gz SHFUAPMLWVMFQR-UHFFFAOYSA-N -1 1 348.280 4.318 20 0 EIADMM O=S(=O)(CCc1ccc(Cl)cc1)[N-]c1ccc(Cl)s1 ZINC001189075088 1050903339 /nfs/dbraw/zinc/90/33/39/1050903339.db2.gz DJUVGYDOYRBZSM-UHFFFAOYSA-N -1 1 336.265 4.039 20 0 EIADMM Cc1c(=O)[n-]c(SCC(=O)c2ccsc2)nc1-c1ccccc1 ZINC001189103749 1050910502 /nfs/dbraw/zinc/91/05/02/1050910502.db2.gz NIFCKQZMPMZZGK-UHFFFAOYSA-N -1 1 342.445 4.194 20 0 EIADMM Fc1cc(C(F)(F)F)ccc1[N-]c1nnc(Br)s1 ZINC001174401353 1050919546 /nfs/dbraw/zinc/91/95/46/1050919546.db2.gz YJIADACNCBGQNJ-UHFFFAOYSA-N -1 1 342.115 4.202 20 0 EIADMM COC(=O)c1ccc(Nc2cc(Cl)cc(Cl)c2[O-])cc1OC ZINC001174430459 1050962093 /nfs/dbraw/zinc/96/20/93/1050962093.db2.gz ZABROZUSIGMCAY-UHFFFAOYSA-N -1 1 342.178 4.238 20 0 EIADMM Cc1cc(C)cc(OCC(=O)Nc2cccc(C(F)(F)F)c2[O-])c1 ZINC001180540617 1051027622 /nfs/dbraw/zinc/02/76/22/1051027622.db2.gz VFAPRPLGRRNBMC-UHFFFAOYSA-N -1 1 339.313 4.045 20 0 EIADMM CC(C)(C)c1cc([N-]S(=O)(=O)CCCF)c(O)c(C(C)(C)C)c1 ZINC001189915730 1051078725 /nfs/dbraw/zinc/07/87/25/1051078725.db2.gz OPRCCEZXMSFQBC-UHFFFAOYSA-N -1 1 345.480 4.089 20 0 EIADMM CCC(C)(C)c1ccc(S(=O)(=O)[N-]c2ccc3ocnc3c2)cc1 ZINC001190444454 1051174666 /nfs/dbraw/zinc/17/46/66/1051174666.db2.gz FWCZXVZPDATPKI-UHFFFAOYSA-N -1 1 344.436 4.316 20 0 EIADMM O=S(=O)([N-]c1ccc2ccc(O)cc2c1)c1ccc(C2CC2)cc1 ZINC001190501127 1051196790 /nfs/dbraw/zinc/19/67/90/1051196790.db2.gz WTKJHGLBWBVQDE-UHFFFAOYSA-N -1 1 339.416 4.224 20 0 EIADMM COc1cc(C(=O)Nc2ccc(OC(C)C)cc2)cc(Cl)c1[O-] ZINC000153598735 1051202576 /nfs/dbraw/zinc/20/25/76/1051202576.db2.gz KJOVZPKTXDGDRE-UHFFFAOYSA-N -1 1 335.787 4.094 20 0 EIADMM O=C(Nc1ccccc1OC(F)(F)F)Nc1ccc([O-])c(F)c1F ZINC001190682495 1051255659 /nfs/dbraw/zinc/25/56/59/1051255659.db2.gz ZZAZRLLOHDAIQA-UHFFFAOYSA-N -1 1 348.227 4.213 20 0 EIADMM O=C(Nc1ccc(OC(F)(F)F)cc1)Nc1cc(F)c(F)cc1[O-] ZINC001190745625 1051268751 /nfs/dbraw/zinc/26/87/51/1051268751.db2.gz IKOCSXNSOBHJKD-UHFFFAOYSA-N -1 1 348.227 4.213 20 0 EIADMM O=c1ccn(-c2ccc(Nc3ccc(F)c(C(F)(F)F)c3)cc2)[n-]1 ZINC001175075238 1051363880 /nfs/dbraw/zinc/36/38/80/1051363880.db2.gz KJBBWEMHBVQYJX-UHFFFAOYSA-N -1 1 337.276 4.479 20 0 EIADMM CCC1(NC(=O)c2cc(Cl)c([O-])c(OC)c2)CCC(F)(F)CC1 ZINC001191157699 1051369600 /nfs/dbraw/zinc/36/96/00/1051369600.db2.gz AHVBOANTICXZHR-UHFFFAOYSA-N -1 1 347.789 4.142 20 0 EIADMM CC[C@H](C)C[C@@H](C)NC(=O)c1ccccc1C(=O)c1ccc([O-])cc1 ZINC001191511176 1051472710 /nfs/dbraw/zinc/47/27/10/1051472710.db2.gz YKMOLNMTCPOZAS-LSDHHAIUSA-N -1 1 339.435 4.178 20 0 EIADMM Cc1ccc(Cl)c(NC(=O)Nc2cc(=O)n(-c3ccccc3)[n-]2)c1 ZINC001191676237 1051504279 /nfs/dbraw/zinc/50/42/79/1051504279.db2.gz JUAOCXGGEPJVKC-UHFFFAOYSA-N -1 1 342.786 4.184 20 0 EIADMM O=S(=O)(Cc1ccc(Cl)cc1F)[N-]c1cccc2occc21 ZINC001191905554 1051583315 /nfs/dbraw/zinc/58/33/15/1051583315.db2.gz YWPQBNCBNQKSFS-UHFFFAOYSA-N -1 1 339.775 4.167 20 0 EIADMM CCc1cccc([N-]S(=O)(=O)c2ccc3cc(OC)ccc3c2)c1 ZINC001191963896 1051601499 /nfs/dbraw/zinc/60/14/99/1051601499.db2.gz WOBBLLFOWFIRBX-UHFFFAOYSA-N -1 1 341.432 4.212 20 0 EIADMM Cc1cc(Nc2ccc(F)c(Br)c2[O-])cc2c[nH]nc21 ZINC001175519453 1051646438 /nfs/dbraw/zinc/64/64/38/1051646438.db2.gz KYJNMXSCTYNUOC-UHFFFAOYSA-N -1 1 336.164 4.222 20 0 EIADMM CC(C)[C@@H]1CN(C(=O)Cc2ccc([O-])c(Cl)c2)c2ccccc2N1 ZINC001182864211 1051725728 /nfs/dbraw/zinc/72/57/28/1051725728.db2.gz UDAMGWQEDBYVCZ-INIZCTEOSA-N -1 1 344.842 4.071 20 0 EIADMM CSc1ccc([O-])c(C(=O)Nc2nc3c(ccc(F)c3C)s2)c1 ZINC001183006591 1051761977 /nfs/dbraw/zinc/76/19/77/1051761977.db2.gz APIBVAWJEAREKB-UHFFFAOYSA-N -1 1 348.424 4.424 20 0 EIADMM CC(C)Cc1ccc([C@H](C)NC(=O)c2cc([O-])cc(F)c2F)cc1 ZINC001192684633 1051792413 /nfs/dbraw/zinc/79/24/13/1051792413.db2.gz RPBPKPAFFMVZRB-LBPRGKRZSA-N -1 1 333.378 4.360 20 0 EIADMM CCCc1nc2ccc(NC(=O)c3cc([O-])cc(F)c3F)cc2o1 ZINC001192664850 1051797257 /nfs/dbraw/zinc/79/72/57/1051797257.db2.gz HBNGYKHANNNMPY-UHFFFAOYSA-N -1 1 332.306 4.016 20 0 EIADMM CCCn1nc(C)cc1Nc1c(Cl)ccc(Br)c1[O-] ZINC001175807607 1051804026 /nfs/dbraw/zinc/80/40/26/1051804026.db2.gz QYUZNCOGPRGHCS-UHFFFAOYSA-N -1 1 344.640 4.467 20 0 EIADMM C[C@@H](Oc1cccc(C(C)(C)C)c1)C(=O)Nc1nc(Cl)ccc1[O-] ZINC001183210280 1051811612 /nfs/dbraw/zinc/81/16/12/1051811612.db2.gz UGVWIKRJEPNAJF-LLVKDONJSA-N -1 1 348.830 4.144 20 0 EIADMM CC1(C)CCC[C@H]1CC[N-]S(=O)(=O)c1cc2cc(F)ccc2o1 ZINC001192855644 1051825270 /nfs/dbraw/zinc/82/52/70/1051825270.db2.gz BDEPWLYRAPEDMC-ZDUSSCGKSA-N -1 1 339.432 4.067 20 0 EIADMM CCCCOc1ccc(C(=O)N2CCc3cc(C)c(C)cc32)c([O-])c1 ZINC001183424273 1051842043 /nfs/dbraw/zinc/84/20/43/1051842043.db2.gz NZJPFXPEIHZNJK-UHFFFAOYSA-N -1 1 339.435 4.391 20 0 EIADMM CCS(=O)(=O)c1ccc([O-])c(Nc2ccc(F)c3ccccc23)c1 ZINC001175955680 1051865480 /nfs/dbraw/zinc/86/54/80/1051865480.db2.gz ODLRZRXJKRXKSS-UHFFFAOYSA-N -1 1 345.395 4.222 20 0 EIADMM CC(C)(C)c1nnc([N-]C(=O)c2c(F)ccc(F)c2Cl)s1 ZINC000621704496 1051914086 /nfs/dbraw/zinc/91/40/86/1051914086.db2.gz UHQHGCRVXWCTRK-UHFFFAOYSA-N -1 1 331.775 4.020 20 0 EIADMM CC(=O)c1sc(-c2ccccc2)cc1[N-]S(=O)(=O)CC1CCC1 ZINC001193471447 1051929077 /nfs/dbraw/zinc/92/90/77/1051929077.db2.gz QONPZGPLKAIYRZ-UHFFFAOYSA-N -1 1 349.477 4.160 20 0 EIADMM O=C1CCc2cc(Nc3ccc(F)c(Br)c3[O-])ccc21 ZINC001176239742 1051970821 /nfs/dbraw/zinc/97/08/21/1051970821.db2.gz QLZDIBFLSKZYPH-UHFFFAOYSA-N -1 1 336.160 4.166 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccccc2[C@H](C)O)c2ccccc12 ZINC001193864384 1052018927 /nfs/dbraw/zinc/01/89/27/1052018927.db2.gz YNDRSWIAOYGSPA-AWEZNQCLSA-N -1 1 341.432 4.002 20 0 EIADMM CC(C)(C)c1nc([N-]c2cccc3c2cnn3[C@H]2CCCCO2)no1 ZINC001176314841 1052019817 /nfs/dbraw/zinc/01/98/17/1052019817.db2.gz DPKUAEAMZBFFFG-OAHLLOKOSA-N -1 1 341.415 4.160 20 0 EIADMM CCc1c(Cl)cc(Nc2ccc3c(c2)CC(=O)N3)c([O-])c1Cl ZINC001176433732 1052055051 /nfs/dbraw/zinc/05/50/51/1052055051.db2.gz YRBGCMIPOXXWIG-UHFFFAOYSA-N -1 1 337.206 4.500 20 0 EIADMM CC(C)c1ccc(Cl)c(S(=O)(=O)[N-]c2c(O)cccc2F)c1 ZINC000671166651 1052088428 /nfs/dbraw/zinc/08/84/28/1052088428.db2.gz AFISVGFJDQEBOY-UHFFFAOYSA-N -1 1 343.807 4.109 20 0 EIADMM O=C(OCc1cc(-c2ccc(Cl)cc2)no1)c1ccc([O-])cc1F ZINC000773580466 1052114228 /nfs/dbraw/zinc/11/42/28/1052114228.db2.gz IJDKAONRNAESGX-UHFFFAOYSA-N -1 1 347.729 4.197 20 0 EIADMM CCS(=O)(=O)c1ccc([O-])c(Nc2ccc(OC(C)(C)C)cc2)c1 ZINC001176638759 1052149123 /nfs/dbraw/zinc/14/91/23/1052149123.db2.gz VHJRGEWTJKTXML-UHFFFAOYSA-N -1 1 349.452 4.107 20 0 EIADMM CCc1ncc(Br)cc1Nc1c(F)cc(F)c([O-])c1F ZINC001176669869 1052157256 /nfs/dbraw/zinc/15/72/56/1052157256.db2.gz NKUPPKCENAOLGO-UHFFFAOYSA-N -1 1 347.134 4.273 20 0 EIADMM [O-]c1c(F)cc(F)c(Nc2ccc(Br)cc2O)c1F ZINC001176669137 1052157738 /nfs/dbraw/zinc/15/77/38/1052157738.db2.gz DUGABQYBKSLFHI-UHFFFAOYSA-N -1 1 334.091 4.021 20 0 EIADMM CC1(C)CC(=O)Nc2cc(Nc3c(F)cc(F)c([O-])c3F)ccc21 ZINC001176670649 1052158196 /nfs/dbraw/zinc/15/81/96/1052158196.db2.gz JJEAOCCNPDLMHY-UHFFFAOYSA-N -1 1 336.313 4.173 20 0 EIADMM COc1cc(Br)cc(Nc2c(F)cc(F)c([O-])c2F)c1 ZINC001176673248 1052159268 /nfs/dbraw/zinc/15/92/68/1052159268.db2.gz QEPSPTISARWPAD-UHFFFAOYSA-N -1 1 348.118 4.324 20 0 EIADMM CCOC(=O)c1cc(F)c(F)cc1Nc1c(F)cc(F)c([O-])c1F ZINC001176673116 1052159978 /nfs/dbraw/zinc/15/99/78/1052159978.db2.gz DWHPNWZJIKSAMB-UHFFFAOYSA-N -1 1 347.239 4.008 20 0 EIADMM COc1cc(Nc2c(F)cc(F)c([O-])c2F)ccc1-c1cnco1 ZINC001176672875 1052160284 /nfs/dbraw/zinc/16/02/84/1052160284.db2.gz MTWBYWVFCBLDKA-UHFFFAOYSA-N -1 1 336.269 4.217 20 0 EIADMM CC1(C)CC(=O)Nc2ccc(Nc3c(F)cc(F)c([O-])c3F)cc21 ZINC001176673422 1052161246 /nfs/dbraw/zinc/16/12/46/1052161246.db2.gz GOFFHTKUACTALO-UHFFFAOYSA-N -1 1 336.313 4.173 20 0 EIADMM COCCCNc1cccc(F)c1Nc1c(F)cc(F)c([O-])c1F ZINC001176674767 1052161388 /nfs/dbraw/zinc/16/13/88/1052161388.db2.gz VNHGQUGGARVBOD-UHFFFAOYSA-N -1 1 344.308 4.141 20 0 EIADMM Cc1cccc(C)c1S(=O)(=O)[N-]c1cccc(OC(C)(C)C)c1 ZINC001194642444 1052184085 /nfs/dbraw/zinc/18/40/85/1052184085.db2.gz ISYYCLJTRNEZKZ-UHFFFAOYSA-N -1 1 333.453 4.282 20 0 EIADMM Cc1cc(Cl)cc([N-]S(=O)(=O)c2ccc(-c3cnco3)cc2)c1 ZINC001185221091 1052196905 /nfs/dbraw/zinc/19/69/05/1052196905.db2.gz HUGXUHFOHXWYPU-UHFFFAOYSA-N -1 1 348.811 4.104 20 0 EIADMM CC(C)(C)C[C@H]1CCCN1C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000622337008 1052215617 /nfs/dbraw/zinc/21/56/17/1052215617.db2.gz JRKOJYUIUFPFDQ-GFCCVEGCSA-N -1 1 329.362 4.452 20 0 EIADMM O=S(=O)([N-]c1cccc(F)c1Cl)c1cc2ccccc2s1 ZINC001185455179 1052244201 /nfs/dbraw/zinc/24/42/01/1052244201.db2.gz XZDUKUXBEVWSTJ-UHFFFAOYSA-N -1 1 341.816 4.495 20 0 EIADMM CC(C)c1ccc(-c2nc(CN3CCC[C@H](C(=O)[O-])C3)cs2)cc1 ZINC000164535352 1052261120 /nfs/dbraw/zinc/26/11/20/1052261120.db2.gz DXRBVSMXLCBNOQ-INIZCTEOSA-N -1 1 344.480 4.230 20 0 EIADMM O=C(Nc1cc(Cl)ncc1[O-])Nc1cc(C(F)(F)F)ccc1F ZINC001185590115 1052268622 /nfs/dbraw/zinc/26/86/22/1052268622.db2.gz LQWCHNZKCAGREL-UHFFFAOYSA-N -1 1 349.671 4.243 20 0 EIADMM COc1cc(NC(=O)c2ccc(C(F)(F)F)cc2[O-])c(C)cc1C ZINC000622575986 1052342876 /nfs/dbraw/zinc/34/28/76/1052342876.db2.gz JJBWTPHEZPTMEH-UHFFFAOYSA-N -1 1 339.313 4.289 20 0 EIADMM CC(C)c1ccc(C(=O)Nc2ncc(C3CCOCC3)s2)c([O-])c1 ZINC000622643470 1052368964 /nfs/dbraw/zinc/36/89/64/1052368964.db2.gz ZGHIZVMPJFUBQI-UHFFFAOYSA-N -1 1 346.452 4.118 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cnc([C@@H]4CCCO4)s3)n2)c(Cl)c1 ZINC000350810826 1052767876 /nfs/dbraw/zinc/76/78/76/1052767876.db2.gz ASWRLGKRWFQSPF-NSHDSACASA-N -1 1 349.799 4.071 20 0 EIADMM C[C@H]1CC(=O)N(C)c2ccc(NCc3cccc([O-])c3Cl)cc21 ZINC000623792547 1052805241 /nfs/dbraw/zinc/80/52/41/1052805241.db2.gz WRUGIHIVJHEFJM-NSHDSACASA-N -1 1 330.815 4.128 20 0 EIADMM Cc1onc(-c2c(Cl)cccc2Cl)c1C(=O)[N-]c1cnoc1 ZINC000623940511 1052840199 /nfs/dbraw/zinc/84/01/99/1052840199.db2.gz IYCTZMMXOVIPRB-UHFFFAOYSA-N -1 1 338.150 4.197 20 0 EIADMM Cc1noc(-c2ccccc2)c1[N-]C(=O)c1ccc(Br)o1 ZINC000183368003 1052971920 /nfs/dbraw/zinc/97/19/20/1052971920.db2.gz WAUPLVBXWJINNB-UHFFFAOYSA-N -1 1 347.168 4.258 20 0 EIADMM O=c1cc(C2CC2)nc(SCc2nc3ccccc3n2C(F)F)[n-]1 ZINC000195084160 1053051329 /nfs/dbraw/zinc/05/13/29/1053051329.db2.gz CMZYCJYGCUEOKE-UHFFFAOYSA-N -1 1 348.378 4.097 20 0 EIADMM Cc1ccc2c([N-]S(=O)(=O)c3cccc(C(C)C)c3)cccc2n1 ZINC001195156776 1053307916 /nfs/dbraw/zinc/30/79/16/1053307916.db2.gz QEOZPXOODSGSTP-UHFFFAOYSA-N -1 1 340.448 4.467 20 0 EIADMM CC(=O)c1cccc([N-]S(=O)(=O)c2cccc(C(C)C)c2)c1C ZINC001195158971 1053308722 /nfs/dbraw/zinc/30/87/22/1053308722.db2.gz IZWZIEOTYKFXOP-UHFFFAOYSA-N -1 1 331.437 4.122 20 0 EIADMM Cc1ccc([O-])c(C(=O)Nc2ccccc2-c2ccc(F)c(F)c2)n1 ZINC001195327065 1053361441 /nfs/dbraw/zinc/36/14/41/1053361441.db2.gz WVPGVZIKIKTFDP-UHFFFAOYSA-N -1 1 340.329 4.293 20 0 EIADMM Cc1c(NC(=O)c2cc([O-])cnc2Cl)snc1-c1ccccc1 ZINC001195299367 1053369233 /nfs/dbraw/zinc/36/92/33/1053369233.db2.gz NXGOXXYGECOZCI-UHFFFAOYSA-N -1 1 345.811 4.125 20 0 EIADMM CCOC(=O)NC(=S)[N-]c1cc(Cl)cc(Cl)c1Cl ZINC001195491149 1053422539 /nfs/dbraw/zinc/42/25/39/1053422539.db2.gz SPYLFFKSOGYVDF-UHFFFAOYSA-N -1 1 327.620 4.090 20 0 EIADMM C[C@H](CC(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)c1ccccc1F ZINC000338933272 1053442744 /nfs/dbraw/zinc/44/27/44/1053442744.db2.gz JODFELVWZDZMQU-GFCCVEGCSA-N -1 1 339.370 4.054 20 0 EIADMM CCc1nc(SCc2c(Cl)cncc2Cl)[n-]c(=O)c1C ZINC000865370210 1053484668 /nfs/dbraw/zinc/48/46/68/1053484668.db2.gz JJLPAECLDCIZKZ-UHFFFAOYSA-N -1 1 330.240 4.047 20 0 EIADMM O=C([N-]c1csc2cnccc12)c1snc(Cl)c1Cl ZINC001196334669 1053642213 /nfs/dbraw/zinc/64/22/13/1053642213.db2.gz ZZYNKUUGSIZHQZ-UHFFFAOYSA-N -1 1 330.221 4.312 20 0 EIADMM O=C(Nc1ccc(OCC2CCCCC2)cc1)c1ccc(O)cc1[O-] ZINC001626030177 1053642129 /nfs/dbraw/zinc/64/21/29/1053642129.db2.gz RVTRWZQEFJWLIF-UHFFFAOYSA-N -1 1 341.407 4.309 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1ccc(Cl)c2cccnc12 ZINC000111666566 1053720573 /nfs/dbraw/zinc/72/05/73/1053720573.db2.gz RNLDLXXDKNSQIY-UHFFFAOYSA-N -1 1 333.174 4.500 20 0 EIADMM [O-]c1c(F)cccc1NC(=S)Nc1ccccc1Br ZINC001197787701 1053996828 /nfs/dbraw/zinc/99/68/28/1053996828.db2.gz YCTYVJFHLUOKGS-UHFFFAOYSA-N -1 1 341.205 4.103 20 0 EIADMM CN(CCCOc1ccccc1)C(=O)c1cc2ccccc2cc1[O-] ZINC000031365535 1054066572 /nfs/dbraw/zinc/06/65/72/1054066572.db2.gz NRGIIGWGWGIXIT-UHFFFAOYSA-N -1 1 335.403 4.087 20 0 EIADMM C[C@H](C(=O)[N-]OCCCC(F)(F)F)c1ccc(C(F)(F)F)cc1 ZINC000871215436 1054168853 /nfs/dbraw/zinc/16/88/53/1054168853.db2.gz BMBCFOBXLMTQHX-VIFPVBQESA-N -1 1 343.267 4.199 20 0 EIADMM Cc1c(NC(=O)c2ccc(C(F)(F)F)cc2[O-])cccc1N(C)C ZINC000857480782 1054268706 /nfs/dbraw/zinc/26/87/06/1054268706.db2.gz PCHHSUNZXUCUBX-UHFFFAOYSA-N -1 1 338.329 4.038 20 0 EIADMM CC(C)Oc1ccc([N-]S(=O)(=O)c2ccc3occc3c2)cc1F ZINC001198871162 1054295642 /nfs/dbraw/zinc/29/56/42/1054295642.db2.gz YEQBLFJUUNXXEP-UHFFFAOYSA-N -1 1 349.383 4.160 20 0 EIADMM COc1ccc(S(=O)(=O)[N-]c2ccc(F)c3ccccc23)c(C)c1 ZINC001198951207 1054319777 /nfs/dbraw/zinc/31/97/77/1054319777.db2.gz QMZQSYPYNQEIOQ-UHFFFAOYSA-N -1 1 345.395 4.097 20 0 EIADMM O=c1nc(N[C@H]2C[C@H](c3ccc(C(F)(F)F)cc3)C2)cc(Cl)[n-]1 ZINC000858526362 1054507804 /nfs/dbraw/zinc/50/78/04/1054507804.db2.gz ZTEFHCPIRBBAMX-HOMQSWHASA-N -1 1 343.736 4.213 20 0 EIADMM C[C@@H]1C[C@@H](c2ccccc2F)N(C(=O)Cc2ccc([O-])c(Cl)c2)C1 ZINC001137070304 1054522353 /nfs/dbraw/zinc/52/23/53/1054522353.db2.gz AKFIDWNELDKMGG-PXAZEXFGSA-N -1 1 347.817 4.337 20 0 EIADMM Cc1ccc(CN2CCC(c3ccccc3C(=O)[O-])CC2)nc1Cl ZINC000873640268 1054583493 /nfs/dbraw/zinc/58/34/93/1054583493.db2.gz BJPOQKYDWZECRI-UHFFFAOYSA-N -1 1 344.842 4.121 20 0 EIADMM Cc1ccc(-c2n[n-]c(=S)n2CCC(=O)Nc2ccsc2)cc1 ZINC000125172336 1054733064 /nfs/dbraw/zinc/73/30/64/1054733064.db2.gz IRVGRCFVIPVYSC-UHFFFAOYSA-N -1 1 344.465 4.006 20 0 EIADMM CN(C)C(=O)c1cc(F)cc(Nc2cc(Cl)c([O-])cc2Cl)c1 ZINC001201526524 1054844343 /nfs/dbraw/zinc/84/43/43/1054844343.db2.gz ABMVGWZKPGNBKT-UHFFFAOYSA-N -1 1 343.185 4.284 20 0 EIADMM [O-]c1cc(F)cc(F)c1Nc1cncc(OCc2ccccc2)c1 ZINC001201625630 1054867998 /nfs/dbraw/zinc/86/79/98/1054867998.db2.gz HSVKRGFNIILEKU-UHFFFAOYSA-N -1 1 328.318 4.388 20 0 EIADMM CCC1=NO[C@@H](c2nc(=O)c3c(-c4ccc(C)s4)csc3[n-]2)C1 ZINC000126614996 1055091626 /nfs/dbraw/zinc/09/16/26/1055091626.db2.gz PFNMZWGLSJJNNG-LLVKDONJSA-N -1 1 345.449 4.249 20 0 EIADMM O=C(Nc1ccc(Br)cc1)Nc1c(F)cc([O-])cc1F ZINC001202335461 1055144261 /nfs/dbraw/zinc/14/42/61/1055144261.db2.gz BQPZRDFSHIPUPB-UHFFFAOYSA-N -1 1 343.127 4.077 20 0 EIADMM O=C(Nc1ccc(C(F)(F)F)cc1)Nc1cc(F)c(F)cc1[O-] ZINC001202412282 1055162774 /nfs/dbraw/zinc/16/27/74/1055162774.db2.gz MFAZNLITEJSYLQ-UHFFFAOYSA-N -1 1 332.228 4.333 20 0 EIADMM COc1ccc(NC(=O)Nc2cc(Cl)c(Cl)cc2[O-])cc1 ZINC001202392650 1055168610 /nfs/dbraw/zinc/16/86/10/1055168610.db2.gz JVCDMHHXBNCIOJ-UHFFFAOYSA-N -1 1 327.167 4.352 20 0 EIADMM O=C([N-]c1nc(-c2ccccc2)ns1)c1conc1C1CCCC1 ZINC000878321374 1055243602 /nfs/dbraw/zinc/24/36/02/1055243602.db2.gz PELQNCDPSJSDOI-UHFFFAOYSA-N -1 1 340.408 4.103 20 0 EIADMM [O-]c1c(F)cc(NC(=S)Nc2ccccc2C(F)(F)F)cc1F ZINC000169148624 1055672428 /nfs/dbraw/zinc/67/24/28/1055672428.db2.gz GTAPXYLCRVWOPJ-UHFFFAOYSA-N -1 1 348.296 4.498 20 0 EIADMM CC(C)Sc1ccccc1C(=O)N=c1cc(-c2cccs2)[n-][nH]1 ZINC000542689858 1055831916 /nfs/dbraw/zinc/83/19/16/1055831916.db2.gz XVZNQOFRUQKWFL-UHFFFAOYSA-N -1 1 343.477 4.313 20 0 EIADMM CC(=O)c1cc(-c2nc(-c3cc(C)ccc3-c3ccccc3)no2)n[n-]1 ZINC001212430090 1055937156 /nfs/dbraw/zinc/93/71/56/1055937156.db2.gz ZOLAWBSBPNGDJK-UHFFFAOYSA-N -1 1 344.374 4.305 20 0 EIADMM CC(=O)c1cc(-c2nc(-c3cc(C)ccc3-c3ccccc3)no2)[n-]n1 ZINC001212430090 1055937167 /nfs/dbraw/zinc/93/71/67/1055937167.db2.gz ZOLAWBSBPNGDJK-UHFFFAOYSA-N -1 1 344.374 4.305 20 0 EIADMM Cc1ccc(Br)c(Nc2cc(F)c([O-])c(Cl)c2)n1 ZINC001214479858 1056700586 /nfs/dbraw/zinc/70/05/86/1056700586.db2.gz HALPKLDMCNHCJQ-UHFFFAOYSA-N -1 1 331.572 4.394 20 0 EIADMM Cc1cc(N2CCCCCC2)ccc1NC(=O)c1ccc([O-])c(F)c1 ZINC000672161575 1056732190 /nfs/dbraw/zinc/73/21/90/1056732190.db2.gz LYEBDKYGGXZPKC-UHFFFAOYSA-N -1 1 342.414 4.472 20 0 EIADMM CSc1ccccc1[N-]S(=O)(=O)c1ccc2c(c1)CCCC2 ZINC000007056701 1056764035 /nfs/dbraw/zinc/76/40/35/1056764035.db2.gz JHOCEHQPIOILBI-UHFFFAOYSA-N -1 1 333.478 4.088 20 0 EIADMM O=C(CCc1ncc(-c2ccccc2)o1)Nc1ccc([O-])c(Cl)c1 ZINC000111665924 1056812014 /nfs/dbraw/zinc/81/20/14/1056812014.db2.gz HADDRXCTXDMGCT-UHFFFAOYSA-N -1 1 342.782 4.272 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1cnc(-c2ccccc2)s1 ZINC000111666493 1056812318 /nfs/dbraw/zinc/81/23/18/1056812318.db2.gz BZCPYMKVBDYYBD-UHFFFAOYSA-N -1 1 330.796 4.421 20 0 EIADMM CSc1ccccc1S(=O)(=O)[N-]c1ccc(F)c(C2CC2)c1 ZINC000499501809 1056820613 /nfs/dbraw/zinc/82/06/13/1056820613.db2.gz BBJORHHBWVJOCM-UHFFFAOYSA-N -1 1 337.441 4.226 20 0 EIADMM CC(=O)c1ccc([O-])c(CCOC(=O)C=Cc2ccc(Cl)cc2)c1 ZINC000744491764 1059532165 /nfs/dbraw/zinc/53/21/65/1059532165.db2.gz WZBROWUYFMEVJJ-WTKPLQERSA-N -1 1 344.794 4.047 20 0 EIADMM CC(=O)c1ccc([O-])c(CCOC(=O)CCCc2ccc(C)cc2)c1 ZINC000744806754 1059645431 /nfs/dbraw/zinc/64/54/31/1059645431.db2.gz YJXKWKKLUXREGJ-UHFFFAOYSA-N -1 1 340.419 4.012 20 0 EIADMM O=C(Nc1ccccc1N1CCCCCC1)c1ccc([O-])cc1F ZINC000181858556 1059685049 /nfs/dbraw/zinc/68/50/49/1059685049.db2.gz JVTZIEICZSHFFG-UHFFFAOYSA-N -1 1 328.387 4.164 20 0 EIADMM CCCCCC[C@@H](C)C(=O)OCc1cc(=O)oc2cc([O-])ccc12 ZINC000745255523 1059796831 /nfs/dbraw/zinc/79/68/31/1059796831.db2.gz JEYXKZYZYXIDPS-CYBMUJFWSA-N -1 1 332.396 4.148 20 0 EIADMM O=C(Nc1ccc(-n2ccc(=O)[n-]2)cc1)C1(c2ccccc2)CCCC1 ZINC001168915299 1060519441 /nfs/dbraw/zinc/51/94/41/1060519441.db2.gz UUQDZDKPQBLORE-UHFFFAOYSA-N -1 1 347.418 4.028 20 0 EIADMM C[C@H]([N-]C(=O)C(F)(F)c1ccc(F)cc1)c1cccc(F)c1F ZINC000766630629 1060714559 /nfs/dbraw/zinc/71/45/59/1060714559.db2.gz YPEWJPOAVGHFIP-VIFPVBQESA-N -1 1 329.268 4.073 20 0 EIADMM CC(C)(C(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)C1CCCCC1 ZINC000767147864 1061129358 /nfs/dbraw/zinc/12/93/58/1061129358.db2.gz KNWWFWFHFUUOTK-UHFFFAOYSA-N -1 1 327.428 4.327 20 0 EIADMM O=C(c1ccc([O-])c(F)c1)N1CCC(CCc2ccccc2)CC1 ZINC000767292911 1061182857 /nfs/dbraw/zinc/18/28/57/1061182857.db2.gz YVRUDQKEQZEWHV-UHFFFAOYSA-N -1 1 327.399 4.016 20 0 EIADMM COc1ccc(NC(=O)c2ccc([O-])c(F)c2)cc1OC1CCCC1 ZINC000767297889 1061184589 /nfs/dbraw/zinc/18/45/89/1061184589.db2.gz CVQOHGAVQIFCDR-UHFFFAOYSA-N -1 1 345.370 4.114 20 0 EIADMM COc1ccc2cc(CNC(=O)c3cc(Cl)ccc3[O-])ccc2c1 ZINC000069741321 203045392 /nfs/dbraw/zinc/04/53/92/203045392.db2.gz NLJLQAXFUUORDO-UHFFFAOYSA-N -1 1 341.794 4.137 20 0 EIADMM CCOc1ccc(S(=O)(=O)[N-]c2ccc(F)cc2)c2ccccc12 ZINC000072027104 203158583 /nfs/dbraw/zinc/15/85/83/203158583.db2.gz QHLFTGKBBVMHJC-UHFFFAOYSA-N -1 1 345.395 4.178 20 0 EIADMM COc1cc(C(=O)N[C@H]2CCCCC23CCCC3)cc(Cl)c1[O-] ZINC000428567459 1032068446 /nfs/dbraw/zinc/06/84/46/1032068446.db2.gz BAIFXFSKJXHHAO-HNNXBMFYSA-N -1 1 337.847 4.287 20 0 EIADMM [O-]c1c(Cl)cc(Br)cc1Nc1csc(CO)c1 ZINC001176375441 1052046000 /nfs/dbraw/zinc/04/60/00/1052046000.db2.gz KGWSSBAOFGAYEF-UHFFFAOYSA-N -1 1 334.622 4.106 20 0 EIADMM CO[C@@H]1CCC[C@H](C(=O)Nc2cc(Cl)c([O-])c3ccccc23)C1 ZINC000529539035 1032428975 /nfs/dbraw/zinc/42/89/75/1032428975.db2.gz OCUQUPLPCIAYGD-NWDGAFQWSA-N -1 1 333.815 4.343 20 0 EIADMM CCc1noc(C)c1[N-]C(=O)c1c(C)onc1-c1ccccc1Cl ZINC000121007948 1032506267 /nfs/dbraw/zinc/50/62/67/1032506267.db2.gz IWTAKDLARGVADP-UHFFFAOYSA-N -1 1 345.786 4.415 20 0 EIADMM COCCCC[C@H](N=c1[n-]c(C(C)=O)c(C)s1)c1ccccc1 ZINC000450493235 1032529824 /nfs/dbraw/zinc/52/98/24/1032529824.db2.gz AQCIFQDZROKMIL-INIZCTEOSA-N -1 1 332.469 4.046 20 0 EIADMM Cc1cn(-c2ccccc2)nc1NC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000683076363 1018744252 /nfs/dbraw/zinc/74/42/52/1018744252.db2.gz YKHMXTAUYIWNKD-UHFFFAOYSA-N -1 1 342.786 4.184 20 0 EIADMM Cc1ccc(F)cc1S(=O)(=O)[N-]c1cccc(C(F)(F)F)c1C ZINC000471127282 1019027118 /nfs/dbraw/zinc/02/71/18/1019027118.db2.gz LEHQOCGZSAHHQD-UHFFFAOYSA-N -1 1 347.333 4.262 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2cccc(C(F)(F)F)c2C)cc1 ZINC000471127652 1019035392 /nfs/dbraw/zinc/03/53/92/1019035392.db2.gz QLFGIVSMVKLUGB-UHFFFAOYSA-N -1 1 329.343 4.123 20 0 EIADMM CC(C)Cc1ccc(CC(=O)Nc2ccc(-c3cc(=O)[nH][n-]3)cc2)cc1 ZINC000510075352 1019084525 /nfs/dbraw/zinc/08/45/25/1019084525.db2.gz XUFRMLRSQFOCBW-UHFFFAOYSA-N -1 1 349.434 4.162 20 0 EIADMM CN(Cc1ccccc1-c1ccccc1)C(=O)c1cc(F)ccc1[O-] ZINC001626346709 1019138924 /nfs/dbraw/zinc/13/89/24/1019138924.db2.gz YNCCYPPWFPGEPV-UHFFFAOYSA-N -1 1 335.378 4.471 20 0 EIADMM COc1cc(C(=O)N2CCCC[C@H]2c2ccccc2)cc(Cl)c1[O-] ZINC000467776395 1019341388 /nfs/dbraw/zinc/34/13/88/1019341388.db2.gz KULTUOWVWWMTAS-INIZCTEOSA-N -1 1 345.826 4.422 20 0 EIADMM C[C@@H](c1ccc2ccccc2c1)N(C(=O)c1cncc([O-])c1)C1CC1 ZINC000339819675 1019888188 /nfs/dbraw/zinc/88/81/88/1019888188.db2.gz IHNSPSOZVRJUCF-AWEZNQCLSA-N -1 1 332.403 4.306 20 0 EIADMM O=C(CSc1nccc2ccccc21)Nc1ccc([O-])c(Cl)c1 ZINC000182879387 1019953165 /nfs/dbraw/zinc/95/31/65/1019953165.db2.gz OYZZQVOKPKGFKB-UHFFFAOYSA-N -1 1 344.823 4.325 20 0 EIADMM O=C([N-]c1nc(Sc2ccccc2)ns1)c1c(F)cccc1F ZINC000109725780 1020304220 /nfs/dbraw/zinc/30/42/20/1020304220.db2.gz ZJKDZFXJJCFKCP-UHFFFAOYSA-N -1 1 349.387 4.220 20 0 EIADMM C[C@H](c1ccc(Cl)cc1Cl)S(=O)(=O)c1ccc([O-])cc1 ZINC000049488907 1020651505 /nfs/dbraw/zinc/65/15/05/1020651505.db2.gz AXTBDEAUUCLQAO-SECBINFHSA-N -1 1 331.220 4.234 20 0 EIADMM C[S@](=O)(=NC(=O)c1cc2sccc2c([O-])c1)C1CCCCC1 ZINC000926023178 1020766501 /nfs/dbraw/zinc/76/65/01/1020766501.db2.gz AMECPRCNCAGKKU-JOCHJYFZSA-N -1 1 337.466 4.178 20 0 EIADMM Cc1ccc(-c2nc(C(=O)Nc3ccc([O-])c(Cl)c3)cs2)n1C ZINC000340342637 1020780086 /nfs/dbraw/zinc/78/00/86/1020780086.db2.gz AGOFQUSZEVAPIN-UHFFFAOYSA-N -1 1 347.827 4.068 20 0 EIADMM [O-]c1c(Br)ccc(Cl)c1Nc1cccc(F)c1O ZINC001210205076 1020926445 /nfs/dbraw/zinc/92/64/45/1020926445.db2.gz YZVSLMHZZNQOSJ-UHFFFAOYSA-N -1 1 332.556 4.396 20 0 EIADMM CCOc1cc(-c2noc([C@@H](C)OCC(C)C)n2)cc(Cl)c1[O-] ZINC000683589347 1020943392 /nfs/dbraw/zinc/94/33/92/1020943392.db2.gz MXNDFTMFCSMEIV-SNVBAGLBSA-N -1 1 340.807 4.228 20 0 EIADMM C[C@H]([N-]c1nc(-c2ccccc2)no1)c1nc(C(F)(F)F)cs1 ZINC000683758242 1021345548 /nfs/dbraw/zinc/34/55/48/1021345548.db2.gz DVMVRIGVVQEEFT-QMMMGPOBSA-N -1 1 340.330 4.385 20 0 EIADMM Cc1c2cc(F)ccc2sc1C([O-])=C(C#N)c1cc(C)nc(C)n1 ZINC000066506489 1021867927 /nfs/dbraw/zinc/86/79/27/1021867927.db2.gz VKUIFHYEQUREHR-AWEZNQCLSA-N -1 1 339.395 4.246 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N(C[C@H]1CCCO1)C1CCCC1 ZINC000174514939 1022094064 /nfs/dbraw/zinc/09/40/64/1022094064.db2.gz MWXACTLUTIQQOE-GOSISDBHSA-N -1 1 339.435 4.109 20 0 EIADMM Cc1ccc(OC[C@H](C)NC(=O)c2cc3ccccc3cc2[O-])cc1 ZINC001625865692 1022120723 /nfs/dbraw/zinc/12/07/23/1022120723.db2.gz CLSJWHGIMIIVIF-HNNXBMFYSA-N -1 1 335.403 4.051 20 0 EIADMM Cc1c(=O)[n-]c(S[C@H]2C[C@@H](C)CCC2=O)nc1-c1ccccc1 ZINC000580517260 1022145243 /nfs/dbraw/zinc/14/52/43/1022145243.db2.gz NBKUAEADLMWOCE-NHYWBVRUSA-N -1 1 328.437 4.007 20 0 EIADMM COCc1ccc(Br)c(Nc2cc(F)c([O-])cc2F)c1 ZINC001215576729 1022755494 /nfs/dbraw/zinc/75/54/94/1022755494.db2.gz GTEDMNZCGJGZBK-UHFFFAOYSA-N -1 1 344.155 4.323 20 0 EIADMM CCCc1nc(-c2nc3sc(C(F)(F)F)cc3c(=O)[n-]2)co1 ZINC000416412007 1022830997 /nfs/dbraw/zinc/83/09/97/1022830997.db2.gz LTCKYGNKUXZECL-UHFFFAOYSA-N -1 1 329.303 4.023 20 0 EIADMM CCCCN1Cc2cccc(NC(=O)CC(CC)(CC)C(=O)[O-])c2C1 ZINC000066965811 1022910781 /nfs/dbraw/zinc/91/07/81/1022910781.db2.gz BBFREISMRLVHPM-UHFFFAOYSA-N -1 1 346.471 4.022 20 0 EIADMM C[C@H]1CCCCN(C(=O)c2ccc(NC(=O)OC(C)(C)C)cc2[O-])C1 ZINC000186476988 1023133381 /nfs/dbraw/zinc/13/33/81/1023133381.db2.gz MVDKEJZSLBVZDF-ZDUSSCGKSA-N -1 1 348.443 4.001 20 0 EIADMM C[C@H]1CCc2c(sc3nc(-c4cnn(C(C)(C)C)c4)[n-]c(=O)c23)C1 ZINC000408009419 1023227135 /nfs/dbraw/zinc/22/71/35/1023227135.db2.gz QMBZJSYRSNOYOF-JTQLQIEISA-N -1 1 342.468 4.140 20 0 EIADMM CC(C)Oc1ccc(CC[C@@H](C)NC(=O)c2ccc([O-])cc2F)cc1 ZINC000181157333 1023231252 /nfs/dbraw/zinc/23/12/52/1023231252.db2.gz YMJHVUOGZWSQPN-CQSZACIVSA-N -1 1 345.414 4.070 20 0 EIADMM O=C([O-])c1cccc(C[N@H+]2CCC[C@H](Oc3ccccc3Cl)C2)c1 ZINC000414635060 1023303062 /nfs/dbraw/zinc/30/30/62/1023303062.db2.gz FLKPNPLWXIQTOR-INIZCTEOSA-N -1 1 345.826 4.082 20 0 EIADMM O=C([O-])c1cccc(CN2CCC[C@H](Oc3ccccc3Cl)C2)c1 ZINC000414635060 1023303071 /nfs/dbraw/zinc/30/30/71/1023303071.db2.gz FLKPNPLWXIQTOR-INIZCTEOSA-N -1 1 345.826 4.082 20 0 EIADMM CCCc1csc(CN[C@@H](CC(=O)[O-])c2cccc(C)c2C)n1 ZINC000417567096 1023360591 /nfs/dbraw/zinc/36/05/91/1023360591.db2.gz IVQUXQUPUIYLMH-INIZCTEOSA-N -1 1 332.469 4.018 20 0 EIADMM O=C([O-])[C@@H](CC1CCCCC1)NCc1ccc(-c2ccccc2)o1 ZINC000417615254 1023381855 /nfs/dbraw/zinc/38/18/55/1023381855.db2.gz XBNJPPZLMVMZOQ-GOSISDBHSA-N -1 1 327.424 4.460 20 0 EIADMM CCOc1cc(-c2noc([C@H](OCC)C(C)C)n2)cc(Cl)c1[O-] ZINC000624574572 1023435935 /nfs/dbraw/zinc/43/59/35/1023435935.db2.gz RNEZERZHTWKNCL-CQSZACIVSA-N -1 1 340.807 4.228 20 0 EIADMM O=C(Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)c1cc(Cl)ccc1Cl ZINC000613663808 1023473340 /nfs/dbraw/zinc/47/33/40/1023473340.db2.gz IGYRGWFIEWJYFB-UHFFFAOYSA-N -1 1 348.189 4.341 20 0 EIADMM O=C([O-])c1ccc(-c2nc(CN3CCC(C4CCC4)CC3)co2)cc1 ZINC000656759929 1023501956 /nfs/dbraw/zinc/50/19/56/1023501956.db2.gz LUEZZFPJADBVLF-UHFFFAOYSA-N -1 1 340.423 4.052 20 0 EIADMM CC[C@H](C)Oc1cccc([N-]S(=O)(=O)c2ccc(F)cc2C)c1 ZINC000511733077 1023843313 /nfs/dbraw/zinc/84/33/13/1023843313.db2.gz CCZMMFFYHCNJJE-ZDUSSCGKSA-N -1 1 337.416 4.112 20 0 EIADMM Cc1ccc(Cl)cc1-c1noc(-c2cnc(C(F)(F)F)[n-]2)n1 ZINC001213589350 1024335451 /nfs/dbraw/zinc/33/54/51/1024335451.db2.gz BLKNDULLMKLSBQ-UHFFFAOYSA-N -1 1 328.681 4.107 20 0 EIADMM Cc1ccc(Cl)cc1-c1noc(-c2c[n-]c(C(F)(F)F)n2)n1 ZINC001213589350 1024335466 /nfs/dbraw/zinc/33/54/66/1024335466.db2.gz BLKNDULLMKLSBQ-UHFFFAOYSA-N -1 1 328.681 4.107 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc(Cl)c(Cl)c2)cc1F ZINC000048652378 1024671941 /nfs/dbraw/zinc/67/19/41/1024671941.db2.gz KSERTAMAWAHOQE-UHFFFAOYSA-N -1 1 334.199 4.242 20 0 EIADMM O=S(=O)([N-]c1ccc(Cl)c(F)c1)c1ccc(F)c(Cl)c1 ZINC000048655435 1024675621 /nfs/dbraw/zinc/67/56/21/1024675621.db2.gz AMQIHKQREJQLJL-UHFFFAOYSA-N -1 1 338.162 4.072 20 0 EIADMM Cc1cc(C)c(S(=O)(=O)[N-]c2ccc(Cl)cc2Cl)s1 ZINC000431148388 1024704014 /nfs/dbraw/zinc/70/40/14/1024704014.db2.gz GOJSWSOLJCHEAB-UHFFFAOYSA-N -1 1 336.265 4.473 20 0 EIADMM Cc1ccc([C@H](CC(=O)[O-])NCc2cc(Cl)cc(Cl)c2)o1 ZINC000426776944 1024760653 /nfs/dbraw/zinc/76/06/53/1024760653.db2.gz JBCXSSKJSJHMNW-ZDUSSCGKSA-N -1 1 328.195 4.200 20 0 EIADMM Cc1cc(C)c(S(=O)(=O)[N-]c2cc(C)c(F)cc2Cl)s1 ZINC000431177665 1024785008 /nfs/dbraw/zinc/78/50/08/1024785008.db2.gz IDBAKMQCFVDFCG-UHFFFAOYSA-N -1 1 333.837 4.267 20 0 EIADMM O=C([O-])CC[C@H]1CCCN(Cc2nc(C3CCCCC3)cs2)C1 ZINC000652496440 1024854369 /nfs/dbraw/zinc/85/43/69/1024854369.db2.gz VODLRCINNJNYCK-CQSZACIVSA-N -1 1 336.501 4.268 20 0 EIADMM COC(=O)Cc1ccccc1Nc1c(Cl)ccc([O-])c1Cl ZINC001213060278 1024897799 /nfs/dbraw/zinc/89/77/99/1024897799.db2.gz REEUXTZQPVXUMK-UHFFFAOYSA-N -1 1 326.179 4.158 20 0 EIADMM C[C@@H]1CO[C@H](c2ccccc2)CN1C(=O)c1ccc2ccccc2c1[O-] ZINC000110314676 1033266564 /nfs/dbraw/zinc/26/65/64/1033266564.db2.gz CWQIURZJSPOPPV-QRWLVFNGSA-N -1 1 347.414 4.148 20 0 EIADMM CCc1nc(SCc2ccc(OC(F)(F)F)cc2)[n-]c(=O)c1C ZINC000657264925 1025468747 /nfs/dbraw/zinc/46/87/47/1025468747.db2.gz JZQLCKDFUMYPPL-UHFFFAOYSA-N -1 1 344.358 4.244 20 0 EIADMM O=S(=O)([N-]c1ccc2n[nH]cc2c1)c1cccc(-c2ccccc2)c1 ZINC000506728969 1025506294 /nfs/dbraw/zinc/50/62/94/1025506294.db2.gz GXOAXFXCFPOXDS-UHFFFAOYSA-N -1 1 349.415 4.031 20 0 EIADMM CCCc1cc(=O)[n-]c(SCCCC(=O)c2ccc(F)cc2)n1 ZINC000319701673 1025626340 /nfs/dbraw/zinc/62/63/40/1025626340.db2.gz CVUHWHSESNOSDX-UHFFFAOYSA-N -1 1 334.416 4.029 20 0 EIADMM Cc1ccc(-c2cccc(CNCc3ccc(C(=O)[O-])c(C)n3)c2)cc1 ZINC000426638766 1025835465 /nfs/dbraw/zinc/83/54/65/1025835465.db2.gz SGPXAZVFRBEUNY-UHFFFAOYSA-N -1 1 346.430 4.353 20 0 EIADMM CCOc1cccc([N-]S(=O)(=O)c2cc(Cl)cc(Cl)c2)c1 ZINC000071977698 1026022733 /nfs/dbraw/zinc/02/27/33/1026022733.db2.gz LGABNHDWARFBQM-UHFFFAOYSA-N -1 1 346.235 4.193 20 0 EIADMM Cc1cc(Cl)ccc1OCC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000541887537 1026243518 /nfs/dbraw/zinc/24/35/18/1026243518.db2.gz FQWDBEKVRODJIP-UHFFFAOYSA-N -1 1 326.179 4.025 20 0 EIADMM Cc1oc([C@H](C)N(C)Cc2ccc(OC(F)F)cc2)cc1C(=O)[O-] ZINC000563278409 1026314673 /nfs/dbraw/zinc/31/46/73/1026314673.db2.gz JPVMEHLWDDJRKY-JTQLQIEISA-N -1 1 339.338 4.081 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2c(C)cccc2Cl)sc1Cl ZINC000473770480 1026326800 /nfs/dbraw/zinc/32/68/00/1026326800.db2.gz KVICBQZJLTZNLT-UHFFFAOYSA-N -1 1 336.265 4.473 20 0 EIADMM Cc1cc(C)c([N-]S(=O)(=O)c2cnc3ccc(F)cc3c2)c(C)c1 ZINC000342472173 1026395128 /nfs/dbraw/zinc/39/51/28/1026395128.db2.gz AKSXTOYSPAHMCW-UHFFFAOYSA-N -1 1 344.411 4.100 20 0 EIADMM Cc1ccc(-c2ccc(CN[C@@H](CC3CCCC3)C(=O)[O-])o2)cc1 ZINC000426728043 1026528266 /nfs/dbraw/zinc/52/82/66/1026528266.db2.gz SKRRSPIKQGLPSP-SFHVURJKSA-N -1 1 327.424 4.378 20 0 EIADMM CC(C)c1ccc([C@@H](CC(=O)[O-])NCc2cc(F)ccc2F)cc1 ZINC000426769984 1026547255 /nfs/dbraw/zinc/54/72/55/1026547255.db2.gz NQNYYVPJCXUECE-GOSISDBHSA-N -1 1 333.378 4.394 20 0 EIADMM CCCSC[C@H](NCc1cc(-c2ccccc2)cs1)C(=O)[O-] ZINC000426767032 1026557508 /nfs/dbraw/zinc/55/75/08/1026557508.db2.gz JPMZXRCLVJQBAB-INIZCTEOSA-N -1 1 335.494 4.101 20 0 EIADMM Cc1ccc([C@@H](CC(=O)[O-])NCc2cc(F)cc(C(F)(F)F)c2)o1 ZINC000426785126 1026557858 /nfs/dbraw/zinc/55/78/58/1026557858.db2.gz VSUVNJXIBQLRFN-CYBMUJFWSA-N -1 1 345.292 4.052 20 0 EIADMM CC(C)c1ccc(CN[C@@H](CC(=O)[O-])c2ccc(F)cc2F)cc1 ZINC000426807418 1026570999 /nfs/dbraw/zinc/57/09/99/1026570999.db2.gz HORIAFWDWVZNPF-SFHVURJKSA-N -1 1 333.378 4.394 20 0 EIADMM CC[C@H](Nc1ccc(-c2nc(C)c(C)c(=O)[n-]2)cn1)c1ccccc1 ZINC000413485488 1026597288 /nfs/dbraw/zinc/59/72/88/1026597288.db2.gz HEIRREQNBYEEIJ-KRWDZBQOSA-N -1 1 334.423 4.424 20 0 EIADMM [O-]c1cccc(CN(Cc2cccs2)C[C@@H]2CCCO2)c1Cl ZINC000507022682 1026601265 /nfs/dbraw/zinc/60/12/65/1026601265.db2.gz PYPPICBBMNHBQR-AWEZNQCLSA-N -1 1 337.872 4.288 20 0 EIADMM O=C(Nc1cccc2ncccc21)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684869995 1026627173 /nfs/dbraw/zinc/62/71/73/1026627173.db2.gz FHBYYWIQYKVYEN-UHFFFAOYSA-N -1 1 332.281 4.212 20 0 EIADMM CCc1cccc(NC(=O)c2cc(Cl)c([O-])c(OC)c2)c1CC ZINC000436736801 1026636391 /nfs/dbraw/zinc/63/63/91/1026636391.db2.gz PAJRUMOMVLONFX-UHFFFAOYSA-N -1 1 333.815 4.431 20 0 EIADMM COC(=O)c1c[n-]c(S[C@@H](C)c2cc(Cl)ccc2Cl)n1 ZINC000432657048 1026678808 /nfs/dbraw/zinc/67/88/08/1026678808.db2.gz JLXUDLGSYNFKJT-ZETCQYMHSA-N -1 1 331.224 4.356 20 0 EIADMM CC[C@@H](C)c1ccc(S(=O)(=O)[N-]c2ccc(OC)c(F)c2)cc1 ZINC000511131527 1026683940 /nfs/dbraw/zinc/68/39/40/1026683940.db2.gz ONYLEJVXCFMQNV-GFCCVEGCSA-N -1 1 337.416 4.149 20 0 EIADMM COC(=O)c1c[n-]c(S[C@@H](C)c2ccc(Cl)cc2Cl)n1 ZINC000432669837 1026697821 /nfs/dbraw/zinc/69/78/21/1026697821.db2.gz REKKAHSOYFQISC-ZETCQYMHSA-N -1 1 331.224 4.356 20 0 EIADMM CCO[C@@H](C)c1ncc(C(=O)[N-]c2cccc(F)c2SC)s1 ZINC000617276131 1026707478 /nfs/dbraw/zinc/70/74/78/1026707478.db2.gz XEQNKHIGQKEETH-VIFPVBQESA-N -1 1 340.445 4.354 20 0 EIADMM CCSc1cccc(-c2nc3cc(OC)cc(OC)c3c(=O)[n-]2)c1 ZINC000427460806 1026857769 /nfs/dbraw/zinc/85/77/69/1026857769.db2.gz XXHCSSRXHBHCQV-UHFFFAOYSA-N -1 1 342.420 4.132 20 0 EIADMM CCOc1cc(-c2noc([C@@H]3CC3(Cl)Cl)n2)cc(Cl)c1[O-] ZINC000277826451 1027016370 /nfs/dbraw/zinc/01/63/70/1027016370.db2.gz DTMRYGTZLBUSAI-ZETCQYMHSA-N -1 1 349.601 4.156 20 0 EIADMM O=C([N-]c1nnc(-c2ccccc2)s1)c1coc(-c2ccccc2)n1 ZINC000078040366 1027189843 /nfs/dbraw/zinc/18/98/43/1027189843.db2.gz LUUWTIMEDPGAAB-UHFFFAOYSA-N -1 1 348.387 4.112 20 0 EIADMM COC[C@H]([N-]c1nc(-c2ccc(C)cc2)no1)c1ccc(F)c(F)c1 ZINC000302075616 1027206867 /nfs/dbraw/zinc/20/68/67/1027206867.db2.gz WBIGORIQYCADTA-INIZCTEOSA-N -1 1 345.349 4.123 20 0 EIADMM Cc1nc(-c2ccc(N[C@@H]3CCC[C@@H](C)CC3)nc2)[n-]c(=O)c1C ZINC000302662123 1027355319 /nfs/dbraw/zinc/35/53/19/1027355319.db2.gz LWWLHYQZHHSLBX-MLGOLLRUSA-N -1 1 326.444 4.242 20 0 EIADMM O=C([O-])[C@@H](CCN(Cc1ccco1)Cc1ccco1)c1ccccc1 ZINC000520416464 1027529233 /nfs/dbraw/zinc/52/92/33/1027529233.db2.gz DPRDWLNMNKNCHG-IBGZPJMESA-N -1 1 339.391 4.133 20 0 EIADMM CCOc1cc(-c2noc(CCCCSC)n2)cc(Cl)c1[O-] ZINC000277959465 1027580670 /nfs/dbraw/zinc/58/06/70/1027580670.db2.gz PPDRRPUPUJJFAH-UHFFFAOYSA-N -1 1 342.848 4.180 20 0 EIADMM CCOCc1cccc([N-]S(=O)(=O)c2ccc3ccccc3c2)c1 ZINC000102320556 1027611312 /nfs/dbraw/zinc/61/13/12/1027611312.db2.gz SRQKBEHOQIUNJU-UHFFFAOYSA-N -1 1 341.432 4.177 20 0 EIADMM O=C([O-])[C@H](CCN(Cc1c(F)cccc1F)C1CC1)c1ccccc1 ZINC000582910096 1027652889 /nfs/dbraw/zinc/65/28/89/1027652889.db2.gz AOIWPKYYYPUZIU-MRXNPFEDSA-N -1 1 345.389 4.188 20 0 EIADMM CCSc1ccc(-c2noc(-c3ccc(OC)cc3[O-])n2)cc1 ZINC000324199841 1028190263 /nfs/dbraw/zinc/19/02/63/1028190263.db2.gz QHPUZNCQXZVFOK-UHFFFAOYSA-N -1 1 328.393 4.230 20 0 EIADMM CCOc1cc(-c2nc([C@@H]3CCC(F)(F)C3)no2)cc(Cl)c1[O-] ZINC000281253864 1028463464 /nfs/dbraw/zinc/46/34/64/1028463464.db2.gz DWYCKGQOQZRXNZ-MRVPVSSYSA-N -1 1 344.745 4.397 20 0 EIADMM CCc1cccc(C)c1[N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1 ZINC000016101250 1028472520 /nfs/dbraw/zinc/47/25/20/1028472520.db2.gz OHKHDOVGIHQKDQ-UHFFFAOYSA-N -1 1 343.370 4.377 20 0 EIADMM CC/C=C(\C)c1nc(-c2cc(Br)c([O-])c(OC)c2)no1 ZINC000445400508 1028512845 /nfs/dbraw/zinc/51/28/45/1028512845.db2.gz DYTLREQHPUYWFJ-VMPITWQZSA-N -1 1 339.189 4.027 20 0 EIADMM Cc1oc(CN2CCC([C@H](F)c3ccccc3F)CC2)cc1C(=O)[O-] ZINC000583334074 1028525189 /nfs/dbraw/zinc/52/51/89/1028525189.db2.gz XKQAQROCGHHTIG-SFHVURJKSA-N -1 1 349.377 4.348 20 0 EIADMM [O-]c1ccc(-c2noc(CCn3ccc4ccccc43)n2)c(Cl)c1 ZINC000445451034 1028544012 /nfs/dbraw/zinc/54/40/12/1028544012.db2.gz ZRZHCWMFJIVTMA-UHFFFAOYSA-N -1 1 339.782 4.293 20 0 EIADMM COc1cc(-c2nc(-c3c[nH]c4ccccc43)no2)cc(Cl)c1[O-] ZINC000445440963 1028563717 /nfs/dbraw/zinc/56/37/17/1028563717.db2.gz BHAJGSSUAWCSST-UHFFFAOYSA-N -1 1 341.754 4.253 20 0 EIADMM Cc1ccccc1OCCCc1nc(-c2ccc([O-])cc2Cl)no1 ZINC000445442762 1028564080 /nfs/dbraw/zinc/56/40/80/1028564080.db2.gz ACONUZUEBJBLAX-UHFFFAOYSA-N -1 1 344.798 4.416 20 0 EIADMM [O-]c1ccc(-c2noc([C@H]3CCOc4ccccc43)n2)c(Cl)c1 ZINC000445444560 1028572226 /nfs/dbraw/zinc/57/22/26/1028572226.db2.gz GVYCDNOEXUPKRG-LBPRGKRZSA-N -1 1 328.755 4.010 20 0 EIADMM CC(=O)c1ccc(-c2nc(-c3ccc([O-])cc3Cl)no2)c(F)c1 ZINC000445446124 1028580100 /nfs/dbraw/zinc/58/01/00/1028580100.db2.gz KZLCEGCTVYPKIX-UHFFFAOYSA-N -1 1 332.718 4.104 20 0 EIADMM CC[C@@H](C)n1nc(-c2nc(-c3ccc([O-])cc3Cl)no2)cc1C ZINC000445447072 1028583363 /nfs/dbraw/zinc/58/33/63/1028583363.db2.gz GPYNZUXQGBMYTP-SECBINFHSA-N -1 1 332.791 4.239 20 0 EIADMM [O-]c1ccc(-c2noc(-c3ccc(Br)cc3)n2)cc1F ZINC000445467624 1028591822 /nfs/dbraw/zinc/59/18/22/1028591822.db2.gz BFBIXSJDCVTYMB-UHFFFAOYSA-N -1 1 335.132 4.011 20 0 EIADMM [O-]c1ccc(-c2noc(/C=C\c3ccccc3OC(F)F)n2)cc1F ZINC000445471570 1028601816 /nfs/dbraw/zinc/60/18/16/1028601816.db2.gz HKOCNLUQFCUZHX-VURMDHGXSA-N -1 1 348.280 4.353 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cc(Oc4ccccc4)ccn3)n2)cc1F ZINC000445471510 1028602481 /nfs/dbraw/zinc/60/24/81/1028602481.db2.gz HCYLGKXOIOBNEX-UHFFFAOYSA-N -1 1 349.321 4.436 20 0 EIADMM Cc1cc(Cl)ccc1OCc1nc(-c2ccc([O-])cc2F)no1 ZINC000445459923 1028617881 /nfs/dbraw/zinc/61/78/81/1028617881.db2.gz JXXUVXAZPOQGSM-UHFFFAOYSA-N -1 1 334.734 4.122 20 0 EIADMM Cc1nc2cc(F)ccc2cc1-c1nc(-c2ccc([O-])cc2F)no1 ZINC000445463434 1028620887 /nfs/dbraw/zinc/62/08/87/1028620887.db2.gz OVXFPFSNYCMCTM-UHFFFAOYSA-N -1 1 339.301 4.244 20 0 EIADMM Cc1ccc2[nH]cc(CCc3nc(-c4ccc([O-])c(F)c4)no3)c2c1 ZINC000445481971 1028632861 /nfs/dbraw/zinc/63/28/61/1028632861.db2.gz NNLQOPDCGYETFK-UHFFFAOYSA-N -1 1 337.354 4.156 20 0 EIADMM [O-]c1ccc(-c2noc(Cc3csc4ccccc34)n2)cc1F ZINC000445474945 1028644272 /nfs/dbraw/zinc/64/42/72/1028644272.db2.gz RYQYLZFTEDGSMV-UHFFFAOYSA-N -1 1 326.352 4.387 20 0 EIADMM [O-]c1ccc(-c2noc(C3(c4ccc(Cl)cc4)CC3)n2)cc1F ZINC000445473947 1028645181 /nfs/dbraw/zinc/64/51/81/1028645181.db2.gz PJBCRRSNOUOQSR-UHFFFAOYSA-N -1 1 330.746 4.315 20 0 EIADMM CCc1ccc(S(=O)(=O)[N-]c2cc(C)c(OC)cc2Cl)s1 ZINC000583586173 1028892426 /nfs/dbraw/zinc/89/24/26/1028892426.db2.gz GZINVDRVPCPYHY-UHFFFAOYSA-N -1 1 345.873 4.082 20 0 EIADMM CC(C)c1ccc(-c2nc(C(=O)[N-]c3nncs3)cs2)cc1 ZINC000029641146 1028892712 /nfs/dbraw/zinc/89/27/12/1028892712.db2.gz QULVVFVCFSAVRB-UHFFFAOYSA-N -1 1 330.438 4.037 20 0 EIADMM CC(C)(CCCc1ccccc1)CNC(=O)c1c(F)ccc([O-])c1F ZINC000583592178 1028899897 /nfs/dbraw/zinc/89/98/97/1028899897.db2.gz WISQJFABAFRHAM-UHFFFAOYSA-N -1 1 347.405 4.449 20 0 EIADMM O=C(Nc1ccc(F)cc1[O-])C1(c2ccc(C(F)(F)F)cc2)CC1 ZINC000444249334 1029110656 /nfs/dbraw/zinc/11/06/56/1029110656.db2.gz PXKHGWOIQIAATI-UHFFFAOYSA-N -1 1 339.288 4.220 20 0 EIADMM C[C@H](CC(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)C1CCCCC1 ZINC000511243507 1029190522 /nfs/dbraw/zinc/19/05/22/1029190522.db2.gz WGNBKWBRGJVONS-CYBMUJFWSA-N -1 1 327.428 4.327 20 0 EIADMM CCOc1ccc2cc(-c3nc(-c4ccc([O-])cc4F)no3)[nH]c2c1 ZINC000445463204 1029371218 /nfs/dbraw/zinc/37/12/18/1029371218.db2.gz HVJURUDCHKPSFP-UHFFFAOYSA-N -1 1 339.326 4.128 20 0 EIADMM Cc1ccccc1[C@H]1CN(C(=O)c2cc3ccccc3cc2[O-])CCO1 ZINC000525253618 1029546914 /nfs/dbraw/zinc/54/69/14/1029546914.db2.gz TTYBALBTAJIICR-OAQYLSRUSA-N -1 1 347.414 4.068 20 0 EIADMM Cc1ccccc1[C@@H](C)Nc1ccc(-c2nc(C)c(C)c(=O)[n-]2)cn1 ZINC000301373782 1029718475 /nfs/dbraw/zinc/71/84/75/1029718475.db2.gz URUPSPXPSSUBLZ-OAHLLOKOSA-N -1 1 334.423 4.343 20 0 EIADMM Cc1nc(-c2ccc(NCC3CCC(C)CC3)nc2)[n-]c(=O)c1C ZINC000301387515 1029721899 /nfs/dbraw/zinc/72/18/99/1029721899.db2.gz XWUVRAXNKVDMSP-UHFFFAOYSA-N -1 1 326.444 4.099 20 0 EIADMM Cc1nc(-c2ccc(N[C@@H](C)CCC(C)(C)C)nc2)[n-]c(=O)c1C ZINC000301390304 1029722679 /nfs/dbraw/zinc/72/26/79/1029722679.db2.gz GEEHDCNAYUEDHU-LBPRGKRZSA-N -1 1 328.460 4.488 20 0 EIADMM Cc1nc(-c2ccc(N(Cc3ccccc3)C3CC3)nc2)[n-]c(=O)c1C ZINC000301507146 1029746534 /nfs/dbraw/zinc/74/65/34/1029746534.db2.gz HGRBPEUFUBZKIO-UHFFFAOYSA-N -1 1 346.434 4.030 20 0 EIADMM Cc1nc(-c2ccc(N3CCC(CC(C)C)CC3)nc2)[n-]c(=O)c1C ZINC000301668788 1029784007 /nfs/dbraw/zinc/78/40/07/1029784007.db2.gz PLQULZXPEMWYDH-UHFFFAOYSA-N -1 1 340.471 4.124 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2ccc(-c3ccco3)cc2F)c(C)o1 ZINC000447271814 1029955310 /nfs/dbraw/zinc/95/53/10/1029955310.db2.gz PIIJQXDZIMFIPW-UHFFFAOYSA-N -1 1 335.356 4.096 20 0 EIADMM COc1cc(C)cc([N-]S(=O)(=O)c2ccccc2C(C)C)c1C ZINC000447276765 1029959684 /nfs/dbraw/zinc/95/96/84/1029959684.db2.gz DHUDDKSXGRLZPB-UHFFFAOYSA-N -1 1 333.453 4.236 20 0 EIADMM O=C(/C=C/c1ccccc1OC(F)(F)F)Nc1c([O-])cccc1F ZINC000760196707 1029994116 /nfs/dbraw/zinc/99/41/16/1029994116.db2.gz OVJGNJLTSIFANN-CMDGGOBGSA-N -1 1 341.260 4.082 20 0 EIADMM CC(C)(C)c1ccc(S(=O)(=O)[N-]c2ccc3[nH]ccc3c2)cc1 ZINC000149733147 1030098672 /nfs/dbraw/zinc/09/86/72/1030098672.db2.gz PWXGYTZRYLCCCE-UHFFFAOYSA-N -1 1 328.437 4.266 20 0 EIADMM COc1cc(C(=O)N[C@@H]2CC[C@H]3CCCC[C@H]3C2)cc(Cl)c1[O-] ZINC000525953755 1030121474 /nfs/dbraw/zinc/12/14/74/1030121474.db2.gz SNWNINXHEUFWBW-MBNYWOFBSA-N -1 1 337.847 4.143 20 0 EIADMM CCc1onc(C)c1[N-]C(=O)c1c(C)onc1-c1cccc(Cl)c1 ZINC000361834801 1030165915 /nfs/dbraw/zinc/16/59/15/1030165915.db2.gz WTVRTUNMGQYMNP-UHFFFAOYSA-N -1 1 345.786 4.415 20 0 EIADMM Cc1cc(Cl)ccc1C1=CCN(Cc2cc(C(=O)[O-])co2)CC1 ZINC000530173757 1030193508 /nfs/dbraw/zinc/19/35/08/1030193508.db2.gz ZMATWXUQEZGTIH-UHFFFAOYSA-N -1 1 331.799 4.229 20 0 EIADMM CSc1ccccc1[N-]S(=O)(=O)c1ccc(C)c(Cl)c1 ZINC000033888373 1030197696 /nfs/dbraw/zinc/19/76/96/1030197696.db2.gz YHQMQTWZGWEBMX-UHFFFAOYSA-N -1 1 327.858 4.171 20 0 EIADMM C[C@@H]1C[C@@H](C(=O)[O-])C[C@H](C)N1Cc1csc(C2CCCCC2)n1 ZINC000530175996 1030198458 /nfs/dbraw/zinc/19/84/58/1030198458.db2.gz SKXIWJOCXWSMKN-AGGWBTHJSA-N -1 1 336.501 4.264 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N1CCC(F)(c2ccccc2)CC1 ZINC000447611868 1030230031 /nfs/dbraw/zinc/23/00/31/1030230031.db2.gz NKQTWDMLJHMHOH-UHFFFAOYSA-N -1 1 333.790 4.147 20 0 EIADMM O=S(=O)([N-]C1(c2cccc(Cl)c2)CC1)c1cc2ccccc2o1 ZINC000531009428 1030834398 /nfs/dbraw/zinc/83/43/98/1030834398.db2.gz IRZQOWTZFQSEQA-UHFFFAOYSA-N -1 1 347.823 4.054 20 0 EIADMM O=C([O-])c1cccc(CN2CCC(=Cc3cccc(F)c3)CC2)c1 ZINC000263445164 1030872146 /nfs/dbraw/zinc/87/21/46/1030872146.db2.gz XPXYUDZETZSZQH-UHFFFAOYSA-N -1 1 325.383 4.203 20 0 EIADMM COc1ccc(S(=O)(=O)[N-]c2cccc(C)c2C)c2ccccc12 ZINC000035685785 1031002403 /nfs/dbraw/zinc/00/24/03/1031002403.db2.gz KSALJDQYYDXIFA-UHFFFAOYSA-N -1 1 341.432 4.266 20 0 EIADMM C[C@@H]1[C@H](CC(F)(F)F)C[C@H](C)N1C(=O)c1cc(Cl)ccc1[O-] ZINC000452665756 1031245726 /nfs/dbraw/zinc/24/57/26/1031245726.db2.gz SFHVOJABTGVYHJ-AEJSXWLSSA-N -1 1 335.753 4.237 20 0 EIADMM CO[C@@H](CC(=O)Nc1cc(Cl)c([O-])c2ccccc12)C(F)(F)F ZINC000628233766 1031263849 /nfs/dbraw/zinc/26/38/49/1031263849.db2.gz UDXUGWIFVROHQU-LBPRGKRZSA-N -1 1 347.720 4.105 20 0 EIADMM CCOc1cc(C(=O)N(C)CCc2ccccc2C)cc(Cl)c1[O-] ZINC000452750765 1031304043 /nfs/dbraw/zinc/30/40/43/1031304043.db2.gz FXHGYKPPMRVOMB-UHFFFAOYSA-N -1 1 347.842 4.067 20 0 EIADMM O=C([N-]c1nnc(C(F)(F)F)s1)c1cc(Cl)sc1Cl ZINC000029283675 1031320847 /nfs/dbraw/zinc/32/08/47/1031320847.db2.gz OWJHDZTVTPVRFO-UHFFFAOYSA-N -1 1 348.158 4.178 20 0 EIADMM O=C(Nc1ccc(F)cc1[O-])[C@@H]1C[C@H]1c1ccccc1C(F)(F)F ZINC000532621091 1031431102 /nfs/dbraw/zinc/43/11/02/1031431102.db2.gz VWBLZKJYTWQEEV-NWDGAFQWSA-N -1 1 339.288 4.292 20 0 EIADMM Cc1ccccc1-c1nc(C(=O)Nc2ccc(F)cc2[O-])cs1 ZINC000532620992 1031432566 /nfs/dbraw/zinc/43/25/66/1031432566.db2.gz XOMHSLGMCUHOAV-UHFFFAOYSA-N -1 1 328.368 4.216 20 0 EIADMM COc1cc(C(=O)N2CCC[C@@]2(C)CC(C)C)cc(Cl)c1[O-] ZINC000452985488 1031471397 /nfs/dbraw/zinc/47/13/97/1031471397.db2.gz ALIRVNUWCXABHK-KRWDZBQOSA-N -1 1 325.836 4.095 20 0 EIADMM O=C(Nc1ccc(F)cc1[O-])c1cc2c(s1)-c1ccccc1OC2 ZINC000531755765 1031535995 /nfs/dbraw/zinc/53/59/95/1031535995.db2.gz NMRGMTVCLNZSGW-UHFFFAOYSA-N -1 1 341.363 4.405 20 0 EIADMM CSc1cc(C(=O)Nc2ccncc2[O-])c(Cl)cc1Cl ZINC000131276361 1031865555 /nfs/dbraw/zinc/86/55/55/1031865555.db2.gz ZBBQXEDZEAISND-UHFFFAOYSA-N -1 1 329.208 4.068 20 0 EIADMM Cc1cnc(C(=O)Nc2cc(Cl)c([O-])c3ccccc23)c(C)c1 ZINC001301158096 1031962307 /nfs/dbraw/zinc/96/23/07/1031962307.db2.gz AAVCBARRSHXBJB-UHFFFAOYSA-N -1 1 326.783 4.463 20 0 EIADMM O=C(C[C@H](c1ccccc1)C(F)(F)F)Nc1ccc(F)cc1[O-] ZINC000532012647 1031976409 /nfs/dbraw/zinc/97/64/09/1031976409.db2.gz FLXWADHGLBNDFE-GFCCVEGCSA-N -1 1 327.277 4.206 20 0 EIADMM Cc1cc(Br)c([O-])c(NC(=O)C[C@@H](C)c2ccco2)c1 ZINC000528980259 1031993345 /nfs/dbraw/zinc/99/33/45/1031993345.db2.gz UJTPNPVPUFFSHY-SNVBAGLBSA-N -1 1 338.201 4.188 20 0 EIADMM CCCN(CCC)C(=O)c1ccc([N-]c2nnc(C(C)(C)C)o2)cc1 ZINC001211760745 1033848594 /nfs/dbraw/zinc/84/85/94/1033848594.db2.gz UFQJXQBWFXCPQB-UHFFFAOYSA-N -1 1 344.459 4.373 20 0 EIADMM O=C([O-])[C@@H]1C[C@H](C2CCCCC2)CN1Cc1sccc1Cl ZINC000576293136 1034388293 /nfs/dbraw/zinc/38/82/93/1034388293.db2.gz JETJPEWYOBWRTL-JSGCOSHPSA-N -1 1 327.877 4.257 20 0 EIADMM O=C([O-])[C@H]1C[C@@H](C2CCCCC2)CN1Cc1sccc1Cl ZINC000576293138 1034391339 /nfs/dbraw/zinc/39/13/39/1034391339.db2.gz JETJPEWYOBWRTL-TZMCWYRMSA-N -1 1 327.877 4.257 20 0 EIADMM CCc1cccc(S(=O)(=O)[N-]c2ccc(CC(F)(F)F)cc2)c1 ZINC000433505427 1034587956 /nfs/dbraw/zinc/58/79/56/1034587956.db2.gz HVFQMEZTDMETFE-UHFFFAOYSA-N -1 1 343.370 4.155 20 0 EIADMM CC(C)C[C@H]1CCCN(C(=O)c2ccc(Br)c([O-])c2)C1 ZINC000490581490 1035553426 /nfs/dbraw/zinc/55/34/26/1035553426.db2.gz BEIRJPFHRMSHCQ-GFCCVEGCSA-N -1 1 340.261 4.053 20 0 EIADMM CCOc1cc(C(=O)N2Cc3ccccc3[C@@H](C)C2)cc(Cl)c1[O-] ZINC000913412023 1035713197 /nfs/dbraw/zinc/71/31/97/1035713197.db2.gz AJGNGSQUVOBYHA-LBPRGKRZSA-N -1 1 345.826 4.204 20 0 EIADMM Cc1csc(-c2cccc([N-]S(=O)(=O)c3ccc(C)cc3)c2)n1 ZINC000588077678 1036205870 /nfs/dbraw/zinc/20/58/70/1036205870.db2.gz IYANCVOPNMXTGZ-UHFFFAOYSA-N -1 1 344.461 4.228 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1cccc(OC(F)(F)F)c1 ZINC000156723687 1036263085 /nfs/dbraw/zinc/26/30/85/1036263085.db2.gz ICEGMHLXBBCOMH-UHFFFAOYSA-N -1 1 331.677 4.197 20 0 EIADMM O=S(=O)([N-]c1ccc(F)c(F)c1)c1ccccc1-c1ccccc1 ZINC000485800314 1036284194 /nfs/dbraw/zinc/28/41/94/1036284194.db2.gz LPJFUSIWCUTTAT-UHFFFAOYSA-N -1 1 345.370 4.433 20 0 EIADMM CC(C)c1ccc2nc(-c3ccc(-c4cc[nH]n4)cc3)[n-]c(=O)c2c1 ZINC000060797389 1036490339 /nfs/dbraw/zinc/49/03/39/1036490339.db2.gz BOBGCLODHFJQMO-UHFFFAOYSA-N -1 1 330.391 4.104 20 0 EIADMM O=C([O-])C[C@H](NCc1cccc(Cl)c1Cl)c1cccs1 ZINC000037087819 1036967186 /nfs/dbraw/zinc/96/71/86/1036967186.db2.gz GMKQHYRAGSLAKX-NSHDSACASA-N -1 1 330.236 4.361 20 0 EIADMM CCc1cc2c(CNc3ccc(C)c(F)c3)cc(=O)oc2cc1[O-] ZINC000057570747 1037128082 /nfs/dbraw/zinc/12/80/82/1037128082.db2.gz XQIHXJZWBUVUMZ-UHFFFAOYSA-N -1 1 327.355 4.121 20 0 EIADMM CCc1ccccc1S(=O)(=O)[N-]c1ccc2nc(C3CC3)oc2c1 ZINC000488228314 1037438849 /nfs/dbraw/zinc/43/88/49/1037438849.db2.gz XLZMRKRAPGCONT-UHFFFAOYSA-N -1 1 342.420 4.068 20 0 EIADMM Cc1nc(Cc2ccccc2)sc1C(=O)Nc1c([O-])cccc1F ZINC000605438256 1037788304 /nfs/dbraw/zinc/78/83/04/1037788304.db2.gz DLYIJTBNCGSJOB-UHFFFAOYSA-N -1 1 342.395 4.139 20 0 EIADMM O=C(CCc1ccccc1OC(F)(F)F)Nc1c([O-])cccc1F ZINC000605440640 1037789760 /nfs/dbraw/zinc/78/97/60/1037789760.db2.gz XLUVIQGGMDZKSH-UHFFFAOYSA-N -1 1 343.276 4.001 20 0 EIADMM O=c1cc(C(F)F)nc(SCc2cc(-c3ccccc3)no2)[n-]1 ZINC000573963852 1037796702 /nfs/dbraw/zinc/79/67/02/1037796702.db2.gz FFKOFUIMPPLWDG-UHFFFAOYSA-N -1 1 335.335 4.067 20 0 EIADMM C[C@@H]1c2ccc(F)cc2CCN1C(=O)c1ccc2ccccc2c1[O-] ZINC000606317313 1038005123 /nfs/dbraw/zinc/00/51/23/1038005123.db2.gz MFHBVDBRQZOIPU-CYBMUJFWSA-N -1 1 335.378 4.444 20 0 EIADMM CC(C)c1ccc([N-]S(=O)(=O)c2cc(F)c(F)c(F)c2)cc1 ZINC000607610581 1038239084 /nfs/dbraw/zinc/23/90/84/1038239084.db2.gz FWRZRNVHAWENFC-UHFFFAOYSA-N -1 1 329.343 4.028 20 0 EIADMM O=C([O-])CC[C@@H]1CCCCN1Cc1csc(-c2cccs2)n1 ZINC000424268408 1038763850 /nfs/dbraw/zinc/76/38/50/1038763850.db2.gz ZZJROZYVXKDXIH-ZDUSSCGKSA-N -1 1 336.482 4.091 20 0 EIADMM O=C([O-])CC[C@@H]1CCCCN1Cc1csc(-c2ccccc2F)n1 ZINC000424267717 1038765028 /nfs/dbraw/zinc/76/50/28/1038765028.db2.gz YJPZMGWBQSDNIE-AWEZNQCLSA-N -1 1 348.443 4.169 20 0 EIADMM CC(C)Cc1nc(-c2nc(-c3ccc([O-])cc3Cl)no2)cs1 ZINC000445447756 1038810716 /nfs/dbraw/zinc/81/07/16/1038810716.db2.gz PRHYYNBJXDSTDK-UHFFFAOYSA-N -1 1 335.816 4.418 20 0 EIADMM C[C@@H]1CCCN(Cc2ccc(-c3ccccc3Cl)o2)[C@H]1C(=O)[O-] ZINC000424414254 1038851553 /nfs/dbraw/zinc/85/15/53/1038851553.db2.gz GZDWSIVSBDPZGF-SJKOYZFVSA-N -1 1 333.815 4.285 20 0 EIADMM CSCc1ccc([N-]S(=O)(=O)c2ccc(F)c(Cl)c2)cc1 ZINC000608955875 1038990470 /nfs/dbraw/zinc/99/04/70/1038990470.db2.gz SCCSAOIGCJNTNK-UHFFFAOYSA-N -1 1 345.848 4.143 20 0 EIADMM CCc1nc(C)c([C@@H](C)N(C)C(=O)c2ccc(Cl)cc2[O-])s1 ZINC000120002575 1039028084 /nfs/dbraw/zinc/02/80/84/1039028084.db2.gz TZEZWZPSLLEPOU-SNVBAGLBSA-N -1 1 338.860 4.206 20 0 EIADMM O=C(Cc1ccsc1)Nc1c([O-])cc(Br)cc1Cl ZINC000552209574 1039290579 /nfs/dbraw/zinc/29/05/79/1039290579.db2.gz LSODHXRHUMUSKK-UHFFFAOYSA-N -1 1 346.633 4.051 20 0 EIADMM Nc1ccc(Nc2ccc(F)c(Br)c2[O-])cc1Cl ZINC001212121250 1039574512 /nfs/dbraw/zinc/57/45/12/1039574512.db2.gz BIYWUHCNDKCCAY-UHFFFAOYSA-N -1 1 331.572 4.273 20 0 EIADMM Cc1ccc([C@H]2OCCC[C@@H]2C(=O)Nc2ccc([O-])c(F)c2F)cc1 ZINC000456780953 1039601245 /nfs/dbraw/zinc/60/12/45/1039601245.db2.gz JHWDKAFXIWZHOC-SCLBCKFNSA-N -1 1 347.361 4.085 20 0 EIADMM O=C(CC1CCC(C(F)(F)F)CC1)Nc1ccc([O-])c(F)c1F ZINC000456788136 1039603194 /nfs/dbraw/zinc/60/31/94/1039603194.db2.gz QXKHQTUOCXKCET-UHFFFAOYSA-N -1 1 337.288 4.368 20 0 EIADMM COc1cc(-c2nc3ccc(C(C)C)cc3c(=O)[nH]2)cc(Cl)c1[O-] ZINC000060797447 1039753850 /nfs/dbraw/zinc/75/38/50/1039753850.db2.gz QJXNJNAMYMRSGF-UHFFFAOYSA-N -1 1 344.798 4.081 20 0 EIADMM CCOc1cc(C(=O)N2CCC[C@H](C(C)(C)C)C2)cc(Cl)c1[O-] ZINC000478475435 1039785575 /nfs/dbraw/zinc/78/55/75/1039785575.db2.gz WFFVDMXZOQPNPD-ZDUSSCGKSA-N -1 1 339.863 4.343 20 0 EIADMM CCc1cc(C)cc(CC)c1[N-]S(=O)(=O)c1ccccc1COC ZINC000481864716 1039865961 /nfs/dbraw/zinc/86/59/61/1039865961.db2.gz HRAFEWZFFVANOH-UHFFFAOYSA-N -1 1 347.480 4.067 20 0 EIADMM COc1cc([N-]S(=O)(=O)c2cccc(C(C)C)c2)c(C)cc1C ZINC000478715319 1039874222 /nfs/dbraw/zinc/87/42/22/1039874222.db2.gz YGIRRUDONPPXJK-UHFFFAOYSA-N -1 1 333.453 4.236 20 0 EIADMM C[C@@H](N=c1ccc(N2CCC[C@@H]2c2ccco2)n[n-]1)c1ccccc1 ZINC000425230658 1039890515 /nfs/dbraw/zinc/89/05/15/1039890515.db2.gz RMPUFPCTKBYRHK-NVXWUHKLSA-N -1 1 334.423 4.006 20 0 EIADMM CC(C)c1nnc(C(=O)[N-]c2ccccc2SC(F)F)s1 ZINC000283047504 1040188228 /nfs/dbraw/zinc/18/82/28/1040188228.db2.gz SJZWUIWJPYMPAY-UHFFFAOYSA-N -1 1 329.397 4.229 20 0 EIADMM Cc1ccc(C)c(S(=O)(=O)[N-]c2ccnc(-c3ccccc3)c2)c1 ZINC000479306547 1040246960 /nfs/dbraw/zinc/24/69/60/1040246960.db2.gz BRMLGDRUFLNTGO-UHFFFAOYSA-N -1 1 338.432 4.166 20 0 EIADMM Cc1cc(Br)c([O-])c(NC(=O)c2cc3ccccc3[nH]2)c1 ZINC000482573197 1040362567 /nfs/dbraw/zinc/36/25/67/1040362567.db2.gz HAFUVEFUNDFLNR-UHFFFAOYSA-N -1 1 345.196 4.197 20 0 EIADMM O=C(Nc1cccc(Oc2ccccn2)c1)c1c(F)ccc([O-])c1F ZINC000539489128 1040474711 /nfs/dbraw/zinc/47/47/11/1040474711.db2.gz XRUHYKXXGMJFPZ-UHFFFAOYSA-N -1 1 342.301 4.110 20 0 EIADMM O=c1[n-]c(-c2n[nH]c(C3CC3)n2)nc2scc(C3CCCCC3)c21 ZINC000668142572 1040521492 /nfs/dbraw/zinc/52/14/92/1040521492.db2.gz VPQFISBUZCDDKQ-UHFFFAOYSA-N -1 1 341.440 4.107 20 0 EIADMM O=C(Nc1ccc(-c2nncs2)cc1)c1cc2ccccc2cc1[O-] ZINC000537720015 1040787234 /nfs/dbraw/zinc/78/72/34/1040787234.db2.gz JPSIWOBCJKOFAP-UHFFFAOYSA-N -1 1 347.399 4.316 20 0 EIADMM Cc1cc(C(=O)CCc2nc(-c3ccc([O-])cc3F)no2)c(C)s1 ZINC000445456239 1040799037 /nfs/dbraw/zinc/79/90/37/1040799037.db2.gz SXHVIRIOVHACBG-UHFFFAOYSA-N -1 1 346.383 4.075 20 0 EIADMM Cc1noc(C(F)F)c1C(=O)[N-]c1ccccc1SC(F)F ZINC000746406083 1040825532 /nfs/dbraw/zinc/82/55/32/1040825532.db2.gz ULSPIGKEZUHAIJ-UHFFFAOYSA-N -1 1 334.294 4.488 20 0 EIADMM O=S(=O)([N-]c1ccc(COc2ccccc2)cc1)c1ccccc1 ZINC000538016943 1041007289 /nfs/dbraw/zinc/00/72/89/1041007289.db2.gz ZRZOHILDMCAWFZ-UHFFFAOYSA-N -1 1 339.416 4.066 20 0 EIADMM O=c1cc(C2CC2)nc(SCc2nc(-c3ccccc3)cs2)[n-]1 ZINC000436258227 1041014078 /nfs/dbraw/zinc/01/40/78/1041014078.db2.gz GWXJNPVTYFPIOZ-UHFFFAOYSA-N -1 1 341.461 4.475 20 0 EIADMM CC[C@@H]1CCCC[C@H]1Nc1ccc(-c2nc(C)c(C)c(=O)[n-]2)cn1 ZINC000462929694 1041110504 /nfs/dbraw/zinc/11/05/04/1041110504.db2.gz ODWQVUOLZTUWJT-GDBMZVCRSA-N -1 1 326.444 4.242 20 0 EIADMM CC(C)c1ccc2nc(-c3ccnc(N4CCCC4)c3)[n-]c(=O)c2c1 ZINC000554529818 1041217504 /nfs/dbraw/zinc/21/75/04/1041217504.db2.gz FPLQWQRQRUKAST-UHFFFAOYSA-N -1 1 334.423 4.121 20 0 EIADMM C=Cc1ccc(S(=O)(=O)[N-]c2ccc3oc(C4CC4)nc3c2)cc1 ZINC000436478633 1041262340 /nfs/dbraw/zinc/26/23/40/1041262340.db2.gz NEYDEBPRBUAKNQ-UHFFFAOYSA-N -1 1 340.404 4.149 20 0 EIADMM C/C(=C\c1ccc(Cl)cc1)CN[C@@H](C)c1ncc(C(=O)[O-])s1 ZINC000904021611 1041264492 /nfs/dbraw/zinc/26/44/92/1041264492.db2.gz ZFOMOSNYIXKLOC-HUYFXPKMSA-N -1 1 336.844 4.249 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N1CCC[C@@H]1Cc1cccc(F)c1 ZINC000436495357 1041281625 /nfs/dbraw/zinc/28/16/25/1041281625.db2.gz XZXRBAIZLNRQEQ-OAHLLOKOSA-N -1 1 333.790 4.032 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1CC[C@@H](Cc2ccc(F)cc2)C1 ZINC000436534916 1041316767 /nfs/dbraw/zinc/31/67/67/1041316767.db2.gz JCXARIBHMOJPIG-INIZCTEOSA-N -1 1 349.405 4.389 20 0 EIADMM COc1ccc(C(=O)N(CCc2ccccc2)c2ccccc2)c([O-])c1 ZINC000436535774 1041320820 /nfs/dbraw/zinc/32/08/20/1041320820.db2.gz SSRUZNOEMBQPBV-UHFFFAOYSA-N -1 1 347.414 4.290 20 0 EIADMM CC[C@H](c1ccccc1)[C@H]1CCCN1C(=O)c1cc(F)ccc1[O-] ZINC000436539265 1041332432 /nfs/dbraw/zinc/33/24/32/1041332432.db2.gz NBEDYERCYPTCIO-SJLPKXTDSA-N -1 1 327.399 4.330 20 0 EIADMM O=C(c1cc(F)ccc1[O-])N(C1CC1)[C@H]1CCCc2ccccc21 ZINC000436541721 1041336235 /nfs/dbraw/zinc/33/62/35/1041336235.db2.gz ZJJPNWWGPOMBOD-SFHVURJKSA-N -1 1 325.383 4.214 20 0 EIADMM COc1ccc([C@@H]2CCN(C(=O)c3cc4ccccc4cc3[O-])C2)cc1 ZINC000436543109 1041339669 /nfs/dbraw/zinc/33/96/69/1041339669.db2.gz JXSJAKCYECYDJC-GOSISDBHSA-N -1 1 347.414 4.184 20 0 EIADMM O=C(c1cc(F)ccc1[O-])N1CCCC[C@@H]1c1cc2ccccc2[nH]1 ZINC000436557101 1041340618 /nfs/dbraw/zinc/34/06/18/1041340618.db2.gz QIHCSBHHLNQSHX-GOSISDBHSA-N -1 1 338.382 4.380 20 0 EIADMM O=C(c1cc(F)ccc1[O-])N1CCCC[C@H]1c1cc2ccccc2[nH]1 ZINC000436557104 1041342159 /nfs/dbraw/zinc/34/21/59/1041342159.db2.gz QIHCSBHHLNQSHX-SFHVURJKSA-N -1 1 338.382 4.380 20 0 EIADMM Cc1ccc(C(C)(C)CN(C)C(=O)c2ccc(Cl)cc2[O-])cc1 ZINC000436563929 1041343990 /nfs/dbraw/zinc/34/39/90/1041343990.db2.gz FYUYLJCNQAQTIY-UHFFFAOYSA-N -1 1 331.843 4.404 20 0 EIADMM Cc1nc(-c2ccc(CNC(=O)c3ccc(Cl)cc3[O-])o2)cs1 ZINC000436564158 1041344689 /nfs/dbraw/zinc/34/46/89/1041344689.db2.gz JQJBJKCRFBEESB-UHFFFAOYSA-N -1 1 348.811 4.001 20 0 EIADMM O=C(CCCc1ccc2ccccc2c1)Nc1nc(-c2ccco2)n[nH]1 ZINC000538425408 1041347822 /nfs/dbraw/zinc/34/78/22/1041347822.db2.gz ZJPQMFCYSFXDKF-UHFFFAOYSA-N -1 1 346.390 4.179 20 0 EIADMM Cc1csc([C@H](NC(=O)c2cc3ccccc3cc2[O-])C2CC2)n1 ZINC000436592664 1041350922 /nfs/dbraw/zinc/35/09/22/1041350922.db2.gz XIXYWVOYEXHWHU-QGZVFWFLSA-N -1 1 338.432 4.191 20 0 EIADMM CCO[C@@H](c1noc(Cc2ccc([O-])c(Cl)c2)n1)C1CCCC1 ZINC000904139143 1041351898 /nfs/dbraw/zinc/35/18/98/1041351898.db2.gz QSECBCTYQMVSPM-MRXNPFEDSA-N -1 1 336.819 4.287 20 0 EIADMM Cc1cccc2nc(-c3ccc(-c4ccc(O)cc4)cc3)[n-]c(=O)c12 ZINC000436597953 1041354440 /nfs/dbraw/zinc/35/44/40/1041354440.db2.gz XQLHIRCABJKMPB-UHFFFAOYSA-N -1 1 328.371 4.271 20 0 EIADMM CC[C@@H]1CCCC[C@H]1c1noc(-c2cc(NC(C)=O)ccc2[O-])n1 ZINC000436596174 1041355263 /nfs/dbraw/zinc/35/52/63/1041355263.db2.gz PJBRUDKWKSUTTO-TZMCWYRMSA-N -1 1 329.400 4.084 20 0 EIADMM O=C(NC[C@@H]1CCO[C@@H]1c1ccccc1)c1ccc2ccccc2c1[O-] ZINC000436587427 1041362373 /nfs/dbraw/zinc/36/23/73/1041362373.db2.gz FDSRUZRGHKCZLC-LAUBAEHRSA-N -1 1 347.414 4.053 20 0 EIADMM Cc1cnc([C@H](NC(=O)c2ccc3ccccc3c2[O-])C2CC2)s1 ZINC000436588631 1041362539 /nfs/dbraw/zinc/36/25/39/1041362539.db2.gz IIOAISAPAXSYNE-MRXNPFEDSA-N -1 1 338.432 4.191 20 0 EIADMM C[C@H]([C@@H]1Cc2ccccc2O1)N(C)C(=O)c1ccc2ccccc2c1[O-] ZINC000436609842 1041371510 /nfs/dbraw/zinc/37/15/10/1041371510.db2.gz WPDCLCYPRZIVIH-VLIAUNLRSA-N -1 1 347.414 4.010 20 0 EIADMM CC(C)c1ccc(CC2CCN(C(=O)c3ncccc3[O-])CC2)cc1 ZINC000463178978 1041395095 /nfs/dbraw/zinc/39/50/95/1041395095.db2.gz ZUMXCRDLJRKVNO-UHFFFAOYSA-N -1 1 338.451 4.006 20 0 EIADMM CC(C)C(=O)Nc1ccc(NC(=O)c2ccc(C(C)C)cc2[O-])cc1 ZINC000436643651 1041399384 /nfs/dbraw/zinc/39/93/84/1041399384.db2.gz YAWQAMBHWZUIGU-UHFFFAOYSA-N -1 1 340.423 4.362 20 0 EIADMM CCCOc1ccc(-c2noc(-c3ccc([O-])cc3F)n2)cc1OC ZINC000436685671 1041421042 /nfs/dbraw/zinc/42/10/42/1041421042.db2.gz BQNCCAHPIHMRMF-UHFFFAOYSA-N -1 1 344.342 4.046 20 0 EIADMM COc1cc(F)c(F)cc1NC(=O)c1ccc2ccccc2c1[O-] ZINC000436700739 1041431579 /nfs/dbraw/zinc/43/15/79/1041431579.db2.gz XCCRJDQUDAKAHF-UHFFFAOYSA-N -1 1 329.302 4.085 20 0 EIADMM O=C(c1cc(F)ccc1[O-])N1C[C@H](c2ccccc2)[C@H]2CCCC[C@H]21 ZINC000436704233 1041435426 /nfs/dbraw/zinc/43/54/26/1041435426.db2.gz GMMGQJITKYKACC-BHIYHBOVSA-N -1 1 339.410 4.330 20 0 EIADMM COc1ccc([C@@H]2CCCN2C(=O)c2ccc(Cl)cc2[O-])cc1 ZINC000436724190 1041435466 /nfs/dbraw/zinc/43/54/66/1041435466.db2.gz QSAVHSRGHROBFP-INIZCTEOSA-N -1 1 331.799 4.032 20 0 EIADMM C[C@H]1CC[C@]2(CCN(C(=O)c3ccc(C(F)(F)F)cc3[O-])C2)C1 ZINC000436725820 1041436988 /nfs/dbraw/zinc/43/69/88/1041436988.db2.gz VHDFAJXYLOXFSX-ZBEGNZNMSA-N -1 1 327.346 4.063 20 0 EIADMM C[C@@H]1CC[C@@]2(CCN(C(=O)c3ccc(C(F)(F)F)cc3[O-])C2)C1 ZINC000436725817 1041437686 /nfs/dbraw/zinc/43/76/86/1041437686.db2.gz VHDFAJXYLOXFSX-BDJLRTHQSA-N -1 1 327.346 4.063 20 0 EIADMM O=C(Nc1ccc(-c2csnn2)cc1)c1ccc2ccccc2c1[O-] ZINC000436714932 1041438832 /nfs/dbraw/zinc/43/88/32/1041438832.db2.gz JWWWZBAPJGXTIE-UHFFFAOYSA-N -1 1 347.399 4.316 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1CCC=C(c2ccccc2)C1 ZINC000436724579 1041444452 /nfs/dbraw/zinc/44/44/52/1041444452.db2.gz OGAGJOMRLBXNLC-UHFFFAOYSA-N -1 1 329.399 4.475 20 0 EIADMM CCN(C(=O)c1ccc(C(C)C)cc1[O-])c1ccc(OC)c(OC)c1 ZINC000436759463 1041457123 /nfs/dbraw/zinc/45/71/23/1041457123.db2.gz YBBHLWSRAHTYHF-UHFFFAOYSA-N -1 1 343.423 4.200 20 0 EIADMM COc1cc(C)c(NC(=O)c2cc3ccccc3cc2[O-])cc1OC ZINC000436749542 1041461276 /nfs/dbraw/zinc/46/12/76/1041461276.db2.gz YZDKQEGFIUUIIS-UHFFFAOYSA-N -1 1 337.375 4.123 20 0 EIADMM O=C(c1ccc(C(F)(F)F)cc1[O-])N1CCc2ccc(Cl)cc21 ZINC000436752182 1041463405 /nfs/dbraw/zinc/46/34/05/1041463405.db2.gz QWMXRZNJRLCXSY-UHFFFAOYSA-N -1 1 341.716 4.267 20 0 EIADMM O=C(c1ccc(C(F)(F)F)cc1[O-])N1CCC2(C1)CCCCC2 ZINC000436750301 1041463449 /nfs/dbraw/zinc/46/34/49/1041463449.db2.gz FUVKLIYLLVVFRA-UHFFFAOYSA-N -1 1 327.346 4.207 20 0 EIADMM C[C@H]1C[C@H](c2ccccc2)CCN1C(=O)c1ccc(Cl)cc1[O-] ZINC000436751213 1041464001 /nfs/dbraw/zinc/46/40/01/1041464001.db2.gz QRRRBBGRVQTYDD-DZGCQCFKSA-N -1 1 329.827 4.454 20 0 EIADMM C[C@H]1CN(C(=O)c2ccc(C(F)(F)F)cc2[O-])[C@@H]1c1ccccc1 ZINC000436754344 1041466810 /nfs/dbraw/zinc/46/68/10/1041466810.db2.gz YHFMAIIVQXHULH-ZBEGNZNMSA-N -1 1 335.325 4.244 20 0 EIADMM CC[C@]1(C(=O)[O-])CCCN(Cc2cc(C(F)(F)F)ccc2Cl)C1 ZINC000904402356 1041469404 /nfs/dbraw/zinc/46/94/04/1041469404.db2.gz WSSGTQIOPBNEGK-HNNXBMFYSA-N -1 1 349.780 4.436 20 0 EIADMM O=C(Nc1ccc(-c2cnco2)cc1)c1ccc(C(F)(F)F)cc1[O-] ZINC000436793794 1041485446 /nfs/dbraw/zinc/48/54/46/1041485446.db2.gz STTMMDQPFGFXGL-UHFFFAOYSA-N -1 1 348.280 4.318 20 0 EIADMM Cn1ncc(NC(=O)c2cc3ccccc3cc2[O-])c1-c1ccccc1 ZINC000436802777 1041489011 /nfs/dbraw/zinc/48/90/11/1041489011.db2.gz GCOYSWHQJRZKHQ-UHFFFAOYSA-N -1 1 343.386 4.198 20 0 EIADMM Cc1ccc(NC(=O)c2ccc(O)cc2[O-])c(OCc2ccccc2)c1 ZINC000436808449 1041490684 /nfs/dbraw/zinc/49/06/84/1041490684.db2.gz LDPLHRVMIIEDKE-UHFFFAOYSA-N -1 1 349.386 4.238 20 0 EIADMM C[C@@H](CCCC(F)(F)F)NC(=O)c1cc2ccccc2cc1[O-] ZINC000436809196 1041491322 /nfs/dbraw/zinc/49/13/22/1041491322.db2.gz RTJMZOWDEAYHKF-NSHDSACASA-N -1 1 325.330 4.396 20 0 EIADMM CC(C)c1ccc(C(=O)Nc2cnn(C)c2-c2ccccc2)c([O-])c1 ZINC000436808473 1041491566 /nfs/dbraw/zinc/49/15/66/1041491566.db2.gz LIOOXISKLKIMCZ-UHFFFAOYSA-N -1 1 335.407 4.168 20 0 EIADMM Cc1cccc([C@@H]2CCN(C(=O)c3ccc(C(F)(F)F)cc3[O-])C2)c1 ZINC000436834523 1041499346 /nfs/dbraw/zinc/49/93/46/1041499346.db2.gz PSKAVGNVKAATAD-CQSZACIVSA-N -1 1 349.352 4.349 20 0 EIADMM CC(C)(c1ccc(NC(=O)c2ccc(O)cc2[O-])cc1)C(F)(F)F ZINC000436851587 1041518687 /nfs/dbraw/zinc/51/86/87/1041518687.db2.gz MENXPSZFYKOKBT-UHFFFAOYSA-N -1 1 339.313 4.190 20 0 EIADMM O=C(N[C@@H](Cc1ccccc1)c1ccccc1)c1ccc([O-])cc1F ZINC000436861652 1041520535 /nfs/dbraw/zinc/52/05/35/1041520535.db2.gz LXRJVJOKDRMROS-FQEVSTJZSA-N -1 1 335.378 4.245 20 0 EIADMM [O-]c1ccc(-c2noc(Cc3ccc(Cl)s3)n2)c(Cl)c1 ZINC000436870023 1041528484 /nfs/dbraw/zinc/52/84/84/1041528484.db2.gz GGQZPMCFLFKLDX-UHFFFAOYSA-N -1 1 327.192 4.401 20 0 EIADMM [O-]c1ccc(-c2noc(CCSCc3ccccc3)n2)cc1F ZINC000436870235 1041528857 /nfs/dbraw/zinc/52/88/57/1041528857.db2.gz DCXZXLJOLJRYEK-UHFFFAOYSA-N -1 1 330.384 4.057 20 0 EIADMM C[C@H](Cc1cncc2ccccc21)c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000436874096 1041530966 /nfs/dbraw/zinc/53/09/66/1041530966.db2.gz PGWSHWGVFWACGZ-GFCCVEGCSA-N -1 1 349.365 4.476 20 0 EIADMM CC(C)[C@H](c1nc(-c2ccc([O-])cc2Cl)no1)c1cccnc1 ZINC000436874297 1041531847 /nfs/dbraw/zinc/53/18/47/1041531847.db2.gz SOJYJFQLGALABA-HNNXBMFYSA-N -1 1 329.787 4.279 20 0 EIADMM [O-]c1ccc(-c2noc(-c3ccc(Cl)c4ncccc34)n2)cc1F ZINC000436876875 1041535694 /nfs/dbraw/zinc/53/56/94/1041535694.db2.gz BUUDZTOQNSILMN-UHFFFAOYSA-N -1 1 341.729 4.450 20 0 EIADMM COC(=O)c1cccc(-c2noc(-c3ccc4ccccc4c3[O-])n2)c1 ZINC000436888437 1041543357 /nfs/dbraw/zinc/54/33/57/1041543357.db2.gz RZCFAHKAIXUTDL-UHFFFAOYSA-N -1 1 346.342 4.049 20 0 EIADMM COc1ccc(-c2nc(Cc3cccc4ccccc43)no2)c([O-])c1 ZINC000436890804 1041543972 /nfs/dbraw/zinc/54/39/72/1041543972.db2.gz CUDKSLHVMPQMRV-UHFFFAOYSA-N -1 1 332.359 4.195 20 0 EIADMM [O-]c1ccc(F)cc1-c1nc(-c2ccccc2OC(F)(F)F)no1 ZINC000436892803 1041545957 /nfs/dbraw/zinc/54/59/57/1041545957.db2.gz KXYYLHUYMCHIRV-UHFFFAOYSA-N -1 1 340.232 4.147 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N1CCC[C@@H]1/C=C\c1ccccc1 ZINC000436902159 1041554085 /nfs/dbraw/zinc/55/40/85/1041554085.db2.gz OTVWXSZRLZVTIZ-SIJIIQCFSA-N -1 1 327.811 4.364 20 0 EIADMM Cn1cnc2cc(-c3noc(-c4ccc5ccccc5c4[O-])n3)ccc21 ZINC000436931764 1041554704 /nfs/dbraw/zinc/55/47/04/1041554704.db2.gz MCSRCEQANCBKNZ-UHFFFAOYSA-N -1 1 342.358 4.149 20 0 EIADMM Cc1nc2ccc(-c3noc(-c4cc(F)ccc4[O-])n3)cc2s1 ZINC000436937884 1041566745 /nfs/dbraw/zinc/56/67/45/1041566745.db2.gz GXVNMFFEMHAFAH-UHFFFAOYSA-N -1 1 327.340 4.166 20 0 EIADMM COc1ccc2c(c1)CCC[C@H]2c1noc(-c2cc(F)ccc2[O-])n1 ZINC000436963551 1041571504 /nfs/dbraw/zinc/57/15/04/1041571504.db2.gz OJYULEZCFJHORU-OAHLLOKOSA-N -1 1 340.354 4.058 20 0 EIADMM [O-]c1ccc(-c2noc(-c3nc4ccccc4cc3Cl)n2)c(F)c1 ZINC000436957091 1041574992 /nfs/dbraw/zinc/57/49/92/1041574992.db2.gz VOXMUTXDEHKVAJ-UHFFFAOYSA-N -1 1 341.729 4.450 20 0 EIADMM O=C(NCCc1nc(C2CCCCC2)cs1)c1c([O-])cccc1F ZINC000436971501 1041576815 /nfs/dbraw/zinc/57/68/15/1041576815.db2.gz KELRFFHEAKNIJD-UHFFFAOYSA-N -1 1 348.443 4.008 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2c(F)cccc2Cl)c(Cl)c1 ZINC000463515849 1041610503 /nfs/dbraw/zinc/61/05/03/1041610503.db2.gz KSPSVIDGHSPGRR-UHFFFAOYSA-N -1 1 334.199 4.242 20 0 EIADMM Cc1ccccc1-c1cnc(CSc2nc(C)c(C)c(=O)[n-]2)o1 ZINC000540712468 1041620505 /nfs/dbraw/zinc/62/05/05/1041620505.db2.gz IIHLIDDFMVRXFC-UHFFFAOYSA-N -1 1 327.409 4.055 20 0 EIADMM Cc1oc(CN(C)[C@@H](C)c2ccc(OC(F)F)cc2)cc1C(=O)[O-] ZINC000516656543 1041693463 /nfs/dbraw/zinc/69/34/63/1041693463.db2.gz ICCZVZMPULWEED-JTQLQIEISA-N -1 1 339.338 4.081 20 0 EIADMM Cc1ccc([C@H]2CCN(C(=O)c3cc4ccccc4cc3[O-])C2)cc1 ZINC000541506766 1041973525 /nfs/dbraw/zinc/97/35/25/1041973525.db2.gz AMEWXWNGJJCHCY-IBGZPJMESA-N -1 1 331.415 4.484 20 0 EIADMM CCOc1ccc(F)c([N-]C(=O)c2ccoc2C(F)(F)F)c1F ZINC000464402823 1041997565 /nfs/dbraw/zinc/99/75/65/1041997565.db2.gz ZAAYJYKUAGOTMH-UHFFFAOYSA-N -1 1 335.228 4.228 20 0 EIADMM CSCc1cccc([N-]S(=O)(=O)c2cc(Cl)ccc2C)c1 ZINC000517593037 1042091465 /nfs/dbraw/zinc/09/14/65/1042091465.db2.gz MIPAAJKKGZYINP-UHFFFAOYSA-N -1 1 341.885 4.312 20 0 EIADMM Cc1[nH]c2c(cc(C)cc2CNC(=O)c2c(F)ccc([O-])c2F)c1C ZINC000438914088 1042422933 /nfs/dbraw/zinc/42/29/33/1042422933.db2.gz VNKRTAJKYLWINX-UHFFFAOYSA-N -1 1 344.361 4.007 20 0 EIADMM Cc1cc(F)ccc1S(=O)(=O)[N-]c1ccccc1CC(F)(F)F ZINC000172901285 1042511454 /nfs/dbraw/zinc/51/14/54/1042511454.db2.gz IQSLVIPMVWCHOO-UHFFFAOYSA-N -1 1 347.333 4.040 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1C[C@@H]2CCC[C@]2(C(F)(F)F)C1 ZINC000894386870 1042724967 /nfs/dbraw/zinc/72/49/67/1042724967.db2.gz OKPFPZOGNQCGHN-KSSFIOAISA-N -1 1 349.352 4.350 20 0 EIADMM CCOC(=O)Nc1ccc(NC(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000492742740 1042738167 /nfs/dbraw/zinc/73/81/67/1042738167.db2.gz CKPQNQOCXMKFTO-UHFFFAOYSA-N -1 1 349.774 4.258 20 0 EIADMM C[C@H]1CCC[C@H]1[N-]S(=O)(=O)c1c(Cl)cc(Cl)cc1Cl ZINC000520555858 1042887184 /nfs/dbraw/zinc/88/71/84/1042887184.db2.gz UZAFVZGJEGJVHI-WRWORJQWSA-N -1 1 342.675 4.114 20 0 EIADMM CCn1ncc(C(=O)Nc2ccc([O-])c(Cl)c2)c1-c1ccccc1 ZINC000427620393 1043004720 /nfs/dbraw/zinc/00/47/20/1043004720.db2.gz HAEBRYQXEIDTGH-UHFFFAOYSA-N -1 1 341.798 4.181 20 0 EIADMM CCC(CC)c1nnc([N-]C(=O)c2ncoc2-c2ccccc2)s1 ZINC000112000583 1043051314 /nfs/dbraw/zinc/05/13/14/1043051314.db2.gz VQFUDUQNZPQJGO-UHFFFAOYSA-N -1 1 342.424 4.349 20 0 EIADMM CCc1cccc(Oc2cc(-c3nc4cccnc4c(=O)[n-]3)ccn2)c1 ZINC000491599441 1043061758 /nfs/dbraw/zinc/06/17/58/1043061758.db2.gz QZROOAORBWPVQC-UHFFFAOYSA-N -1 1 344.374 4.147 20 0 EIADMM O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2ccccc2[O-])c1 ZINC000218461704 1043132350 /nfs/dbraw/zinc/13/23/50/1043132350.db2.gz XJWDFAQHBDRMNW-UHFFFAOYSA-N -1 1 347.374 4.289 20 0 EIADMM CC[C@H](O[C@@H]1CCC[C@H](C)C1)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000509167244 1043158365 /nfs/dbraw/zinc/15/83/65/1043158365.db2.gz DCNANQXAVWYVAL-GHJWDPDVSA-N -1 1 325.836 4.358 20 0 EIADMM CCCN(Cc1cccc([O-])c1Cl)[C@H](C)C(=O)Nc1ccccc1 ZINC000507950435 1043208567 /nfs/dbraw/zinc/20/85/67/1043208567.db2.gz KJGSHQWVKMPHOW-CQSZACIVSA-N -1 1 346.858 4.285 20 0 EIADMM COc1cccc(-c2c[nH]cc2C(=O)Nc2ccc([O-])c(Cl)c2)c1 ZINC000509181365 1043219650 /nfs/dbraw/zinc/21/96/50/1043219650.db2.gz WFSDSUGBIOVURY-UHFFFAOYSA-N -1 1 342.782 4.302 20 0 EIADMM CSc1cccc([N-]S(=O)(=O)c2c(C)ccc3ncccc32)c1 ZINC000673982543 1043232015 /nfs/dbraw/zinc/23/20/15/1043232015.db2.gz NQVVFTSSUOVKSK-UHFFFAOYSA-N -1 1 344.461 4.066 20 0 EIADMM CCc1cccc2cc(CN[C@H](C(=O)[O-])[C@H](C)c3ccccc3)oc21 ZINC000656570337 1043232445 /nfs/dbraw/zinc/23/24/45/1043232445.db2.gz XPXLWDAGBYEKES-KUHUBIRLSA-N -1 1 337.419 4.342 20 0 EIADMM CCOc1cc(C(=O)Nc2ccc3c(c2)CCC3)cc(Cl)c1[O-] ZINC000216008425 1043232823 /nfs/dbraw/zinc/23/28/23/1043232823.db2.gz ZHGMFDQTCDCKBB-UHFFFAOYSA-N -1 1 331.799 4.185 20 0 EIADMM COc1cc(C)c([N-]S(=O)(=O)c2cccc3ccccc32)cc1F ZINC000187069665 1043325273 /nfs/dbraw/zinc/32/52/73/1043325273.db2.gz BCVMNIFWZHJYMP-UHFFFAOYSA-N -1 1 345.395 4.097 20 0 EIADMM O=S(=O)(/C=C/c1ccc(Cl)cc1)[N-]c1cc(Cl)ccc1O ZINC000728149909 1043377861 /nfs/dbraw/zinc/37/78/61/1043377861.db2.gz VCQXMKHAGLJJFR-BQYQJAHWSA-N -1 1 344.219 4.112 20 0 EIADMM O=C(OCc1nc2ccccc2o1)c1ccc(Cl)c(Cl)c1[O-] ZINC000730360334 1043504346 /nfs/dbraw/zinc/50/43/46/1043504346.db2.gz GECDRCAVAFHRII-UHFFFAOYSA-N -1 1 338.146 4.197 20 0 EIADMM CCOc1c(Cl)cccc1CC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000189666577 1043626588 /nfs/dbraw/zinc/62/65/88/1043626588.db2.gz JSMRKCDEMKRYES-UHFFFAOYSA-N -1 1 340.206 4.279 20 0 EIADMM CCc1nc(SCc2csc(-c3ccc(C)o3)n2)[n-]c(=O)c1C ZINC000521372159 1043731371 /nfs/dbraw/zinc/73/13/71/1043731371.db2.gz ZDEAELUDTBNTCW-UHFFFAOYSA-N -1 1 347.465 4.370 20 0 EIADMM COc1ccc(Cl)c(NC(=O)Nc2ccc([O-])c(Cl)c2)c1 ZINC000190953433 1043752895 /nfs/dbraw/zinc/75/28/95/1043752895.db2.gz YOZTZZZXGQPJEQ-UHFFFAOYSA-N -1 1 327.167 4.352 20 0 EIADMM O=C(Nc1c([O-])cccc1F)c1cc(Br)ccc1Cl ZINC000078807052 1043781314 /nfs/dbraw/zinc/78/13/14/1043781314.db2.gz XSGQAIJMZWOIEP-UHFFFAOYSA-N -1 1 344.567 4.200 20 0 EIADMM CC[C@H](NC(=O)c1cc(Cl)c([O-])c(OC)c1)C1CCCCC1 ZINC000682376883 1043811158 /nfs/dbraw/zinc/81/11/58/1043811158.db2.gz ZRGPABFBPDLKPB-AWEZNQCLSA-N -1 1 325.836 4.143 20 0 EIADMM CC[C@@H](C)c1ccc(S(=O)(=O)[N-]c2ccccc2CCOC)cc1 ZINC000191887694 1043855884 /nfs/dbraw/zinc/85/58/84/1043855884.db2.gz ONPCGZKTXJDEGX-OAHLLOKOSA-N -1 1 347.480 4.190 20 0 EIADMM COc1cc(C(=O)N2CCC[C@H]2c2ccc(C)cc2)cc(Cl)c1[O-] ZINC000442859443 1043864871 /nfs/dbraw/zinc/86/48/71/1043864871.db2.gz ADCFQZRLJXASOK-INIZCTEOSA-N -1 1 345.826 4.340 20 0 EIADMM C[C@@H]1CO[C@@H](c2ccccc2)[C@H](C)N1C(=O)c1ccc(Cl)cc1[O-] ZINC000732019431 1043870560 /nfs/dbraw/zinc/87/05/60/1043870560.db2.gz IMWLWCUTGKPJAJ-FHSNZYRGSA-N -1 1 345.826 4.036 20 0 EIADMM CCC(=O)Nc1ccc(NC(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000192202504 1043892747 /nfs/dbraw/zinc/89/27/47/1043892747.db2.gz NOMJLADPCJCBQS-UHFFFAOYSA-N -1 1 333.775 4.038 20 0 EIADMM CCOc1cc(C(=O)N[C@H]2CCCC(C)(C)C2)cc(Cl)c1[O-] ZINC000442927186 1043893074 /nfs/dbraw/zinc/89/30/74/1043893074.db2.gz ZBMBHICAAJHYMZ-LBPRGKRZSA-N -1 1 325.836 4.143 20 0 EIADMM CCOc1ccc(OC)cc1NC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000192214546 1043894418 /nfs/dbraw/zinc/89/44/18/1043894418.db2.gz FVNLQGBBORIEKA-UHFFFAOYSA-N -1 1 336.775 4.097 20 0 EIADMM Cc1nn(-c2ccccc2)cc1NC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000192264087 1043897475 /nfs/dbraw/zinc/89/74/75/1043897475.db2.gz HQKKTYYAAZPTTR-UHFFFAOYSA-N -1 1 342.786 4.184 20 0 EIADMM CCC[C@H](Cc1ccccc1)NC(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC000442951504 1043903305 /nfs/dbraw/zinc/90/33/05/1043903305.db2.gz HFZCJWZHFPVJEK-OAHLLOKOSA-N -1 1 347.842 4.195 20 0 EIADMM CCN(C(=O)c1cc(Cl)c([O-])c(OC)c1)[C@H]1CCCC[C@H]1C ZINC000442966744 1043927702 /nfs/dbraw/zinc/92/77/02/1043927702.db2.gz NGVZAAAUCLYKPQ-RISCZKNCSA-N -1 1 325.836 4.095 20 0 EIADMM COc1cc(C(=O)N2CCCCC[C@@H]2CC(C)C)cc(Cl)c1[O-] ZINC000442965808 1043928869 /nfs/dbraw/zinc/92/88/69/1043928869.db2.gz JEGONWZGVZYVCD-CQSZACIVSA-N -1 1 339.863 4.485 20 0 EIADMM CCOc1cc(C(=O)N(C)Cc2ccc(C)cc2)cc(Cl)c1[O-] ZINC000193015286 1043991736 /nfs/dbraw/zinc/99/17/36/1043991736.db2.gz JEKLYIRUKDQZMI-UHFFFAOYSA-N -1 1 333.815 4.025 20 0 EIADMM CSCc1cccc([N-]S(=O)(=O)c2ccc(Cl)cc2)c1 ZINC000521851041 1044021809 /nfs/dbraw/zinc/02/18/09/1044021809.db2.gz JJJLYUSOHQKUEM-UHFFFAOYSA-N -1 1 327.858 4.004 20 0 EIADMM C[C@@H](c1ccccc1)N(Cc1ccccc1)C(=O)c1ncccc1[O-] ZINC000428269131 1044046398 /nfs/dbraw/zinc/04/63/98/1044046398.db2.gz HYBPMVPZKGFVDR-INIZCTEOSA-N -1 1 332.403 4.191 20 0 EIADMM COc1cc(-c2nc([C@@H](C)Oc3ccccc3)no2)cc(Cl)c1[O-] ZINC000443195023 1044083868 /nfs/dbraw/zinc/08/38/68/1044083868.db2.gz JQWQMOYJGSCJEL-SNVBAGLBSA-N -1 1 346.770 4.244 20 0 EIADMM C[C@H](NC(=O)c1ccc([O-])c(F)c1)c1ccc(F)c2ccccc21 ZINC000673408297 1044203995 /nfs/dbraw/zinc/20/39/95/1044203995.db2.gz ZRXLTLMAPTZSGZ-NSHDSACASA-N -1 1 327.330 4.315 20 0 EIADMM CC(C)(C)c1cnc(COC(=O)c2ccc(Cl)c(Cl)c2[O-])o1 ZINC000733490938 1044243278 /nfs/dbraw/zinc/24/32/78/1044243278.db2.gz YDKJAVOOZMFDPA-UHFFFAOYSA-N -1 1 344.194 4.342 20 0 EIADMM CC(C)c1cnc(COC(=O)c2ccc(Cl)c(Cl)c2[O-])o1 ZINC000733488885 1044243722 /nfs/dbraw/zinc/24/37/22/1044243722.db2.gz BECBOLRHGRCJIW-UHFFFAOYSA-N -1 1 330.167 4.167 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N(CCc1ccccc1)C1CC1 ZINC000914490324 1044259897 /nfs/dbraw/zinc/25/98/97/1044259897.db2.gz KWSFPYVGGQGQES-UHFFFAOYSA-N -1 1 331.415 4.393 20 0 EIADMM CCNc1cc(C)ccc1NC(=O)c1cc(Cl)c([O-])c(OCC)c1 ZINC000191335704 1044414810 /nfs/dbraw/zinc/41/48/10/1044414810.db2.gz MBDGBDGYZTYZFS-UHFFFAOYSA-N -1 1 348.830 4.437 20 0 EIADMM Cc1cc(F)ccc1-c1ccc(CN(CC(=O)[O-])CC(C)(C)C)o1 ZINC000665350114 1044467885 /nfs/dbraw/zinc/46/78/85/1044467885.db2.gz BLDOQDLVAVFMTL-UHFFFAOYSA-N -1 1 333.403 4.327 20 0 EIADMM COc1cccc(C2(C(=O)Nc3cc([O-])c(F)cc3F)CCCC2)c1 ZINC000824775217 1044527054 /nfs/dbraw/zinc/52/70/54/1044527054.db2.gz YEBLVPGSFIYUQG-UHFFFAOYSA-N -1 1 347.361 4.130 20 0 EIADMM Cc1ccc(OCCCC(=O)Nc2c([O-])cccc2F)c(Cl)c1 ZINC000676050874 1044629910 /nfs/dbraw/zinc/62/99/10/1044629910.db2.gz CKFYDIHQBZXFSC-UHFFFAOYSA-N -1 1 337.778 4.291 20 0 EIADMM O=C([O-])CCCN1CCC[C@@H]1c1ccc(Br)cc1Cl ZINC000626009059 1045121198 /nfs/dbraw/zinc/12/11/98/1045121198.db2.gz VOJDQDMCMPEVPV-CYBMUJFWSA-N -1 1 346.652 4.104 20 0 EIADMM C#Cc1cccc(N(CC)C(=O)c2cc(Cl)c([O-])c(OCC)c2)c1 ZINC000186778984 1045237938 /nfs/dbraw/zinc/23/79/38/1045237938.db2.gz BRWUPVMIIOJIAE-UHFFFAOYSA-N -1 1 343.810 4.092 20 0 EIADMM O=C(N[C@@H]1C[C@@H]1c1c(F)cccc1Cl)c1c([O-])cccc1Cl ZINC000740928966 1045242612 /nfs/dbraw/zinc/24/26/12/1045242612.db2.gz VPJIMAZRADCMCA-QPUJVOFHSA-N -1 1 340.181 4.124 20 0 EIADMM O=C([O-])CC[C@H]1CCCCN1Cc1csc(-c2ccsc2)n1 ZINC000315613922 1045406180 /nfs/dbraw/zinc/40/61/80/1045406180.db2.gz MYFQODMQTHYUJN-CQSZACIVSA-N -1 1 336.482 4.091 20 0 EIADMM COc1c(C)ccc([N-]S(=O)(=O)c2cccc3ccccc32)c1C ZINC000326103435 1045583395 /nfs/dbraw/zinc/58/33/95/1045583395.db2.gz DWDBEATXLDVXDA-UHFFFAOYSA-N -1 1 341.432 4.266 20 0 EIADMM Cc1cc(-c2csc(NC(=O)c3ccc([O-])c(F)c3)n2)ccc1F ZINC000768240363 1045752790 /nfs/dbraw/zinc/75/27/90/1045752790.db2.gz AWDRMUQNYHIZCI-UHFFFAOYSA-N -1 1 346.358 4.355 20 0 EIADMM O=C(NCc1cccc(-c2cccnc2)c1)c1c([O-])cccc1Cl ZINC000768541539 1045817992 /nfs/dbraw/zinc/81/79/92/1045817992.db2.gz PEQDWLUCGVFSFK-UHFFFAOYSA-N -1 1 338.794 4.038 20 0 EIADMM CC(C)Cc1ccccc1C(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC000792235276 1045879810 /nfs/dbraw/zinc/87/98/10/1045879810.db2.gz MYMLVHGGYUKDEB-UHFFFAOYSA-N -1 1 335.407 4.233 20 0 EIADMM O=C(c1c([O-])cccc1Cl)N(CCc1cccc(F)c1)C1CC1 ZINC000769859897 1046081779 /nfs/dbraw/zinc/08/17/79/1046081779.db2.gz SWNVEZRIVBKVHF-UHFFFAOYSA-N -1 1 333.790 4.032 20 0 EIADMM O=C([O-])C1CCN(Cc2c(Cl)cccc2Oc2ccccc2)CC1 ZINC000263394968 1046281255 /nfs/dbraw/zinc/28/12/55/1046281255.db2.gz GGOVEKIUFWBXQB-UHFFFAOYSA-N -1 1 345.826 4.429 20 0 EIADMM O=S(=O)([N-]c1ccc(F)cc1Cl)c1c(F)cccc1Cl ZINC000125283554 1046298146 /nfs/dbraw/zinc/29/81/46/1046298146.db2.gz BROLCGJCVJUQKF-UHFFFAOYSA-N -1 1 338.162 4.072 20 0 EIADMM CCc1ccc(-c2nc(C(=O)[N-]c3c(F)ccnc3F)cs2)cc1 ZINC001129483799 1046476713 /nfs/dbraw/zinc/47/67/13/1046476713.db2.gz KOIYNAKRVMECGZ-UHFFFAOYSA-N -1 1 345.374 4.298 20 0 EIADMM CC([NH2+]Cc1cc(=O)[nH]c(C2CC2)n1)(c1ccccc1)c1ccccc1 ZINC000459401866 1046600803 /nfs/dbraw/zinc/60/08/03/1046600803.db2.gz YPRBUFYFTIJANX-UHFFFAOYSA-N -1 1 345.446 4.113 20 0 EIADMM CC(=C([O-])Nc1nc(-c2ccccc2Cl)ns1)c1ccccc1 ZINC000476026986 1047065951 /nfs/dbraw/zinc/06/59/51/1047065951.db2.gz SZMRNERINKSZRD-LLVKDONJSA-N -1 1 343.839 4.023 20 0 EIADMM CCCCC[C@@H](NC(=O)C(=O)c1ccc([O-])cc1)c1ccccc1 ZINC000806777249 1047358872 /nfs/dbraw/zinc/35/88/72/1047358872.db2.gz ZPQFXAWARZBKLA-GOSISDBHSA-N -1 1 325.408 4.013 20 0 EIADMM O=C(Nc1nc(Cl)ccc1[O-])c1cc(F)c(Cl)cc1Cl ZINC000789929668 1047484715 /nfs/dbraw/zinc/48/47/15/1047484715.db2.gz ASWPSYURMWHJND-UHFFFAOYSA-N -1 1 335.549 4.139 20 0 EIADMM CSc1c(F)cccc1[N-]C(=O)c1cnc(-c2ccccn2)s1 ZINC001131058976 1047502734 /nfs/dbraw/zinc/50/27/34/1047502734.db2.gz IYSQJPIEBCWTSP-UHFFFAOYSA-N -1 1 345.424 4.318 20 0 EIADMM O=C(Nc1nc(Cl)ccc1[O-])c1ccccc1CCC(F)(F)F ZINC000790050739 1047510519 /nfs/dbraw/zinc/51/05/19/1047510519.db2.gz HUTWDIHRTKUMAJ-UHFFFAOYSA-N -1 1 344.720 4.188 20 0 EIADMM COc1ccc2cccc(CC(=O)Nc3cc(F)cc(F)c3[O-])c2c1 ZINC001142542953 1047603882 /nfs/dbraw/zinc/60/38/82/1047603882.db2.gz XMBGHQHCHSRQOY-UHFFFAOYSA-N -1 1 343.329 4.013 20 0 EIADMM O=S(=O)([N-]c1cc(Cl)ccc1F)c1ccc(F)cc1Cl ZINC000044254970 1047637615 /nfs/dbraw/zinc/63/76/15/1047637615.db2.gz UBQBXUBZWKBZAO-UHFFFAOYSA-N -1 1 338.162 4.072 20 0 EIADMM CCCOc1ccc([N-]S(=O)(=O)c2cc(C)cc(F)c2)c(C)c1 ZINC000476399073 1047788262 /nfs/dbraw/zinc/78/82/62/1047788262.db2.gz WWFOEBRCTVPMPG-UHFFFAOYSA-N -1 1 337.416 4.032 20 0 EIADMM Cc1ccc(CN(C(=O)c2cc(Cl)ccc2[O-])C2CC2)cc1C ZINC001136924365 1047901513 /nfs/dbraw/zinc/90/15/13/1047901513.db2.gz WTFHQKOYTDJRID-UHFFFAOYSA-N -1 1 329.827 4.467 20 0 EIADMM Cc1ccsc1-c1nsc([N-]C(=O)c2ccc(Cl)o2)n1 ZINC000131412848 1047907794 /nfs/dbraw/zinc/90/77/94/1047907794.db2.gz XFWAACBUIFINET-UHFFFAOYSA-N -1 1 325.802 4.074 20 0 EIADMM CC[C@H](c1ccccc1)[C@H]1CCCN1C(=O)c1ccc(F)c([O-])c1 ZINC001137007914 1048055004 /nfs/dbraw/zinc/05/50/04/1048055004.db2.gz UMRNEPALRITMEG-SJLPKXTDSA-N -1 1 327.399 4.330 20 0 EIADMM Cc1ccc(-c2cnc(NC([O-])=NO[C@@H]3CCCCO3)s2)c(C)c1 ZINC000844662104 1048458640 /nfs/dbraw/zinc/45/86/40/1048458640.db2.gz LVVYATQFADWJLQ-OAHLLOKOSA-N -1 1 347.440 4.007 20 0 EIADMM Cc1ccc(-c2cnc(NC(=O)[N-]O[C@@H]3CCCCO3)s2)c(C)c1 ZINC000844662104 1048458648 /nfs/dbraw/zinc/45/86/48/1048458648.db2.gz LVVYATQFADWJLQ-OAHLLOKOSA-N -1 1 347.440 4.007 20 0 EIADMM Cc1ccc(F)cc1S(=O)(=O)[N-]c1ccc(SC(F)F)cc1 ZINC000033911063 1048537401 /nfs/dbraw/zinc/53/74/01/1048537401.db2.gz JOBWTDUMRLIUJT-UHFFFAOYSA-N -1 1 347.383 4.250 20 0 EIADMM COc1ccc([C@H](NC(=O)c2ccc3ccccc3c2[O-])C2CC2)cc1 ZINC001135223340 1048607645 /nfs/dbraw/zinc/60/76/45/1048607645.db2.gz GLCMFPYUWJTTDL-HXUWFJFHSA-N -1 1 347.414 4.435 20 0 EIADMM Cc1ccc2[nH]c3c(c2c1)CN(C(=O)c1c([O-])cccc1Cl)CC3 ZINC000920445659 1048675332 /nfs/dbraw/zinc/67/53/32/1048675332.db2.gz VUABMBYKZRVSGG-UHFFFAOYSA-N -1 1 340.810 4.034 20 0 EIADMM CN(Cc1ccc(Cl)s1)C(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC001135406429 1048704996 /nfs/dbraw/zinc/70/49/96/1048704996.db2.gz PTOOVNLRIBFSCY-UHFFFAOYSA-N -1 1 349.761 4.398 20 0 EIADMM [O-]c1cc(F)c(CN2CCC(c3nc4ccccc4o3)CC2)c(F)c1 ZINC001144542437 1048719780 /nfs/dbraw/zinc/71/97/80/1048719780.db2.gz XLXRXOVZUCNFQW-UHFFFAOYSA-N -1 1 344.361 4.191 20 0 EIADMM O=C([O-])c1occc1CN1CCC[C@@H]1c1ccccc1C(F)(F)F ZINC000846243454 1048846978 /nfs/dbraw/zinc/84/69/78/1048846978.db2.gz BXBQKXIXCWLPDO-CQSZACIVSA-N -1 1 339.313 4.334 20 0 EIADMM CC(C)(C)c1ccc(CC(=O)Nc2ccc(-n3ccc(=O)[n-]3)cc2)cc1 ZINC001144868963 1048873729 /nfs/dbraw/zinc/87/37/29/1048873729.db2.gz MNGDRGQOTYRMAZ-UHFFFAOYSA-N -1 1 349.434 4.057 20 0 EIADMM CCOc1cccc2cc([C@@H](C)NC(=O)c3cc(F)ccc3[O-])oc21 ZINC001135846817 1048927253 /nfs/dbraw/zinc/92/72/53/1048927253.db2.gz YUFIXWULIXAZBF-LLVKDONJSA-N -1 1 343.354 4.167 20 0 EIADMM O=C(N[C@@H](c1cccs1)C1CC1)c1ccc(C(F)(F)F)c([O-])c1 ZINC001136056631 1049059066 /nfs/dbraw/zinc/05/90/66/1049059066.db2.gz VOPCQJXQWCVRKC-CQSZACIVSA-N -1 1 341.354 4.354 20 0 EIADMM CC(C)(C)C[C@H](NC(=O)c1cncc([O-])c1)c1ccc(Cl)cc1 ZINC001147496123 1049166934 /nfs/dbraw/zinc/16/69/34/1049166934.db2.gz WVGMGRUYMJXMSR-INIZCTEOSA-N -1 1 332.831 4.348 20 0 EIADMM CC(C)c1ccc(C(=O)N2C[C@@H](C)CN(C)c3ccccc32)c([O-])c1 ZINC001148140788 1049268664 /nfs/dbraw/zinc/26/86/64/1049268664.db2.gz JUHDIDHYRYWYDX-HNNXBMFYSA-N -1 1 338.451 4.248 20 0 EIADMM Cc1cc(C)c(C)c(S(=O)(=O)[N-]c2ccc3[nH]ccc3c2)c1C ZINC000078677283 1049270577 /nfs/dbraw/zinc/27/05/77/1049270577.db2.gz YETNPKIJZHACNE-UHFFFAOYSA-N -1 1 328.437 4.202 20 0 EIADMM CC[C@H](Cc1ccc(C)cc1)N(C)C(=O)c1c([O-])cccc1Cl ZINC001148224047 1049281785 /nfs/dbraw/zinc/28/17/85/1049281785.db2.gz JGMYVUCOWHOPMG-OAHLLOKOSA-N -1 1 331.843 4.447 20 0 EIADMM Cc1c(F)ccc(N)c1C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC001148254007 1049288627 /nfs/dbraw/zinc/28/86/27/1049288627.db2.gz ZUTKSOUISPLHQX-UHFFFAOYSA-N -1 1 344.773 4.481 20 0 EIADMM O=C(NCCc1cccc(-c2ccccc2)c1)c1ccc([O-])c(F)c1 ZINC001148735214 1049362780 /nfs/dbraw/zinc/36/27/80/1049362780.db2.gz WFRZCMQFASEMIX-UHFFFAOYSA-N -1 1 335.378 4.171 20 0 EIADMM O=C(Nc1ccc2ccncc2c1)c1ccc(C(F)(F)F)cc1[O-] ZINC001148800556 1049383159 /nfs/dbraw/zinc/38/31/59/1049383159.db2.gz HFBHFEXRHXIIME-UHFFFAOYSA-N -1 1 332.281 4.212 20 0 EIADMM CC1(C)C[C@]1(NC(=O)Cc1ccc([O-])c(Cl)c1)c1ccccc1 ZINC001148896359 1049392712 /nfs/dbraw/zinc/39/27/12/1049392712.db2.gz XZKSUDXKLVWCCM-IBGZPJMESA-N -1 1 329.827 4.030 20 0 EIADMM O=C(N[C@@H]1COCc2ccccc21)c1cccc(-c2ccccc2)c1[O-] ZINC001148872509 1049393592 /nfs/dbraw/zinc/39/35/92/1049393592.db2.gz JTQXDAXEWNSIRP-HXUWFJFHSA-N -1 1 345.398 4.061 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc3nc(C4CC4)oc3c2)cc1C ZINC000080311367 1049576974 /nfs/dbraw/zinc/57/69/74/1049576974.db2.gz DSYLZIMDUYQDSC-UHFFFAOYSA-N -1 1 342.420 4.123 20 0 EIADMM COc1cnc(C=Cc2ccc(-c3ccccc3Cl)o2)[n-]c1=O ZINC000821007236 1049594626 /nfs/dbraw/zinc/59/46/26/1049594626.db2.gz GEMGHIVKYUIDDS-CLFYSBASSA-N -1 1 328.755 4.275 20 0 EIADMM CCCN(C(=O)c1ccc([O-])cc1F)[C@@H](C)c1ccccc1OC ZINC001136437590 1049626381 /nfs/dbraw/zinc/62/63/81/1049626381.db2.gz LQLQECGJJLZNDS-ZDUSSCGKSA-N -1 1 331.387 4.153 20 0 EIADMM CSc1ccc([O-])c(C(=O)N2CC3(CCC3)c3c2cccc3F)c1 ZINC001136526346 1049721500 /nfs/dbraw/zinc/72/15/00/1049721500.db2.gz SEGAHZRRHYUBLO-UHFFFAOYSA-N -1 1 343.423 4.335 20 0 EIADMM COc1ccc(C(=O)Nc2cccc(-c3cccs3)c2)c([O-])c1 ZINC001136533725 1049726601 /nfs/dbraw/zinc/72/66/01/1049726601.db2.gz MYECHRQFLRKRMK-UHFFFAOYSA-N -1 1 325.389 4.382 20 0 EIADMM O=C(Nc1ccc(CCCc2ccccc2)cc1)c1cncc([O-])c1 ZINC001136553400 1049741457 /nfs/dbraw/zinc/74/14/57/1049741457.db2.gz ZFQLLFFVGXOFPD-UHFFFAOYSA-N -1 1 332.403 4.215 20 0 EIADMM CCCC[C@H]1CCC[C@H]1NC(=O)c1c([O-])cnc2c(F)cccc21 ZINC001136601329 1049776827 /nfs/dbraw/zinc/77/68/27/1049776827.db2.gz SUNTUEMLKJJNEX-SWLSCSKDSA-N -1 1 330.403 4.168 20 0 EIADMM Cc1noc(C(C)C)c1[N-]C(=O)c1ncc(C(F)(F)F)cc1Cl ZINC000830200042 1049794987 /nfs/dbraw/zinc/79/49/87/1049794987.db2.gz UPTSTSLHORSPCV-UHFFFAOYSA-N -1 1 347.724 4.426 20 0 EIADMM C[C@@H](NC(=O)c1cncc([O-])c1)c1ccc(Cl)c(Cl)c1Cl ZINC001136714409 1049842985 /nfs/dbraw/zinc/84/29/85/1049842985.db2.gz MEVSJSGPSDKPDB-SSDOTTSWSA-N -1 1 345.613 4.238 20 0 EIADMM CC[C@@H]1CC[C@H](C)N1C(=O)c1ccc(NC(=O)OC(C)(C)C)cc1[O-] ZINC000772872437 1049859231 /nfs/dbraw/zinc/85/92/31/1049859231.db2.gz MWFKYSNSDKBXGV-GXTWGEPZSA-N -1 1 348.443 4.142 20 0 EIADMM Cc1ccc([C@H]2CSCCN2C(=O)c2ccc(Cl)cc2[O-])cc1 ZINC001136744599 1049859538 /nfs/dbraw/zinc/85/95/38/1049859538.db2.gz WMKCGJOMKHPBLO-MRXNPFEDSA-N -1 1 347.867 4.284 20 0 EIADMM CC[C@@H](Cc1ccc(Cl)cc1)NC(=O)c1cc(Cl)ccc1[O-] ZINC001136748176 1049862518 /nfs/dbraw/zinc/86/25/18/1049862518.db2.gz DZFGPVCSTCUZEH-AWEZNQCLSA-N -1 1 338.234 4.450 20 0 EIADMM C[C@@H](NC(=O)Cc1ccc([O-])c(Cl)c1)c1nc2ccccc2s1 ZINC001136817890 1049898138 /nfs/dbraw/zinc/89/81/38/1049898138.db2.gz DVRKOXZQEUOZBR-SNVBAGLBSA-N -1 1 346.839 4.075 20 0 EIADMM CSc1c(F)cccc1[N-]C(=O)c1csc([C@H]2CCCO2)n1 ZINC000617274660 1049973817 /nfs/dbraw/zinc/97/38/17/1049973817.db2.gz FAMMPCFUSASBDJ-GFCCVEGCSA-N -1 1 338.429 4.108 20 0 EIADMM Cc1nc([C@H](C)[N@H+]2CC[C@](C)(C(=O)[O-])C2)oc1-c1ccc(Cl)cc1 ZINC000263571522 1049995152 /nfs/dbraw/zinc/99/51/52/1049995152.db2.gz JMOUNCCPEQSCDO-SGTLLEGYSA-N -1 1 348.830 4.161 20 0 EIADMM CCc1onc(C)c1[N-]C(=O)c1cnc(-c2ccccc2F)s1 ZINC000089399174 1050117220 /nfs/dbraw/zinc/11/72/20/1050117220.db2.gz MZGVXTXCFKVKBF-UHFFFAOYSA-N -1 1 331.372 4.060 20 0 EIADMM COc1ccccc1CNC(=O)Nc1cc(Cl)c(Cl)cc1[O-] ZINC001186135148 1050244989 /nfs/dbraw/zinc/24/49/89/1050244989.db2.gz FBYKFKMIMUJXAZ-UHFFFAOYSA-N -1 1 341.194 4.029 20 0 EIADMM O=C(Nc1c[nH]c2ccc(Br)cc12)c1ccc([O-])c(F)c1 ZINC001186209495 1050272363 /nfs/dbraw/zinc/27/23/63/1050272363.db2.gz USODXNRGZJPVOQ-UHFFFAOYSA-N -1 1 349.159 4.027 20 0 EIADMM CC(=O)OCc1cccc(Cl)c1Nc1cc(F)c([O-])cc1F ZINC001212777963 1050319837 /nfs/dbraw/zinc/31/98/37/1050319837.db2.gz IVTQFVRSWXQHCF-UHFFFAOYSA-N -1 1 327.714 4.131 20 0 EIADMM Cc1nc(C(C)(C)C)[n-]c(=O)c1C(=O)N1CCC(C)(C)CC(C)(C)C1 ZINC000618281133 1050333642 /nfs/dbraw/zinc/33/36/42/1050333642.db2.gz SYDMRLVNLKAECA-UHFFFAOYSA-N -1 1 347.503 4.077 20 0 EIADMM [O-]c1cnccc1-c1nc(-c2cccc(C(F)(F)F)c2Cl)no1 ZINC001212721377 1050430726 /nfs/dbraw/zinc/43/07/26/1050430726.db2.gz MWFUNPRGMBTKOP-UHFFFAOYSA-N -1 1 341.676 4.176 20 0 EIADMM CSc1ccc([O-])c(C(=O)Nc2cccc(-c3ccon3)c2)c1 ZINC001178760905 1050548080 /nfs/dbraw/zinc/54/80/80/1050548080.db2.gz DPKRWOYXOIMCBM-UHFFFAOYSA-N -1 1 326.377 4.021 20 0 EIADMM O=C(Nc1cc(C(F)(F)F)ccc1Cl)Nc1ncccc1[O-] ZINC001187489230 1050553979 /nfs/dbraw/zinc/55/39/79/1050553979.db2.gz SZKAUXVYISLZSB-UHFFFAOYSA-N -1 1 331.681 4.103 20 0 EIADMM O=C(Nc1ccc(C2CC2)c2ccccc12)c1n[n-]nc1C(F)(F)F ZINC001187766259 1050622351 /nfs/dbraw/zinc/62/23/51/1050622351.db2.gz MUVOUQPHQPRUHJ-UHFFFAOYSA-N -1 1 346.312 4.106 20 0 EIADMM CN(C)C(=O)c1ccc(Nc2c(Cl)ccc([O-])c2Cl)cc1 ZINC001174008246 1050679077 /nfs/dbraw/zinc/67/90/77/1050679077.db2.gz WKEZORKOUJZQEI-UHFFFAOYSA-N -1 1 325.195 4.144 20 0 EIADMM C[C@H](CC(=O)Nc1cc(F)c([O-])cc1Cl)c1ccccc1F ZINC001179656547 1050738540 /nfs/dbraw/zinc/73/85/40/1050738540.db2.gz SDIRHPAXJTYCPT-SECBINFHSA-N -1 1 325.742 4.456 20 0 EIADMM O=C(c1ccc(Nc2c([O-])cc(F)cc2F)cc1)N1CCCCC1 ZINC001174073242 1050745371 /nfs/dbraw/zinc/74/53/71/1050745371.db2.gz FVUBMTARTZRSST-UHFFFAOYSA-N -1 1 332.350 4.040 20 0 EIADMM Cc1cc2ccc(NC(=O)c3ccc([O-])c(C(F)(F)F)c3)cc2[nH]1 ZINC001188589098 1050810607 /nfs/dbraw/zinc/81/06/07/1050810607.db2.gz NADUVIMNNOTHBL-UHFFFAOYSA-N -1 1 334.297 4.453 20 0 EIADMM CC(C)S(=O)(=O)c1ccc(Nc2cc([O-])c(Cl)cc2F)cc1 ZINC001174269826 1050872075 /nfs/dbraw/zinc/87/20/75/1050872075.db2.gz GLLYIPPQGXQPJS-UHFFFAOYSA-N -1 1 343.807 4.110 20 0 EIADMM CC(C)n1cnc2cc(Nc3cc4ccc([O-])cc4oc3=O)ccc21 ZINC001174382538 1050946781 /nfs/dbraw/zinc/94/67/81/1050946781.db2.gz VKVHURFXFZDUSI-UHFFFAOYSA-N -1 1 335.363 4.173 20 0 EIADMM Cc1cccc(OCC(=O)Nc2cccc(C(F)(F)F)c2[O-])c1C ZINC001180499868 1051023420 /nfs/dbraw/zinc/02/34/20/1051023420.db2.gz CJZHKBFFSOWAKU-UHFFFAOYSA-N -1 1 339.313 4.045 20 0 EIADMM CNc1ncc2cc(Nc3cc(Cl)cc(Cl)c3[O-])ccc2n1 ZINC001174534824 1051029506 /nfs/dbraw/zinc/02/95/06/1051029506.db2.gz DARGSFNKMQLISD-UHFFFAOYSA-N -1 1 335.194 4.428 20 0 EIADMM Cc1cccnc1-c1nc2ccc(Oc3ccccc3)cc2c(=O)[n-]1 ZINC000620127110 1051030724 /nfs/dbraw/zinc/03/07/24/1051030724.db2.gz RCBKFWUQLBLXGB-UHFFFAOYSA-N -1 1 329.359 4.498 20 0 EIADMM CCOc1cc(C(=O)N2CCC[C@@H](C3CCC3)C2)cc(Cl)c1[O-] ZINC000620218871 1051068886 /nfs/dbraw/zinc/06/88/86/1051068886.db2.gz YFCWZWKRTBZRIX-CYBMUJFWSA-N -1 1 337.847 4.097 20 0 EIADMM COCc1cccc(CSc2nc(-c3ccccc3)cc(=O)[n-]2)c1 ZINC001190200839 1051136377 /nfs/dbraw/zinc/13/63/77/1051136377.db2.gz DPKYRIXPBKAACN-UHFFFAOYSA-N -1 1 338.432 4.288 20 0 EIADMM [O-]c1c(Cl)cc(Cl)cc1Nc1ccc(N2CCOCC2)cc1 ZINC001174709935 1051143127 /nfs/dbraw/zinc/14/31/27/1051143127.db2.gz VPOXAVQTBUPSLD-UHFFFAOYSA-N -1 1 339.222 4.279 20 0 EIADMM CCC(C)(C)c1ccc(S(=O)(=O)[N-]c2cnc(F)cc2C)cc1 ZINC001190423084 1051180618 /nfs/dbraw/zinc/18/06/18/1051180618.db2.gz CTBGLLXZTSDTFI-UHFFFAOYSA-N -1 1 336.432 4.018 20 0 EIADMM CCC(C)(C)c1ccc(S(=O)(=O)[N-]c2cccc3c2COC3)cc1 ZINC001190448719 1051189174 /nfs/dbraw/zinc/18/91/74/1051189174.db2.gz YEMCPVXBSJWRIQ-UHFFFAOYSA-N -1 1 345.464 4.205 20 0 EIADMM CC(C)Oc1ccc([N-]S(=O)(=O)c2ccc(C3CC3)cc2)cc1F ZINC001190507294 1051197732 /nfs/dbraw/zinc/19/77/32/1051197732.db2.gz QSRDSSCFJZZLHL-UHFFFAOYSA-N -1 1 349.427 4.291 20 0 EIADMM O=C(Nc1ccc(F)cc1[O-])Nc1ccccc1OC(F)(F)F ZINC001190680366 1051254615 /nfs/dbraw/zinc/25/46/15/1051254615.db2.gz HBYJSMVVIZHKQK-UHFFFAOYSA-N -1 1 330.237 4.074 20 0 EIADMM Cc1cc(F)cc(CC(=O)Nc2cccc(C(F)(F)F)c2[O-])c1 ZINC001181646226 1051268731 /nfs/dbraw/zinc/26/87/31/1051268731.db2.gz WZPSLTFEXGZVEV-UHFFFAOYSA-N -1 1 327.277 4.040 20 0 EIADMM O=C(Nc1cc(Cl)c([O-])c(Cl)c1)c1cn[nH]c1-c1ccccc1 ZINC000154705240 1051328669 /nfs/dbraw/zinc/32/86/69/1051328669.db2.gz ZWHDSXILQIPPIJ-UHFFFAOYSA-N -1 1 348.189 4.341 20 0 EIADMM Cc1ccc(-c2nnc([N-]C(=O)c3cc(C(C)C)on3)s2)c(C)c1 ZINC000154817671 1051340134 /nfs/dbraw/zinc/34/01/34/1051340134.db2.gz DSRRCNCFWKSKMJ-UHFFFAOYSA-N -1 1 342.424 4.186 20 0 EIADMM O=C(NCCCc1ccccc1)Nc1cc(Cl)c(Cl)cc1[O-] ZINC001191208689 1051384562 /nfs/dbraw/zinc/38/45/62/1051384562.db2.gz OEWMSPZPUIPZMZ-UHFFFAOYSA-N -1 1 339.222 4.453 20 0 EIADMM Cc1cc(Nc2cc3ccc([O-])cc3oc2=O)ccc1OC(C)C ZINC001175192812 1051418658 /nfs/dbraw/zinc/41/86/58/1051418658.db2.gz WVAQMMBXLRXPJL-UHFFFAOYSA-N -1 1 325.364 4.338 20 0 EIADMM CCCCCOc1ccc(Nc2cc(S(C)(=O)=O)ccc2[O-])cc1 ZINC001175297798 1051492497 /nfs/dbraw/zinc/49/24/97/1051492497.db2.gz ZXNWGTYWTDRVKI-UHFFFAOYSA-N -1 1 349.452 4.108 20 0 EIADMM O=S(=O)([N-][C@H](C1CCC1)C1CCCC1)c1sccc1Cl ZINC001191720669 1051519270 /nfs/dbraw/zinc/51/92/70/1051519270.db2.gz QCRTWGQJQBKBNE-ZDUSSCGKSA-N -1 1 333.906 4.039 20 0 EIADMM COc1ccc(C(C)C)cc1S(=O)(=O)[N-]c1cc(C)ccc1F ZINC001191698470 1051524265 /nfs/dbraw/zinc/52/42/65/1051524265.db2.gz LWJPNRQIATWCIM-UHFFFAOYSA-N -1 1 337.416 4.067 20 0 EIADMM COc1ccc2c(c1)OC(C)(C)CN(Cc1cccc([O-])c1Cl)C2 ZINC001182434771 1051559740 /nfs/dbraw/zinc/55/97/40/1051559740.db2.gz QEMYITUWWPXSKH-UHFFFAOYSA-N -1 1 347.842 4.227 20 0 EIADMM COc1ccc2cc(S(=O)(=O)[N-]c3ccc(F)c(C)c3)ccc2c1 ZINC001191932811 1051587233 /nfs/dbraw/zinc/58/72/33/1051587233.db2.gz XSIZBMXOKLNSAM-UHFFFAOYSA-N -1 1 345.395 4.097 20 0 EIADMM O=C(Nc1ncccc1[O-])Nc1c(Cl)cc(Cl)cc1Cl ZINC001192009408 1051612609 /nfs/dbraw/zinc/61/26/09/1051612609.db2.gz XIDFRCYDOSYMDN-UHFFFAOYSA-N -1 1 332.574 4.391 20 0 EIADMM CCS(=O)(=O)c1cccc(Nc2cc(Cl)c([O-])cc2Cl)c1 ZINC001175452618 1051623527 /nfs/dbraw/zinc/62/35/27/1051623527.db2.gz MKXFPVHKGVNBGS-UHFFFAOYSA-N -1 1 346.235 4.236 20 0 EIADMM O=C(Nc1ccc(OC(F)F)c(Cl)c1)Nc1cccc(F)c1[O-] ZINC001192320486 1051689284 /nfs/dbraw/zinc/68/92/84/1051689284.db2.gz OZWLKCGFRQROCQ-UHFFFAOYSA-N -1 1 346.692 4.430 20 0 EIADMM Cc1ccc(CNC(=O)c2cc([O-])cc(F)c2F)c2ccccc12 ZINC001192679016 1051790762 /nfs/dbraw/zinc/79/07/62/1051790762.db2.gz NZRUKGQYNGYYIG-UHFFFAOYSA-N -1 1 327.330 4.062 20 0 EIADMM O=c1oc2cc([O-])ccc2cc1Nc1ccc(-c2ccccc2)nc1 ZINC001175833684 1051797709 /nfs/dbraw/zinc/79/77/09/1051797709.db2.gz ZQFJKJLWVMLTSF-UHFFFAOYSA-N -1 1 330.343 4.304 20 0 EIADMM O=C([O-])c1cncc(Nc2cc(Cl)c(Cl)c(Cl)c2O)c1 ZINC001175846621 1051801302 /nfs/dbraw/zinc/80/13/02/1051801302.db2.gz JAVSJKJDQTUHJY-UHFFFAOYSA-N -1 1 333.558 4.189 20 0 EIADMM CC(C)(C(=O)Nc1nc(Cl)ccc1[O-])c1ccc(Cl)cc1F ZINC001183209709 1051811568 /nfs/dbraw/zinc/81/15/68/1051811568.db2.gz JQYXOKNAYFZJAI-UHFFFAOYSA-N -1 1 343.185 4.149 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc3ncccc3c2)c2ccccc12 ZINC001193825005 1052005797 /nfs/dbraw/zinc/00/57/97/1052005797.db2.gz RDZJEJHJSMJAAR-UHFFFAOYSA-N -1 1 348.427 4.497 20 0 EIADMM COc1cc([N-]S(=O)(=O)c2ccc(C)c3ccccc32)ccc1F ZINC001193856902 1052014846 /nfs/dbraw/zinc/01/48/46/1052014846.db2.gz ILPXMAZZAOKMHE-UHFFFAOYSA-N -1 1 345.395 4.097 20 0 EIADMM O=C(OCc1c(Cl)ccc2cccnc21)c1ccc([O-])cc1F ZINC000773573465 1052030967 /nfs/dbraw/zinc/03/09/67/1052030967.db2.gz OBMDFTRUEZKGNR-UHFFFAOYSA-N -1 1 331.730 4.090 20 0 EIADMM Cc1ccc(C)c(S(=O)(=O)[N-]c2ccc(C)c(-c3ncco3)c2)c1 ZINC000164654227 1052035336 /nfs/dbraw/zinc/03/53/36/1052035336.db2.gz SZIVUQWDOKBKKV-UHFFFAOYSA-N -1 1 342.420 4.068 20 0 EIADMM CCCC[C@@H](CC)COC(=O)Nc1cc2ccc([O-])cc2oc1=O ZINC001193950818 1052046131 /nfs/dbraw/zinc/04/61/31/1052046131.db2.gz HBYHFLNTIJCAKF-GFCCVEGCSA-N -1 1 333.384 4.264 20 0 EIADMM CSc1cc(C)nc(SC)c1[N-]C(=O)c1nc(C)ccc1C ZINC001184578000 1052047599 /nfs/dbraw/zinc/04/75/99/1052047599.db2.gz RGAZQDSBRPGNIB-UHFFFAOYSA-N -1 1 333.482 4.098 20 0 EIADMM CC(=O)c1c(C)cc(C)c(COC(=O)c2ccc([O-])cc2F)c1C ZINC000773578466 1052076049 /nfs/dbraw/zinc/07/60/49/1052076049.db2.gz HJAVLCDJYYKZIR-UHFFFAOYSA-N -1 1 330.355 4.016 20 0 EIADMM [O-]c1c(Cl)cc(Cl)cc1Nc1cnc(N2CCCCC2)nc1 ZINC001176507330 1052101107 /nfs/dbraw/zinc/10/11/07/1052101107.db2.gz KFAKJUVUQZZVOZ-UHFFFAOYSA-N -1 1 339.226 4.223 20 0 EIADMM O=C([O-])C1(c2ccc(Nc3ccncc3Oc3ccccc3)cc2)CC1 ZINC001176582308 1052121236 /nfs/dbraw/zinc/12/12/36/1052121236.db2.gz MVSOTQVYZQXYNN-UHFFFAOYSA-N -1 1 346.386 4.156 20 0 EIADMM Cc1cccc(C)c1[N-]S(=O)(=O)c1cccc2c(Cl)nccc21 ZINC001194454806 1052148777 /nfs/dbraw/zinc/14/87/77/1052148777.db2.gz HANSDZVRVMPXKH-UHFFFAOYSA-N -1 1 346.839 4.306 20 0 EIADMM O=c1ccn(-c2ccc(Nc3ccc(OC(F)(F)F)cc3)cc2)[n-]1 ZINC001176643609 1052152101 /nfs/dbraw/zinc/15/21/01/1052152101.db2.gz CVWQTBJGBLXVND-UHFFFAOYSA-N -1 1 335.285 4.220 20 0 EIADMM Cc1cnc(Br)cc1Nc1c(F)cc(F)c([O-])c1F ZINC001176664392 1052156912 /nfs/dbraw/zinc/15/69/12/1052156912.db2.gz XMSXZUFOCWCBHB-UHFFFAOYSA-N -1 1 333.107 4.019 20 0 EIADMM Cc1cc(Br)c(Nc2c(F)cc(F)c([O-])c2F)nc1C ZINC001176664722 1052157033 /nfs/dbraw/zinc/15/70/33/1052157033.db2.gz YRPPQASBAQVJJY-UHFFFAOYSA-N -1 1 347.134 4.327 20 0 EIADMM Cc1nc(Br)ccc1Nc1c(F)cc(F)c([O-])c1F ZINC001176664141 1052158001 /nfs/dbraw/zinc/15/80/01/1052158001.db2.gz UCYPLNCBBULXOY-UHFFFAOYSA-N -1 1 333.107 4.019 20 0 EIADMM COc1ccc(-n2cccc2)c(Nc2c(F)cc(F)c([O-])c2F)c1 ZINC001176671791 1052159328 /nfs/dbraw/zinc/15/93/28/1052159328.db2.gz PETLJHQSMFVEDV-UHFFFAOYSA-N -1 1 334.297 4.352 20 0 EIADMM [O-]c1c(F)cc(F)c(Nc2c(O)cccc2Br)c1F ZINC001176671749 1052159488 /nfs/dbraw/zinc/15/94/88/1052159488.db2.gz NKNRVVZEJQNYGL-UHFFFAOYSA-N -1 1 334.091 4.021 20 0 EIADMM Cc1nc2cc([N-]S(=O)(=O)c3c(C)cccc3C)ccc2s1 ZINC001194603386 1052175877 /nfs/dbraw/zinc/17/58/77/1052175877.db2.gz VOKWXRVKKOMVIP-UHFFFAOYSA-N -1 1 332.450 4.022 20 0 EIADMM Cc1cccc(C)c1S(=O)(=O)[N-]c1cc(Cl)c2ncccc2c1 ZINC001194643313 1052184826 /nfs/dbraw/zinc/18/48/26/1052184826.db2.gz SRSBLADYNOHPRS-UHFFFAOYSA-N -1 1 346.839 4.306 20 0 EIADMM Cc1cccc(C)c1S(=O)(=O)[N-]c1ccc2c(c1)CCCCC2=O ZINC001194645186 1052185787 /nfs/dbraw/zinc/18/57/87/1052185787.db2.gz ZGLRFDIKOVHGFC-UHFFFAOYSA-N -1 1 343.448 4.013 20 0 EIADMM CC(C)Oc1ccccc1NC(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000622307935 1052188098 /nfs/dbraw/zinc/18/80/98/1052188098.db2.gz PTKILKNXCPHCBV-UHFFFAOYSA-N -1 1 339.313 4.451 20 0 EIADMM CC(C)(C)CC[N-]S(=O)(=O)c1sc2ccccc2c1Cl ZINC001185263106 1052206011 /nfs/dbraw/zinc/20/60/11/1052206011.db2.gz DZLBPPJKWHRDBE-UHFFFAOYSA-N -1 1 331.890 4.269 20 0 EIADMM Cc1ccc(F)c(NC(=O)Nc2cccc([O-])c2Br)c1 ZINC001185267514 1052206669 /nfs/dbraw/zinc/20/66/69/1052206669.db2.gz GTAYUYZWZUAOHM-UHFFFAOYSA-N -1 1 339.164 4.246 20 0 EIADMM O=C(Cc1ccc(Cl)c(Cl)c1)NCc1ccc([O-])c(Cl)c1 ZINC001176988276 1052214890 /nfs/dbraw/zinc/21/48/90/1052214890.db2.gz JRVFBTFYZMSFBR-UHFFFAOYSA-N -1 1 344.625 4.211 20 0 EIADMM Cc1cc(CCCC(=O)NCc2ccc([O-])c(Cl)c2)c(C)s1 ZINC001176987702 1052214997 /nfs/dbraw/zinc/21/49/97/1052214997.db2.gz COFHWFNEUSKYFR-UHFFFAOYSA-N -1 1 337.872 4.363 20 0 EIADMM CCSCc1cc(C(=O)[N-]c2ccccc2SC(F)F)no1 ZINC000184795714 1052223904 /nfs/dbraw/zinc/22/39/04/1052223904.db2.gz SIUDUOILBWIBGI-UHFFFAOYSA-N -1 1 344.408 4.495 20 0 EIADMM CCC1(CC)CN(C(=O)c2c(F)ccc([O-])c2F)c2ccccc21 ZINC000622459187 1052276624 /nfs/dbraw/zinc/27/66/24/1052276624.db2.gz MOJFWQHKZFDWFR-UHFFFAOYSA-N -1 1 331.362 4.389 20 0 EIADMM COc1cc(C)c(NC(=O)c2cc3ccccc3cc2[O-])cc1F ZINC000622520105 1052312894 /nfs/dbraw/zinc/31/28/94/1052312894.db2.gz DEVRQEOLRHWGBC-UHFFFAOYSA-N -1 1 325.339 4.254 20 0 EIADMM CC1(C)CN(C(=O)c2cc3ccccc3cc2[O-])Cc2ccccc2O1 ZINC000622604391 1052344705 /nfs/dbraw/zinc/34/47/05/1052344705.db2.gz CAPMPMRJELBXSU-UHFFFAOYSA-N -1 1 347.414 4.359 20 0 EIADMM CCC(C)(C)CC(=O)N1CCC(c2n[n-]c(=S)n2C(C)C)CC1 ZINC000073082362 1052689909 /nfs/dbraw/zinc/68/99/09/1052689909.db2.gz XCSWFTVFCCBYFY-UHFFFAOYSA-N -1 1 338.521 4.054 20 0 EIADMM COc1cc(C)c(S(=O)(=O)[N-]c2csc(Cl)c2)c(C)c1C ZINC001194836489 1053126465 /nfs/dbraw/zinc/12/64/65/1053126465.db2.gz BTBARQNJEJNORA-UHFFFAOYSA-N -1 1 345.873 4.136 20 0 EIADMM Cc1cccc(Cl)c1S(=O)(=O)[N-]c1cccc(Cl)c1F ZINC001195307944 1053372524 /nfs/dbraw/zinc/37/25/24/1053372524.db2.gz CVOCGHVKKALOII-UHFFFAOYSA-N -1 1 334.199 4.242 20 0 EIADMM CCOC(=O)NC(=S)[N-]c1ccccc1-c1ccc(Cl)cc1 ZINC001195490558 1053422528 /nfs/dbraw/zinc/42/25/28/1053422528.db2.gz JAQQHQKEIXKKCF-UHFFFAOYSA-N -1 1 334.828 4.450 20 0 EIADMM Cc1ccc(-c2ccccc2)c([N-]S(=O)(=O)c2ccc(O)cc2)c1 ZINC001195810565 1053494993 /nfs/dbraw/zinc/49/49/93/1053494993.db2.gz JDADDDLVKXQZJD-UHFFFAOYSA-N -1 1 339.416 4.168 20 0 EIADMM C[C@@H](NC(=O)c1c([O-])cccc1Cl)c1ccccc1OC(F)F ZINC000765426175 1053542642 /nfs/dbraw/zinc/54/26/42/1053542642.db2.gz NEELZKFMHSIWPR-SECBINFHSA-N -1 1 341.741 4.138 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2cc(Cl)c(C)cc2F)c(F)c1 ZINC001196384358 1053652944 /nfs/dbraw/zinc/65/29/44/1053652944.db2.gz MDMMNHLSPIAYFQ-UHFFFAOYSA-N -1 1 331.771 4.036 20 0 EIADMM Cc1ccc(C(=O)CCC(=O)Nc2ccc([O-])c(Cl)c2)cc1C ZINC000111667123 1053719188 /nfs/dbraw/zinc/71/91/88/1053719188.db2.gz AYJIKZNBEPEQSK-UHFFFAOYSA-N -1 1 331.799 4.264 20 0 EIADMM [O-]c1cc(NC(=S)NCc2ccccc2Cl)c(F)cc1Cl ZINC001196823991 1053784187 /nfs/dbraw/zinc/78/41/87/1053784187.db2.gz IPDYHDFADVHONN-UHFFFAOYSA-N -1 1 345.226 4.325 20 0 EIADMM Cc1nc(-c2ccc(CNC(=O)c3cc(Cl)ccc3[O-])o2)cs1 ZINC000024247151 1053801514 /nfs/dbraw/zinc/80/15/14/1053801514.db2.gz VWONGYQMUKTVFW-UHFFFAOYSA-N -1 1 348.811 4.001 20 0 EIADMM CCCc1nc(C)c([N-]S(=O)(=O)/C=C\c2ccc(C)cc2)s1 ZINC000776742204 1053816129 /nfs/dbraw/zinc/81/61/29/1053816129.db2.gz SKYYRTGZIYEFLI-KHPPLWFESA-N -1 1 336.482 4.125 20 0 EIADMM O=c1ccn(-c2ccc(NC(=S)Nc3ccc(Cl)cc3)cc2)[n-]1 ZINC001197337995 1053889121 /nfs/dbraw/zinc/88/91/21/1053889121.db2.gz KZNUUZTXQPCPHY-UHFFFAOYSA-N -1 1 344.827 4.040 20 0 EIADMM CCCCC[C@@H](CC)C(=O)N1CCC(C(=O)c2ccc([O-])cc2)CC1 ZINC000775774570 1053907896 /nfs/dbraw/zinc/90/78/96/1053907896.db2.gz OAJFHHXXVBKRER-MRXNPFEDSA-N -1 1 345.483 4.420 20 0 EIADMM Cc1nc(C(C)C)[n-]c(=O)c1C(=O)N(C)C1CC(C)(C)CC(C)(C)C1 ZINC000855569100 1053948826 /nfs/dbraw/zinc/94/88/26/1053948826.db2.gz RIHIWNFVMMCVOH-UHFFFAOYSA-N -1 1 347.503 4.291 20 0 EIADMM CC(C)(C)c1ccc(NC(=O)NCCc2c(F)cc([O-])cc2F)cc1 ZINC001197923340 1054023580 /nfs/dbraw/zinc/02/35/80/1054023580.db2.gz IOZVHIMKOKODPE-UHFFFAOYSA-N -1 1 348.393 4.332 20 0 EIADMM [O-]c1cc(F)c(NC(=S)Nc2cccc(C(F)(F)F)c2)c(F)c1 ZINC001198064507 1054072810 /nfs/dbraw/zinc/07/28/10/1054072810.db2.gz BZBGQCNMOQMLSV-UHFFFAOYSA-N -1 1 348.296 4.498 20 0 EIADMM CC(C)c1cc(F)ccc1[N-]S(=O)(=O)c1ccc(Cl)cc1 ZINC001251738357 1054082070 /nfs/dbraw/zinc/08/20/70/1054082070.db2.gz HIFCWLBANHMJLN-UHFFFAOYSA-N -1 1 327.808 4.403 20 0 EIADMM COc1ccc(C(=O)Nc2nc(-c3ccccc3C)cs2)c([O-])c1 ZINC000031791400 1054082252 /nfs/dbraw/zinc/08/22/52/1054082252.db2.gz BPZSYVGUFXALBF-UHFFFAOYSA-N -1 1 340.404 4.085 20 0 EIADMM Cc1cc(F)ccc1S(=O)(=O)[N-]c1ccc2oc(C(C)C)nc2c1 ZINC000032097580 1054091457 /nfs/dbraw/zinc/09/14/57/1054091457.db2.gz OJCAWQCXBGABSO-UHFFFAOYSA-N -1 1 348.399 4.200 20 0 EIADMM Cc1cc2cccc(C(=O)Nc3cccc(C(F)(F)F)c3[O-])c2[nH]1 ZINC001198573795 1054190712 /nfs/dbraw/zinc/19/07/12/1054190712.db2.gz NEYHWGJXNNKCSD-UHFFFAOYSA-N -1 1 334.297 4.453 20 0 EIADMM CC(C)Oc1ccc([N-]S(=O)(=O)c2ccc3occc3c2)cc1 ZINC001198816044 1054270092 /nfs/dbraw/zinc/27/00/92/1054270092.db2.gz CCVPTLISHOQVLO-UHFFFAOYSA-N -1 1 331.393 4.021 20 0 EIADMM O=S(=O)([N-]c1ccc(C(F)(F)F)cc1)c1ccc2occc2c1 ZINC001198816864 1054272411 /nfs/dbraw/zinc/27/24/11/1054272411.db2.gz QBZIKUXYHFMJME-UHFFFAOYSA-N -1 1 341.310 4.252 20 0 EIADMM COc1ccc([N-]S(=O)(=O)c2ccc3occc3c2)cc1C(C)C ZINC001198867836 1054293153 /nfs/dbraw/zinc/29/31/53/1054293153.db2.gz CCAQPHPEBRXAOZ-UHFFFAOYSA-N -1 1 345.420 4.366 20 0 EIADMM CCc1cc([N-]S(=O)(=O)c2ccc3occc3c2)c(C)cc1C ZINC001198870979 1054297159 /nfs/dbraw/zinc/29/71/59/1054297159.db2.gz VSHWXGDPMLNNNQ-UHFFFAOYSA-N -1 1 329.421 4.413 20 0 EIADMM O=C([N-]c1nnc(C2CCCCC2)s1)c1ccc(C(F)F)o1 ZINC000858693689 1054549582 /nfs/dbraw/zinc/54/95/82/1054549582.db2.gz VOSMEEDCPNBYND-UHFFFAOYSA-N -1 1 327.356 4.369 20 0 EIADMM Cc1ccc(-c2nc(C)c(C(=O)[N-]c3nc(C(C)C)ns3)s2)o1 ZINC000874697195 1054719476 /nfs/dbraw/zinc/71/94/76/1054719476.db2.gz GIKYIUPKODOXNA-UHFFFAOYSA-N -1 1 348.453 4.247 20 0 EIADMM O=C1[N-]C(=O)C(=Cc2ccc(Oc3cc(F)cc(F)c3)cc2)S1 ZINC000874928819 1054743377 /nfs/dbraw/zinc/74/33/77/1054743377.db2.gz WLMOIRIEJAKFKW-LHHJGKSTSA-N -1 1 333.315 4.081 20 0 EIADMM COc1cc(OC(F)(F)F)ccc1Nc1ccnc(Cl)c1[O-] ZINC001201357424 1054772586 /nfs/dbraw/zinc/77/25/86/1054772586.db2.gz UPGVQMZYZKARCV-UHFFFAOYSA-N -1 1 334.681 4.091 20 0 EIADMM O=C([N-]c1nnc(-c2ccccc2Cl)s1)c1ccc(Cl)o1 ZINC000065852941 1054969853 /nfs/dbraw/zinc/96/98/53/1054969853.db2.gz KFZPEMKBZZUDFK-UHFFFAOYSA-N -1 1 340.191 4.357 20 0 EIADMM O=C(Nc1cc([O-])c(F)cc1F)Nc1ccccc1C(F)(F)F ZINC001202167751 1055067009 /nfs/dbraw/zinc/06/70/09/1055067009.db2.gz DTRUMKLQARNPNX-UHFFFAOYSA-N -1 1 332.228 4.333 20 0 EIADMM CC[C@@H](C)c1cccc(NC(=O)c2c(C)nc(C(C)C)[n-]c2=O)c1 ZINC000862485707 1055074569 /nfs/dbraw/zinc/07/45/69/1055074569.db2.gz COXVHFPUAZTYCG-GFCCVEGCSA-N -1 1 327.428 4.380 20 0 EIADMM O=C(OCc1cc(=O)oc2cc([O-])ccc12)c1ccc2ccccc2c1 ZINC000006460689 1055255968 /nfs/dbraw/zinc/25/59/68/1055255968.db2.gz GLJFKGLAXFMDLZ-UHFFFAOYSA-N -1 1 346.338 4.009 20 0 EIADMM CC(=O)n1ncc2ccc(Nc3ccc(Cl)c(Cl)c3[O-])cc21 ZINC001212422563 1055724659 /nfs/dbraw/zinc/72/46/59/1055724659.db2.gz FXOSOFXUIDNCRY-UHFFFAOYSA-N -1 1 336.178 4.452 20 0 EIADMM COc1ccsc1C(=O)[N-]c1nc(Sc2ccccc2)ns1 ZINC000110768561 1056693595 /nfs/dbraw/zinc/69/35/95/1056693595.db2.gz XOAQFGWHYDUMGX-UHFFFAOYSA-N -1 1 349.462 4.012 20 0 EIADMM CC[C@H](C)c1ccc(S(=O)(=O)[N-]c2cccc(C(C)=O)c2)cc1 ZINC000007056221 1056760718 /nfs/dbraw/zinc/76/07/18/1056760718.db2.gz AAFIKSRVSRGUMS-ZDUSSCGKSA-N -1 1 331.437 4.204 20 0 EIADMM [O-]c1c(F)cc(Nc2cc(Br)ncc2F)cc1Cl ZINC001214485264 1056809383 /nfs/dbraw/zinc/80/93/83/1056809383.db2.gz YBJGBBNYJZWBTL-UHFFFAOYSA-N -1 1 335.535 4.225 20 0 EIADMM Cc1ccc(/C=C\S(=O)(=O)[N-]c2cc(Cl)c(Cl)cn2)cc1 ZINC000743048445 1058849575 /nfs/dbraw/zinc/84/95/75/1058849575.db2.gz PLTNLMSQMGPQTB-SREVYHEPSA-N -1 1 343.235 4.109 20 0 EIADMM CCCCCC[C@@H](C)C(=O)N1CCC(C(=O)c2ccc([O-])cc2)CC1 ZINC000743296357 1058917045 /nfs/dbraw/zinc/91/70/45/1058917045.db2.gz XBINTCNAIFYRHJ-MRXNPFEDSA-N -1 1 345.483 4.420 20 0 EIADMM O=C(CCc1ccc(Cl)c(Cl)c1)Nc1c([O-])cccc1F ZINC000743415583 1058992056 /nfs/dbraw/zinc/99/20/56/1058992056.db2.gz HJYOUQUNESQXEE-UHFFFAOYSA-N -1 1 328.170 4.409 20 0 EIADMM CC(=O)c1ccc([O-])c(CCOC(=O)c2cc3sccc3s2)c1 ZINC000744839306 1059645036 /nfs/dbraw/zinc/64/50/36/1059645036.db2.gz GIQYWDAAWNVTAD-UHFFFAOYSA-N -1 1 346.429 4.271 20 0 EIADMM CCc1ccc([C@@H](C)C(=O)OCCc2cc(C(C)=O)ccc2[O-])cc1 ZINC000744945597 1059673288 /nfs/dbraw/zinc/67/32/88/1059673288.db2.gz PFQUFVPTSCIZAX-CQSZACIVSA-N -1 1 340.419 4.047 20 0 EIADMM C[C@H](CCCc1ccccc1)C(=O)Nc1ccc(-n2ccc(=O)[n-]2)cc1 ZINC001168914871 1060517492 /nfs/dbraw/zinc/51/74/92/1060517492.db2.gz PWQBLFFGAHASPX-MRXNPFEDSA-N -1 1 349.434 4.175 20 0 EIADMM O=C(Nc1cccc(C2SCCS2)c1)c1ccc([O-])c(F)c1 ZINC000767295557 1061184934 /nfs/dbraw/zinc/18/49/34/1061184934.db2.gz KDSJDVSZUQKBMX-UHFFFAOYSA-N -1 1 335.425 4.262 20 0 EIADMM O=C(Nc1cccc(COc2ccccc2)c1)c1ccc([O-])c(F)c1 ZINC000767312695 1061196965 /nfs/dbraw/zinc/19/69/65/1061196965.db2.gz NWGFQMRRFVJQHD-UHFFFAOYSA-N -1 1 337.350 4.363 20 0 EIADMM CC(C)Oc1ccc([N-]S(=O)(=O)c2ccc(F)cc2Cl)cc1 ZINC000071977268 203156590 /nfs/dbraw/zinc/15/65/90/203156590.db2.gz ZEZMVZWCYZTGNS-UHFFFAOYSA-N -1 1 343.807 4.067 20 0 EIADMM O=C(NCCc1ccc(Cl)cc1)c1cc2ccccc2cc1[O-] ZINC000006584458 206516967 /nfs/dbraw/zinc/51/69/67/206516967.db2.gz AWDPSKHWWLVOBV-UHFFFAOYSA-N -1 1 325.795 4.171 20 0 EIADMM Cc1c(F)cccc1-c1ccc(CNCc2cccc(C(=O)[O-])c2)o1 ZINC000683175832 1019101867 /nfs/dbraw/zinc/10/18/67/1019101867.db2.gz AVCSXOYIESKRSD-UHFFFAOYSA-N -1 1 339.366 4.382 20 0 EIADMM CCC[C@@H]1CCc2nc(NC(=O)c3ccc([O-])c(F)c3)sc2C1 ZINC001143379357 1020998101 /nfs/dbraw/zinc/99/81/01/1020998101.db2.gz SSQZZVAIOIFWAJ-SNVBAGLBSA-N -1 1 334.416 4.145 20 0 EIADMM C/C=C\c1ccc(OCC(=O)Nc2ccc([O-])c(Cl)c2)c(OC)c1 ZINC000255076245 1021134345 /nfs/dbraw/zinc/13/43/45/1021134345.db2.gz HFVVYULVMFVKLI-ARJAWSKDSA-N -1 1 347.798 4.105 20 0 EIADMM CC(=O)c1cc(F)c([N-]C(=O)c2csc(-c3ccoc3)n2)c(F)c1 ZINC000340531262 1021222751 /nfs/dbraw/zinc/22/27/51/1021222751.db2.gz JJUKJQSYJUUGOZ-UHFFFAOYSA-N -1 1 348.330 4.136 20 0 EIADMM CC1(C)CN(C(=O)c2ccc(C(F)(F)F)c([O-])c2)[C@@H]2CCC[C@H]21 ZINC000647497180 1021591463 /nfs/dbraw/zinc/59/14/63/1021591463.db2.gz VHJVEEYWPRMDBO-DGCLKSJQSA-N -1 1 327.346 4.062 20 0 EIADMM CC1(C)CN(C(=O)c2ccc(C(F)(F)F)c([O-])c2)[C@H]2CCC[C@H]21 ZINC000647497182 1021592019 /nfs/dbraw/zinc/59/20/19/1021592019.db2.gz VHJVEEYWPRMDBO-YPMHNXCESA-N -1 1 327.346 4.062 20 0 EIADMM Cc1cccc(C(C)C)c1[N-]S(=O)(=O)c1ccc2c(c1)C(=O)CC2 ZINC000656184397 1021879432 /nfs/dbraw/zinc/87/94/32/1021879432.db2.gz RIIXKGUVSMOISQ-UHFFFAOYSA-N -1 1 343.448 4.048 20 0 EIADMM Cc1nc(C(F)(F)F)ccc1NC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000549352459 1022056542 /nfs/dbraw/zinc/05/65/42/1022056542.db2.gz KUJZQHCBEPDNLQ-UHFFFAOYSA-N -1 1 345.708 4.412 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2ccc(SC(F)(F)F)cc2)cc1 ZINC000064937633 1022068298 /nfs/dbraw/zinc/06/82/98/1022068298.db2.gz RWXRKKPVOQRPSW-UHFFFAOYSA-N -1 1 347.383 4.408 20 0 EIADMM CC(C)(C)c1ccccc1S(=O)(=O)[N-]c1ccc2scnc2c1 ZINC000460821713 1022206787 /nfs/dbraw/zinc/20/67/87/1022206787.db2.gz WRRQEOSUZRAUCQ-UHFFFAOYSA-N -1 1 346.477 4.395 20 0 EIADMM CCOc1cc(C(=O)N(CC)c2ccc(F)cc2)cc(Cl)c1[O-] ZINC000186447121 1022612312 /nfs/dbraw/zinc/61/23/12/1022612312.db2.gz OUKSVLGCQASKDC-UHFFFAOYSA-N -1 1 337.778 4.250 20 0 EIADMM CCc1cccc(C)c1[N-]S(=O)(=O)c1ccc(Cl)c(OC)c1 ZINC000414371597 1022782718 /nfs/dbraw/zinc/78/27/18/1022782718.db2.gz NEEIHSCCDBIGMP-UHFFFAOYSA-N -1 1 339.844 4.020 20 0 EIADMM Nc1nc(Cl)ccc1C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC001167444705 1022817114 /nfs/dbraw/zinc/81/71/14/1022817114.db2.gz MDNGUMVSRGCBGF-UHFFFAOYSA-N -1 1 348.189 4.082 20 0 EIADMM O=S(=O)([N-]c1cccc(C(F)F)c1)c1ccc(C(F)F)cc1 ZINC000581331937 1023029526 /nfs/dbraw/zinc/02/95/26/1023029526.db2.gz OYJQXLNVYRXNKW-UHFFFAOYSA-N -1 1 333.306 4.363 20 0 EIADMM Cc1cc2[n-]c(CCc3ccc(OC(F)F)cc3)nc(=O)c2s1 ZINC000656490408 1023038444 /nfs/dbraw/zinc/03/84/44/1023038444.db2.gz CJLLGFUZMDULJI-UHFFFAOYSA-N -1 1 336.363 4.092 20 0 EIADMM C[C@H](c1ccco1)N(C(=O)c1ccc(C(F)(F)F)cc1[O-])C1CC1 ZINC000182020999 1023284410 /nfs/dbraw/zinc/28/44/10/1023284410.db2.gz IEZGRDDMKBFDEC-SNVBAGLBSA-N -1 1 339.313 4.370 20 0 EIADMM C[C@@H]1CC[N@@H+](CCSc2cc(Cl)ccc2Cl)C[C@H]1C(=O)[O-] ZINC000584779979 1023311504 /nfs/dbraw/zinc/31/15/04/1023311504.db2.gz ZISHGQYQBOTYBS-ZYHUDNBSSA-N -1 1 348.295 4.128 20 0 EIADMM O=C(Nc1ccc(Cl)c(OC(F)F)c1)c1ccc([O-])cc1F ZINC000183203701 1023351063 /nfs/dbraw/zinc/35/10/63/1023351063.db2.gz YVKSUEOSGYNJGB-UHFFFAOYSA-N -1 1 331.677 4.038 20 0 EIADMM CC(C)c1ncc(CN[C@@H](CC(=O)[O-])c2cccc(Cl)c2)s1 ZINC000417559454 1023355403 /nfs/dbraw/zinc/35/54/03/1023355403.db2.gz XUPOGCGLLJMZOC-AWEZNQCLSA-N -1 1 338.860 4.226 20 0 EIADMM CCc1ccc(-c2ccc(CN[C@H](C(=O)[O-])[C@@H](C)C3CC3)o2)cc1 ZINC000417640964 1023393532 /nfs/dbraw/zinc/39/35/32/1023393532.db2.gz NWXRBYNEWUFDQL-DJJJIMSYSA-N -1 1 327.424 4.098 20 0 EIADMM O=C(Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)c1ccc(Cl)cc1Cl ZINC000613665305 1023474885 /nfs/dbraw/zinc/47/48/85/1023474885.db2.gz SPYGQBLAZJUOMI-UHFFFAOYSA-N -1 1 348.189 4.341 20 0 EIADMM Cc1nc(-c2ccc(NC[C@@H]3CCCC3(C)C)nc2)[n-]c(=O)c1C ZINC000549246357 1023547421 /nfs/dbraw/zinc/54/74/21/1023547421.db2.gz HFDNBMWITFYQCG-HNNXBMFYSA-N -1 1 326.444 4.099 20 0 EIADMM O=C([O-])CC[C@H]1CCCCN1Cc1cc(Cl)ccc1OC(F)F ZINC000320340395 1023622249 /nfs/dbraw/zinc/62/22/49/1023622249.db2.gz AWHSFFXLODECRQ-CYBMUJFWSA-N -1 1 347.789 4.161 20 0 EIADMM Cc1cccc(C)c1[C@H](C)NC(=O)c1ccc(Br)c([O-])c1 ZINC000544943055 1023700202 /nfs/dbraw/zinc/70/02/02/1023700202.db2.gz JLLVZDIDNQZHTH-LBPRGKRZSA-N -1 1 348.240 4.263 20 0 EIADMM CC(C)c1ccc(-c2nc(C[N@@H+](C)CCCC(=O)[O-])cs2)cc1 ZINC000430660002 1023726396 /nfs/dbraw/zinc/72/63/96/1023726396.db2.gz CDQUGSARYKPKMG-UHFFFAOYSA-N -1 1 332.469 4.230 20 0 EIADMM CC(C)c1ccc(-c2nc(CN(C)CCCC(=O)[O-])cs2)cc1 ZINC000430660002 1023726403 /nfs/dbraw/zinc/72/64/03/1023726403.db2.gz CDQUGSARYKPKMG-UHFFFAOYSA-N -1 1 332.469 4.230 20 0 EIADMM CCOc1cc(/C=C2\C(=O)Nc3ccc(F)cc32)cc(Cl)c1[O-] ZINC000255386511 1023869416 /nfs/dbraw/zinc/86/94/16/1023869416.db2.gz XWDMWKWJTWMQIZ-XGICHPGQSA-N -1 1 333.746 4.076 20 0 EIADMM C[C@H]1CCC[C@H](C)N1Cc1csc(-c2cccc(C(=O)[O-])c2)n1 ZINC000652367149 1024735800 /nfs/dbraw/zinc/73/58/00/1024735800.db2.gz RYRDDPPJQXVWDI-STQMWFEESA-N -1 1 330.453 4.271 20 0 EIADMM Cc1ccnc2c1cccc2S(=O)(=O)[N-]c1ccsc1Cl ZINC000520953707 1024843368 /nfs/dbraw/zinc/84/33/68/1024843368.db2.gz DRPLGTXXBOEMGZ-UHFFFAOYSA-N -1 1 338.841 4.059 20 0 EIADMM O=C([O-])CC[C@@H]1CCCN(Cc2nc(C3CCCCC3)cs2)C1 ZINC000652496439 1024854010 /nfs/dbraw/zinc/85/40/10/1024854010.db2.gz VODLRCINNJNYCK-AWEZNQCLSA-N -1 1 336.501 4.268 20 0 EIADMM Cc1nc2ccc(S(=O)(=O)[N-]c3ccc4ccoc4c3)cc2s1 ZINC000427315561 1025215715 /nfs/dbraw/zinc/21/57/15/1025215715.db2.gz OOHBYFGLFMCDBD-UHFFFAOYSA-N -1 1 344.417 4.152 20 0 EIADMM C[C@H]1CO[C@H](c2ccccc2)CN1C(=O)c1ccc2ccccc2c1[O-] ZINC000110314679 1033267316 /nfs/dbraw/zinc/26/73/16/1033267316.db2.gz CWQIURZJSPOPPV-YWZLYKJASA-N -1 1 347.414 4.148 20 0 EIADMM O=S(=O)([N-]c1ccccc1F)c1c(Cl)ccc2ccccc21 ZINC000440292361 1025805056 /nfs/dbraw/zinc/80/50/56/1025805056.db2.gz MTBCPQXWWSKHPA-UHFFFAOYSA-N -1 1 335.787 4.433 20 0 EIADMM CC(C)c1ccc([C@@H](CC(=O)[O-])NCc2cccnc2Cl)cc1 ZINC000277380570 1025838270 /nfs/dbraw/zinc/83/82/70/1025838270.db2.gz QUYJVEIHBYRXSF-MRXNPFEDSA-N -1 1 332.831 4.164 20 0 EIADMM CCc1ccc(S(=O)(=O)[N-]c2ccc(Cl)cc2Cl)s1 ZINC000071974106 1025981918 /nfs/dbraw/zinc/98/19/18/1025981918.db2.gz XHLZAHJXNGBKAJ-UHFFFAOYSA-N -1 1 336.265 4.418 20 0 EIADMM Cc1csc(CCCCNC(=O)c2cc3ccccc3cc2[O-])n1 ZINC000110621669 1026022602 /nfs/dbraw/zinc/02/26/02/1026022602.db2.gz HGTNXLNHJOQVOC-UHFFFAOYSA-N -1 1 340.448 4.063 20 0 EIADMM CC(C)c1ccc(S(=O)(=O)[N-]c2ccc(-c3cnco3)cc2)cc1 ZINC000119776001 1026083810 /nfs/dbraw/zinc/08/38/10/1026083810.db2.gz RNUYMTIBKNDLPA-UHFFFAOYSA-N -1 1 342.420 4.266 20 0 EIADMM CCCN(CC1CCCCC1)C(=O)c1c(C)nc(C(C)(C)C)[n-]c1=O ZINC000582362093 1026495276 /nfs/dbraw/zinc/49/52/76/1026495276.db2.gz WWTSQTXAYSOZKG-UHFFFAOYSA-N -1 1 347.503 4.221 20 0 EIADMM CCC/C=C\c1nc(-c2cc(Br)c([O-])c(OC)c2)no1 ZINC000664849214 1026523391 /nfs/dbraw/zinc/52/33/91/1026523391.db2.gz AZGMPNRQJOCRMT-WAYWQWQTSA-N -1 1 339.189 4.027 20 0 EIADMM Cc1ccoc1CN[C@@H](CC(=O)[O-])c1cc(Cl)cc(Cl)c1 ZINC000426758999 1026543511 /nfs/dbraw/zinc/54/35/11/1026543511.db2.gz VDHOVXJZQYDSPF-ZDUSSCGKSA-N -1 1 328.195 4.200 20 0 EIADMM O=C([O-])[C@H](NCc1ccccc1Cl)c1ccc(Cl)c(F)c1 ZINC000426762869 1026548315 /nfs/dbraw/zinc/54/83/15/1026548315.db2.gz ODALWKFCNRCRQL-CQSZACIVSA-N -1 1 328.170 4.048 20 0 EIADMM Cc1ccc([C@@H](CC(=O)[O-])NCc2ccc(Cl)c(Cl)c2)o1 ZINC000426782251 1026556079 /nfs/dbraw/zinc/55/60/79/1026556079.db2.gz FDYINUOWQNVGME-CYBMUJFWSA-N -1 1 328.195 4.200 20 0 EIADMM Cc1ccc([C@@H](CC(=O)[O-])NCc2ccc(OCCC(C)C)cc2)o1 ZINC000426765321 1026558307 /nfs/dbraw/zinc/55/83/07/1026558307.db2.gz MMVQHERGAUBUPO-GOSISDBHSA-N -1 1 345.439 4.319 20 0 EIADMM CN(Cc1ccccc1Cl)C(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684870118 1026627615 /nfs/dbraw/zinc/62/76/15/1026627615.db2.gz LYYYQSMLSYDHMB-UHFFFAOYSA-N -1 1 343.732 4.337 20 0 EIADMM Cc1nc2cc(NC(=O)c3ccc(C(F)(F)F)c([O-])c3)ccc2o1 ZINC000684870632 1026632630 /nfs/dbraw/zinc/63/26/30/1026632630.db2.gz GSDWYJWUQMMFOT-UHFFFAOYSA-N -1 1 336.269 4.113 20 0 EIADMM COc1c(Br)cc(F)cc1Nc1cc(F)c([O-])cc1F ZINC001211715446 1026802110 /nfs/dbraw/zinc/80/21/10/1026802110.db2.gz WUIUQBCMUROAFB-UHFFFAOYSA-N -1 1 348.118 4.324 20 0 EIADMM CC(=O)Nc1ccc([O-])c(C(=O)Nc2ccc(CCC(C)C)cc2)c1 ZINC000519880529 1027024346 /nfs/dbraw/zinc/02/43/46/1027024346.db2.gz GPBYGODNNHLZQN-UHFFFAOYSA-N -1 1 340.423 4.192 20 0 EIADMM O=C(COc1cc(Cl)cc(Cl)c1)Nc1ccc([O-])c(Cl)c1 ZINC000440781069 1027054001 /nfs/dbraw/zinc/05/40/01/1027054001.db2.gz RNSOHNLKVGQCGL-UHFFFAOYSA-N -1 1 346.597 4.370 20 0 EIADMM Cc1ccc(Cl)c(O[C@H](C)C(=O)Nc2ccc([O-])c(Cl)c2)c1 ZINC000440948646 1027154405 /nfs/dbraw/zinc/15/44/05/1027154405.db2.gz MSIXCYPPFASBCT-SNVBAGLBSA-N -1 1 340.206 4.413 20 0 EIADMM Cc1c(=O)[n-]c(SCc2cc(F)cc(F)c2)nc1-c1ccccc1 ZINC000188254553 1027226319 /nfs/dbraw/zinc/22/63/19/1027226319.db2.gz HHQPXJSCVWHWIV-UHFFFAOYSA-N -1 1 344.386 4.316 20 0 EIADMM Cc1nc(C(C)(C)C)[n-]c(=O)c1C(=O)N[C@@H](C)CCC1CCCCC1 ZINC000474815393 1027541938 /nfs/dbraw/zinc/54/19/38/1027541938.db2.gz HZOZUJYPKYZQPZ-ZDUSSCGKSA-N -1 1 347.503 4.267 20 0 EIADMM C[C@@H](C[N@@H+](Cc1nc2ccccc2s1)Cc1ccccc1)C(=O)[O-] ZINC000582971312 1027790848 /nfs/dbraw/zinc/79/08/48/1027790848.db2.gz XBIMXGQAUWACAV-AWEZNQCLSA-N -1 1 340.448 4.019 20 0 EIADMM C[C@@H](CN(Cc1nc2ccccc2s1)Cc1ccccc1)C(=O)[O-] ZINC000582971312 1027790868 /nfs/dbraw/zinc/79/08/68/1027790868.db2.gz XBIMXGQAUWACAV-AWEZNQCLSA-N -1 1 340.448 4.019 20 0 EIADMM COc1cc(C(=O)N([C@H](C)c2ccco2)C2CC2)cc(Cl)c1[O-] ZINC000153646342 1027824709 /nfs/dbraw/zinc/82/47/09/1027824709.db2.gz PBKWGANKOAMKEO-SNVBAGLBSA-N -1 1 335.787 4.013 20 0 EIADMM CC[C@H](C)[C@H](C)[N-]S(=O)(=O)c1c(Cl)cccc1C(F)(F)F ZINC000523567146 1028216231 /nfs/dbraw/zinc/21/62/31/1028216231.db2.gz RWISACNKLDSGKL-IUCAKERBSA-N -1 1 343.798 4.072 20 0 EIADMM [O-]c1c(F)cc(Nc2cc(F)c(Br)cc2F)cc1F ZINC001213379447 1028232375 /nfs/dbraw/zinc/23/23/75/1028232375.db2.gz ZRYZQYVAYXCMJS-UHFFFAOYSA-N -1 1 336.082 4.455 20 0 EIADMM O=S(=O)([N-]c1ccc(Cl)c(Cl)c1)c1cccc(Cl)c1 ZINC000016101146 1028473431 /nfs/dbraw/zinc/47/34/31/1028473431.db2.gz NKXFXBCBUZUZSS-UHFFFAOYSA-N -1 1 336.627 4.448 20 0 EIADMM CC(C)Sc1ccccc1[N-]C(=O)c1nc2cccnc2s1 ZINC000346511650 1028490399 /nfs/dbraw/zinc/49/03/99/1028490399.db2.gz UODAJNKGRGSNMT-UHFFFAOYSA-N -1 1 329.450 4.444 20 0 EIADMM [O-]c1ccc(-c2noc(CCc3c[nH]c4ccccc34)n2)c(Cl)c1 ZINC000445449591 1028541737 /nfs/dbraw/zinc/54/17/37/1028541737.db2.gz WAMUHRGWCNGEIZ-UHFFFAOYSA-N -1 1 339.782 4.362 20 0 EIADMM C[C@@H](COc1ccccc1)c1nc(-c2ccc([O-])cc2Cl)no1 ZINC000445444878 1028572330 /nfs/dbraw/zinc/57/23/30/1028572330.db2.gz KQWYDUIUEWBSQI-NSHDSACASA-N -1 1 330.771 4.278 20 0 EIADMM C[C@H](COc1ccccc1)c1nc(-c2ccc([O-])cc2Cl)no1 ZINC000445444877 1028575264 /nfs/dbraw/zinc/57/52/64/1028575264.db2.gz KQWYDUIUEWBSQI-LLVKDONJSA-N -1 1 330.771 4.278 20 0 EIADMM Cc1nc(-c2ccccc2)oc1-c1nc(-c2ccc([O-])cc2F)no1 ZINC000445464898 1028581826 /nfs/dbraw/zinc/58/18/26/1028581826.db2.gz WLFHQNNHJXCYAH-UHFFFAOYSA-N -1 1 337.310 4.212 20 0 EIADMM CCC(CC)n1ccc(-c2nc(-c3ccc([O-])cc3Cl)no2)n1 ZINC000445447376 1028583450 /nfs/dbraw/zinc/58/34/50/1028583450.db2.gz ONYLCAWTBVAZNE-UHFFFAOYSA-N -1 1 332.791 4.320 20 0 EIADMM [O-]c1ccc(-c2noc(C[C@@H]3CCOc4ccccc43)n2)c(Cl)c1 ZINC000445454463 1028607782 /nfs/dbraw/zinc/60/77/82/1028607782.db2.gz ZYUIMKNURDEPOL-NSHDSACASA-N -1 1 342.782 4.204 20 0 EIADMM C[C@H](CCOc1ccccc1)c1nc(-c2ccc([O-])cc2F)no1 ZINC000445457578 1028611975 /nfs/dbraw/zinc/61/19/75/1028611975.db2.gz TUIRYVLJIZFTLW-GFCCVEGCSA-N -1 1 328.343 4.154 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cncc(-c4ccccc4)c3)n2)c(F)c1 ZINC000445457007 1028612508 /nfs/dbraw/zinc/61/25/08/1028612508.db2.gz LNWRXETZOUZMDB-UHFFFAOYSA-N -1 1 333.322 4.310 20 0 EIADMM [O-]c1ccc(-c2noc([C@H]3C[C@@H]3c3cc(F)ccc3F)n2)c(F)c1 ZINC000445457679 1028614036 /nfs/dbraw/zinc/61/40/36/1028614036.db2.gz ZGKXEWFZFOFNTA-YPMHNXCESA-N -1 1 332.281 4.131 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cc(-c4ccc(F)cc4)on3)n2)c(F)c1 ZINC000445458506 1028614081 /nfs/dbraw/zinc/61/40/81/1028614081.db2.gz YKSYCKZORWACDA-UHFFFAOYSA-N -1 1 341.273 4.042 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cccc(Br)c3)n2)c(F)c1 ZINC000445461221 1028619412 /nfs/dbraw/zinc/61/94/12/1028619412.db2.gz WGKBMANYNGSGAW-UHFFFAOYSA-N -1 1 335.132 4.011 20 0 EIADMM CCn1cc(Cc2nc(-c3ccc([O-])c(F)c3)no2)c2ccccc21 ZINC000445479909 1028623087 /nfs/dbraw/zinc/62/30/87/1028623087.db2.gz ISMYROOUFBSREE-UHFFFAOYSA-N -1 1 337.354 4.147 20 0 EIADMM COc1ccccc1C[C@H](C)Cc1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445478565 1028624554 /nfs/dbraw/zinc/62/45/54/1028624554.db2.gz CZVDXLPCIQZUSC-LBPRGKRZSA-N -1 1 342.370 4.011 20 0 EIADMM C[C@@H](Oc1cccc(Cl)c1)c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445483801 1028632228 /nfs/dbraw/zinc/63/22/28/1028632228.db2.gz VIRCBWZAHRHZLM-SECBINFHSA-N -1 1 334.734 4.375 20 0 EIADMM [O-]c1c(Br)c(F)ccc1Nc1cc(F)c(O)c(F)c1 ZINC001213386639 1028775514 /nfs/dbraw/zinc/77/55/14/1028775514.db2.gz MXUXRDGVYUVRPP-UHFFFAOYSA-N -1 1 334.091 4.021 20 0 EIADMM O=c1cc(C(F)F)nc(SCc2cc(-c3ccccc3)on2)[n-]1 ZINC000583721853 1029092940 /nfs/dbraw/zinc/09/29/40/1029092940.db2.gz TXHMDGIMHHHFFA-UHFFFAOYSA-N -1 1 335.335 4.067 20 0 EIADMM CCN(Cc1cccs1)Cc1nc2ccccc2c(C)c1C(=O)[O-] ZINC000583757812 1029132866 /nfs/dbraw/zinc/13/28/66/1029132866.db2.gz IIIJONCMBJZPEK-UHFFFAOYSA-N -1 1 340.448 4.325 20 0 EIADMM O=c1cc(C(F)F)nc(SCc2ccccc2OC(F)F)[n-]1 ZINC000583781379 1029165307 /nfs/dbraw/zinc/16/53/07/1029165307.db2.gz FLGZUTPJLFTZLG-UHFFFAOYSA-N -1 1 334.294 4.014 20 0 EIADMM COCc1ccc([C@H]2CCCN2Cc2c(Cl)cccc2C(=O)[O-])o1 ZINC000565105691 1029634225 /nfs/dbraw/zinc/63/42/25/1029634225.db2.gz IEWWXNKIESPUGH-MRXNPFEDSA-N -1 1 349.814 4.115 20 0 EIADMM CC[C@H](CNc1ccc(-c2nc(C)c(C)c(=O)[n-]2)cn1)c1ccccc1 ZINC000301380112 1029719350 /nfs/dbraw/zinc/71/93/50/1029719350.db2.gz YOOCRMMPTFWMHY-MRXNPFEDSA-N -1 1 348.450 4.467 20 0 EIADMM Cc1nc(-c2ccc(N[C@@H](c3ccccc3)C3CC3)nc2)[n-]c(=O)c1C ZINC000301496947 1029744106 /nfs/dbraw/zinc/74/41/06/1029744106.db2.gz BNKINXXGFDCTJK-IBGZPJMESA-N -1 1 346.434 4.424 20 0 EIADMM CCC[C@H](Nc1ccc(-c2nc(C)c(C)c(=O)[n-]2)cn1)c1ccccc1 ZINC000080945179 1029765692 /nfs/dbraw/zinc/76/56/92/1029765692.db2.gz IBQVVPISXGKFDN-SFHVURJKSA-N -1 1 348.450 4.402 20 0 EIADMM Cc1nc(-c2ccc(NCC3(CC(C)C)CC3)nc2)[n-]c(=O)c1C ZINC000301607634 1029771205 /nfs/dbraw/zinc/77/12/05/1029771205.db2.gz NYYXKDPMWQJCQM-UHFFFAOYSA-N -1 1 326.444 4.099 20 0 EIADMM Cc1nc(-c2ccc(NC3CCC(C(C)C)CC3)nc2)[n-]c(=O)c1C ZINC000301655933 1029782245 /nfs/dbraw/zinc/78/22/45/1029782245.db2.gz IAMSNXIYNAIUQP-UHFFFAOYSA-N -1 1 340.471 4.488 20 0 EIADMM Cc1nc(-c2ccc(NC(=O)c3cc(F)ccc3[O-])cc2)oc1C ZINC000080003769 1029814425 /nfs/dbraw/zinc/81/44/25/1029814425.db2.gz LSAYTPZTWLUAMM-UHFFFAOYSA-N -1 1 326.327 4.055 20 0 EIADMM C[C@H]1CN(C(=O)c2cc3ccccc3cc2[O-])C[C@H](c2ccccc2)O1 ZINC000143491043 1030070541 /nfs/dbraw/zinc/07/05/41/1030070541.db2.gz ICWOPYVAMVCCRW-YCRPNKLZSA-N -1 1 347.414 4.148 20 0 EIADMM Cc1ccccc1[C@H](CC(F)(F)F)NCc1ccc(C(=O)[O-])cc1 ZINC000263415745 1030370386 /nfs/dbraw/zinc/37/03/86/1030370386.db2.gz NECCSDRTIXIQEW-INIZCTEOSA-N -1 1 337.341 4.477 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2ccc(-c3ccccc3)cc2)c(C)n1 ZINC000531515148 1031326545 /nfs/dbraw/zinc/32/65/45/1031326545.db2.gz BRVAQHJDJPEVOH-UHFFFAOYSA-N -1 1 338.432 4.166 20 0 EIADMM Cc1nn(-c2ccc(Cl)cc2)c(C)c1C=C1SC(=S)[N-]C1=O ZINC000053091061 1031369172 /nfs/dbraw/zinc/36/91/72/1031369172.db2.gz AYRMJNMGKIMZRZ-QPEQYQDCSA-N -1 1 349.868 4.472 20 0 EIADMM CCCc1cc(-c2nc(-c3cc(Cl)c([O-])c(OCC)c3)no2)no1 ZINC000453165446 1031670439 /nfs/dbraw/zinc/67/04/39/1031670439.db2.gz PJQNAOAZIGVABN-UHFFFAOYSA-N -1 1 349.774 4.102 20 0 EIADMM CCc1c(Cl)cc(Nc2cnc3nccnc3c2)c([O-])c1Cl ZINC001213227125 1033609398 /nfs/dbraw/zinc/60/93/98/1033609398.db2.gz WPRZSUVQBAWRFP-UHFFFAOYSA-N -1 1 335.194 4.343 20 0 EIADMM CCCN(CCC)C(=O)c1ccc([N-]c2nnc(C(C)C)o2)cc1 ZINC001211760410 1033845834 /nfs/dbraw/zinc/84/58/34/1033845834.db2.gz CJVAGWGUDYBGSP-UHFFFAOYSA-N -1 1 330.432 4.199 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2c(C)c(F)ccc2Cl)c(F)c1 ZINC000433133832 1033903078 /nfs/dbraw/zinc/90/30/78/1033903078.db2.gz IWOQXYYJYLACQR-UHFFFAOYSA-N -1 1 331.771 4.036 20 0 EIADMM CC(C)(CCC(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)c1ccccc1 ZINC000513718006 1035486566 /nfs/dbraw/zinc/48/65/66/1035486566.db2.gz IFUDZHUSIBJEBB-UHFFFAOYSA-N -1 1 349.434 4.479 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc3cnn(C(C)C)c3c2)c(C)c1 ZINC000509538662 1036128100 /nfs/dbraw/zinc/12/81/00/1036128100.db2.gz MGDSICFZAVLYKC-UHFFFAOYSA-N -1 1 343.452 4.035 20 0 EIADMM Cc1oc(CN(C)CCSc2ccc(Cl)cc2)cc1C(=O)[O-] ZINC000571811432 1036259488 /nfs/dbraw/zinc/25/94/88/1036259488.db2.gz XGESHANAKKPDOS-UHFFFAOYSA-N -1 1 339.844 4.164 20 0 EIADMM O=c1cc(C(F)F)nc(SCc2ccc(C(F)(F)F)cc2)[n-]1 ZINC000572080978 1036406300 /nfs/dbraw/zinc/40/63/00/1036406300.db2.gz NJILWLDPSJTYIZ-UHFFFAOYSA-N -1 1 336.285 4.431 20 0 EIADMM COc1ccc([N-]S(=O)(=O)c2cc(Cl)cc(Cl)c2)c(C)c1 ZINC000589149756 1036689108 /nfs/dbraw/zinc/68/91/08/1036689108.db2.gz YAYBIGIPTBSPFW-UHFFFAOYSA-N -1 1 346.235 4.111 20 0 EIADMM COCc1cccc(S(=O)(=O)[N-]c2ccc(CCC(C)C)cc2)c1 ZINC000589436785 1036800257 /nfs/dbraw/zinc/80/02/57/1036800257.db2.gz YEUNFFUUFXJOSC-UHFFFAOYSA-N -1 1 347.480 4.222 20 0 EIADMM CC(C)(CC(=O)Nc1cccc([O-])c1Br)CC(F)F ZINC000908718264 1036908169 /nfs/dbraw/zinc/90/81/69/1036908169.db2.gz VAKKIHFFGXOIMP-UHFFFAOYSA-N -1 1 336.176 4.165 20 0 EIADMM CCC[C@H](C(=O)Nc1cccc([O-])c1Br)c1ccccn1 ZINC000908707989 1036920956 /nfs/dbraw/zinc/92/09/56/1036920956.db2.gz MBUUTQKBDCJMJN-NSHDSACASA-N -1 1 349.228 4.072 20 0 EIADMM O=S(=O)([N-]c1cc(F)ccc1Cl)c1ccc(Cl)cc1F ZINC000590264826 1037037915 /nfs/dbraw/zinc/03/79/15/1037037915.db2.gz OLXARIPDPCOKFB-UHFFFAOYSA-N -1 1 338.162 4.072 20 0 EIADMM O=C(Nc1cc([O-])c(F)cc1F)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F ZINC000909988032 1037248742 /nfs/dbraw/zinc/24/87/42/1037248742.db2.gz RSEQYFWNSSISTE-MQGAUOKCSA-N -1 1 349.299 4.224 20 0 EIADMM Cc1cccnc1[C@@H](NC(=O)c1cc2ccccc2cc1[O-])C(C)C ZINC000604244773 1037296022 /nfs/dbraw/zinc/29/60/22/1037296022.db2.gz CRJRCFJHFBRPJP-IBGZPJMESA-N -1 1 334.419 4.376 20 0 EIADMM CC(C)O[C@H](CSc1nc(C(F)F)cc(=O)[n-]1)c1ccccc1 ZINC000488265335 1037466647 /nfs/dbraw/zinc/46/66/47/1037466647.db2.gz QHHSPFPWWNYZRL-CYBMUJFWSA-N -1 1 340.395 4.378 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1CCCO[C@H](c2ccccc2)C1 ZINC000591791709 1037583251 /nfs/dbraw/zinc/58/32/51/1037583251.db2.gz JZVARMRMFWBPNN-FQEVSTJZSA-N -1 1 347.414 4.149 20 0 EIADMM C[C@H]1c2ccc(F)cc2CCN1C(=O)c1cc2ccccc2cc1[O-] ZINC000606317032 1038002390 /nfs/dbraw/zinc/00/23/90/1038002390.db2.gz FHRVXOYEOPQDGJ-ZDUSSCGKSA-N -1 1 335.378 4.444 20 0 EIADMM Cn1nc(-c2ccsc2)cc1NC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000489710866 1038214404 /nfs/dbraw/zinc/21/44/04/1038214404.db2.gz UPEUJOCKXRCCSQ-UHFFFAOYSA-N -1 1 348.815 4.152 20 0 EIADMM O=C([N-]c1ccccc1SC(F)F)c1cc(F)ccc1[N+](=O)[O-] ZINC000059356306 1038425385 /nfs/dbraw/zinc/42/53/85/1038425385.db2.gz NYKHIVGLTQAOKO-UHFFFAOYSA-N -1 1 342.298 4.301 20 0 EIADMM Cc1cc(C)c(S(=O)(=O)[N-]c2ccccc2C(F)F)c(C)c1 ZINC000424072720 1038457595 /nfs/dbraw/zinc/45/75/95/1038457595.db2.gz YVNBRTKHPMTPKD-UHFFFAOYSA-N -1 1 325.380 4.350 20 0 EIADMM O=C(Nc1ccc(F)cc1[O-])[C@H]1C[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000533971355 1038743969 /nfs/dbraw/zinc/74/39/69/1038743969.db2.gz VZKDSNYFQWRUSG-STQMWFEESA-N -1 1 339.288 4.292 20 0 EIADMM O=C(Nc1c([O-])cccc1F)c1ccc(-n2cnc3ccccc32)cc1 ZINC000608365910 1038804937 /nfs/dbraw/zinc/80/49/37/1038804937.db2.gz VFMFKWPUQMVRSW-UHFFFAOYSA-N -1 1 347.349 4.123 20 0 EIADMM C[C@H](C(=O)Nc1c([O-])cccc1F)c1ccccc1C(F)(F)F ZINC000608366749 1038804975 /nfs/dbraw/zinc/80/49/75/1038804975.db2.gz XLQITPPEQFMZSS-VIFPVBQESA-N -1 1 327.277 4.292 20 0 EIADMM CCOc1cc(-c2noc([C@@H]3CCC[C@H](F)C3)n2)cc(Cl)c1[O-] ZINC000424355503 1038820812 /nfs/dbraw/zinc/82/08/12/1038820812.db2.gz JQYSAVSFZBROIA-KOLCDFICSA-N -1 1 340.782 4.490 20 0 EIADMM C[C@@H]1CCCN(Cc2ccc(-c3ccccc3Cl)o2)[C@@H]1C(=O)[O-] ZINC000424414252 1038850792 /nfs/dbraw/zinc/85/07/92/1038850792.db2.gz GZDWSIVSBDPZGF-PXAZEXFGSA-N -1 1 333.815 4.285 20 0 EIADMM C[C@H]1CCCN(Cc2ccc(-c3ccccc3Cl)o2)[C@H]1C(=O)[O-] ZINC000424414255 1038850975 /nfs/dbraw/zinc/85/09/75/1038850975.db2.gz GZDWSIVSBDPZGF-YVEFUNNKSA-N -1 1 333.815 4.285 20 0 EIADMM Cc1nc(C(C)(C)C)[n-]c(=O)c1C(=O)N[C@@H](C)[C@@H](C)C1CCCCC1 ZINC000481208309 1039123396 /nfs/dbraw/zinc/12/33/96/1039123396.db2.gz YCRMRYKYXUNDQL-OLZOCXBDSA-N -1 1 347.503 4.123 20 0 EIADMM COc1cc(C(=O)N2CC3(CCC3)c3ccccc32)cc(Cl)c1[O-] ZINC000481460212 1039451469 /nfs/dbraw/zinc/45/14/69/1039451469.db2.gz BBAOWSIHWQTJCC-UHFFFAOYSA-N -1 1 343.810 4.136 20 0 EIADMM Cc1c(C([O-])=C(C#N)c2cc(C)nc(C)n2)sc2cccc(F)c12 ZINC000041562738 1039480254 /nfs/dbraw/zinc/48/02/54/1039480254.db2.gz QDERJMOHIDAFTF-GFCCVEGCSA-N -1 1 339.395 4.246 20 0 EIADMM O=C(CCCCCc1cccs1)Nc1ccc([O-])c(F)c1F ZINC000456795045 1039613009 /nfs/dbraw/zinc/61/30/09/1039613009.db2.gz RMBMRXZIIWLIQJ-UHFFFAOYSA-N -1 1 325.380 4.474 20 0 EIADMM Cn1cc(CCC(=O)Nc2ccc([O-])c(Cl)c2)c2ccccc21 ZINC000122278681 1039640561 /nfs/dbraw/zinc/64/05/61/1039640561.db2.gz MEBURVOWAIVUEG-UHFFFAOYSA-N -1 1 328.799 4.109 20 0 EIADMM CCC(C)(C)OCc1cccc(NC(=O)c2cncc([O-])c2)c1C ZINC000555863498 1039735594 /nfs/dbraw/zinc/73/55/94/1039735594.db2.gz MDOCXTOFXQMMML-UHFFFAOYSA-N -1 1 328.412 4.053 20 0 EIADMM CCOc1cc(C(=O)Nc2cccc3cccnc32)cc(Cl)c1[O-] ZINC000192649780 1039911581 /nfs/dbraw/zinc/91/15/81/1039911581.db2.gz QMIWGXZRCPIJQR-UHFFFAOYSA-N -1 1 342.782 4.245 20 0 EIADMM CC[C@H](C)c1ccc(S(=O)(=O)[N-]c2cc3c[nH]nc3cc2C)cc1 ZINC000479139852 1040159514 /nfs/dbraw/zinc/15/95/14/1040159514.db2.gz VPUNBXLHRFVNQR-LBPRGKRZSA-N -1 1 343.452 4.186 20 0 EIADMM CCS[C@H](C(=O)Nc1cc(C)cc(Br)c1[O-])C(C)C ZINC000482571325 1040363143 /nfs/dbraw/zinc/36/31/43/1040363143.db2.gz AVPRZXPOBYJQCZ-ZDUSSCGKSA-N -1 1 346.290 4.179 20 0 EIADMM Cc1cc(Br)c([O-])c(NC(=O)c2coc3ccccc32)c1 ZINC000482600003 1040372208 /nfs/dbraw/zinc/37/22/08/1040372208.db2.gz BSOAPARCSMRUFK-UHFFFAOYSA-N -1 1 346.180 4.462 20 0 EIADMM CCCCS[C@H](C)C(=O)Nc1cc(C)cc(Br)c1[O-] ZINC000482679615 1040417511 /nfs/dbraw/zinc/41/75/11/1040417511.db2.gz YCUGASGMZHQTQJ-SNVBAGLBSA-N -1 1 346.290 4.323 20 0 EIADMM CC(C)(C)c1nc(CSc2nc(C(F)F)cc(=O)[n-]2)cs1 ZINC000515020444 1040421166 /nfs/dbraw/zinc/42/11/66/1040421166.db2.gz VMNDBJNMVFMFBC-UHFFFAOYSA-N -1 1 331.413 4.166 20 0 EIADMM Cc1cc(Br)c([O-])c(NC(=O)c2cc(F)ccc2C)c1 ZINC000482694729 1040433952 /nfs/dbraw/zinc/43/39/52/1040433952.db2.gz OYDOYZXWQLZGAL-UHFFFAOYSA-N -1 1 338.176 4.163 20 0 EIADMM Cc1nc(SCc2coc(-c3c(F)cccc3F)n2)[n-]c(=O)c1C ZINC000539618665 1040617045 /nfs/dbraw/zinc/61/70/45/1040617045.db2.gz NSRVCEDAPFHFDZ-UHFFFAOYSA-N -1 1 349.362 4.025 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2cc(Cl)ccc2Cl)sc1C ZINC000538010628 1040986311 /nfs/dbraw/zinc/98/63/11/1040986311.db2.gz MXXPMTSHVUQAKZ-UHFFFAOYSA-N -1 1 336.265 4.473 20 0 EIADMM CCc1cc(=O)[n-]c(S[C@H](C)C(=O)c2ccc(C(C)C)cc2)n1 ZINC000436197103 1040967392 /nfs/dbraw/zinc/96/73/92/1040967392.db2.gz KURXTTXQDFTENT-GFCCVEGCSA-N -1 1 330.453 4.232 20 0 EIADMM CCc1cc(=O)[n-]c(SCc2ncc(-c3ccc(C)cc3)o2)n1 ZINC000436200025 1040970205 /nfs/dbraw/zinc/97/02/05/1040970205.db2.gz DOQMAAFEMXWERC-UHFFFAOYSA-N -1 1 327.409 4.000 20 0 EIADMM Cc1ccc(NC(=O)c2c(F)ccc([O-])c2F)cc1C(F)(F)F ZINC000537991402 1040971104 /nfs/dbraw/zinc/97/11/04/1040971104.db2.gz RMZAUKCHYBGDEH-UHFFFAOYSA-N -1 1 331.240 4.250 20 0 EIADMM CO[C@@H](C)c1cccc([N-]S(=O)(=O)c2cccc(C(C)C)c2)c1 ZINC000460831869 1040990298 /nfs/dbraw/zinc/99/02/98/1040990298.db2.gz XCMKZEHXHFAGJJ-AWEZNQCLSA-N -1 1 333.453 4.318 20 0 EIADMM CO[C@H](C)c1cccc([N-]S(=O)(=O)c2ccccc2C(C)(C)C)c1 ZINC000460830600 1040992422 /nfs/dbraw/zinc/99/24/22/1040992422.db2.gz PKMCRCFQABBZBP-CQSZACIVSA-N -1 1 347.480 4.492 20 0 EIADMM Cc1cc2cc([N-]S(=O)(=O)c3ccc(C)c(Cl)c3)ccc2[nH]1 ZINC000515694171 1040999784 /nfs/dbraw/zinc/99/97/84/1040999784.db2.gz OTLVNZDNUPDDDM-UHFFFAOYSA-N -1 1 334.828 4.239 20 0 EIADMM CSc1ccc(Cl)cc1[N-]S(=O)(=O)c1ccc(F)cc1C ZINC000064374881 1041032670 /nfs/dbraw/zinc/03/26/70/1041032670.db2.gz PZKHZLQJMKYVOK-UHFFFAOYSA-N -1 1 345.848 4.310 20 0 EIADMM CC(=O)c1cc(F)c([N-]C(=O)c2cccc(Cl)c2F)c(F)c1F ZINC000461107293 1041222293 /nfs/dbraw/zinc/22/22/93/1041222293.db2.gz KDNOLOFYWWCXSK-UHFFFAOYSA-N -1 1 345.679 4.351 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1CC[C@@H](c2ccccc2F)C1 ZINC000436486049 1041285390 /nfs/dbraw/zinc/28/53/90/1041285390.db2.gz IVRIVFLDINPAQN-MRXNPFEDSA-N -1 1 335.378 4.314 20 0 EIADMM CC(C)CCC[C@@H](NCc1ccc(-c2ccc(F)cc2)o1)C(=O)[O-] ZINC000904039406 1041292663 /nfs/dbraw/zinc/29/26/63/1041292663.db2.gz ZJRUWLYTSRVSGE-QGZVFWFLSA-N -1 1 333.403 4.455 20 0 EIADMM CCOc1cc(-c2noc([C@]3(C)C[C@H]4C[C@H]4C3)n2)cc(Cl)c1[O-] ZINC000436520251 1041302113 /nfs/dbraw/zinc/30/21/13/1041302113.db2.gz DJNAHKMNOXVSPT-YQYWCBKUSA-N -1 1 334.803 4.182 20 0 EIADMM Cc1cc(N(C)C)cc(C)c1NC(=O)c1ccc2ccccc2c1[O-] ZINC000436521871 1041303398 /nfs/dbraw/zinc/30/33/98/1041303398.db2.gz PITWLGVSXIXRSM-UHFFFAOYSA-N -1 1 334.419 4.481 20 0 EIADMM C[C@@H]1C[C@H](c2ccc(F)cc2)CN1C(=O)c1ccc(Cl)cc1[O-] ZINC000436536507 1041320686 /nfs/dbraw/zinc/32/06/86/1041320686.db2.gz MOARQGDRSDEJOV-YPMHNXCESA-N -1 1 333.790 4.203 20 0 EIADMM CC[C@H](C)[C@@H](C)N(C(=O)c1cc(Cl)c([O-])c(OC)c1)C1CC1 ZINC000436538554 1041330453 /nfs/dbraw/zinc/33/04/53/1041330453.db2.gz WDQAGCLGTJMULP-WDEREUQCSA-N -1 1 325.836 4.093 20 0 EIADMM O=C(Nc1ccc(-c2cncnc2)cc1)c1cc2ccccc2cc1[O-] ZINC000436540800 1041333218 /nfs/dbraw/zinc/33/32/18/1041333218.db2.gz XWVLAUCWRVMZHO-UHFFFAOYSA-N -1 1 341.370 4.255 20 0 EIADMM O=C(Nc1ccc2nc(C3CCC3)[nH]c2c1)c1ccc([O-])c(Cl)c1 ZINC000436559933 1041342212 /nfs/dbraw/zinc/34/22/12/1041342212.db2.gz ASIHPNMWHWLXSF-UHFFFAOYSA-N -1 1 341.798 4.442 20 0 EIADMM CC[C@@H](C)[C@H](C)N(C(=O)c1ccc(Br)cc1[O-])C1CC1 ZINC000436563048 1041344865 /nfs/dbraw/zinc/34/48/65/1041344865.db2.gz CJOMSGFUBGJPID-MNOVXSKESA-N -1 1 340.261 4.194 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1CC[C@H](c2cccc(F)c2)C1 ZINC000436570722 1041348973 /nfs/dbraw/zinc/34/89/73/1041348973.db2.gz SBGXTNGQXDPWNG-INIZCTEOSA-N -1 1 335.378 4.314 20 0 EIADMM CCO[C@H](c1noc(Cc2ccc([O-])c(Cl)c2)n1)C1CCCC1 ZINC000904139142 1041351228 /nfs/dbraw/zinc/35/12/28/1041351228.db2.gz QSECBCTYQMVSPM-INIZCTEOSA-N -1 1 336.819 4.287 20 0 EIADMM Cc1ccc([C@@H]2CCC[C@H]2N(C)C(=O)c2cc(F)ccc2[O-])cc1 ZINC000436592556 1041351389 /nfs/dbraw/zinc/35/13/89/1041351389.db2.gz WLWVEPDQYNNPDQ-FUHWJXTLSA-N -1 1 327.399 4.248 20 0 EIADMM CC(C)c1csc(CNC(=O)c2ccc3ccccc3c2[O-])n1 ZINC000436596189 1041355049 /nfs/dbraw/zinc/35/50/49/1041355049.db2.gz LJDLIIYEINKAPU-UHFFFAOYSA-N -1 1 326.421 4.055 20 0 EIADMM O=C(N[C@H]1CCOC2(CCCCC2)C1)c1ccc2ccccc2c1[O-] ZINC000436596367 1041355676 /nfs/dbraw/zinc/35/56/76/1041355676.db2.gz QFERCIWRICTUME-INIZCTEOSA-N -1 1 339.435 4.157 20 0 EIADMM Cc1ccc(-c2ccc(C)c(NC(=O)C(=O)c3ccc([O-])cc3)c2)o1 ZINC000436622851 1041389766 /nfs/dbraw/zinc/38/97/66/1041389766.db2.gz CPLADVBEXMRMQN-UHFFFAOYSA-N -1 1 335.359 4.090 20 0 EIADMM Cn1c(-c2ccc([O-])c(Br)c2)nc2cccc(Cl)c21 ZINC000436657095 1041396786 /nfs/dbraw/zinc/39/67/86/1041396786.db2.gz PHLNJRMBPWHEOT-UHFFFAOYSA-N -1 1 337.604 4.362 20 0 EIADMM O=C(N[C@H](c1ccco1)c1ccccc1)c1cc(Cl)ccc1[O-] ZINC000436656421 1041397769 /nfs/dbraw/zinc/39/77/69/1041397769.db2.gz GDXCPISBDXRMFY-KRWDZBQOSA-N -1 1 327.767 4.158 20 0 EIADMM O=C(Nc1ccc(Oc2ccccc2)cc1)C(=O)c1ccc([O-])cc1 ZINC000436663334 1041404549 /nfs/dbraw/zinc/40/45/49/1041404549.db2.gz GXPNWMPSZPVJKB-UHFFFAOYSA-N -1 1 333.343 4.006 20 0 EIADMM COc1ccc(C[C@@H](C)CN(C)C(=O)c2cc(Cl)ccc2[O-])cc1 ZINC000436668446 1041409256 /nfs/dbraw/zinc/40/92/56/1041409256.db2.gz WTESGBOJOFJWLJ-CYBMUJFWSA-N -1 1 347.842 4.005 20 0 EIADMM CN(Cc1cccc2ccccc21)C(=O)c1ccc(Cl)cc1[O-] ZINC000436711375 1041439596 /nfs/dbraw/zinc/43/95/96/1041439596.db2.gz HFROXNLVBYIDMY-UHFFFAOYSA-N -1 1 325.795 4.471 20 0 EIADMM CC(C)[C@@H](NC(=O)c1ccc([O-])cc1F)c1ccc(Cl)cc1F ZINC000436724966 1041444488 /nfs/dbraw/zinc/44/44/88/1041444488.db2.gz TXHKMHXTFDOLNQ-MRXNPFEDSA-N -1 1 339.769 4.451 20 0 EIADMM O=C(c1ccc(C(F)(F)F)cc1[O-])N1CC(C2CCCCC2)C1 ZINC000436729165 1041454064 /nfs/dbraw/zinc/45/40/64/1041454064.db2.gz QFUMNKBGOMLOSK-UHFFFAOYSA-N -1 1 327.346 4.063 20 0 EIADMM Cc1nc2ccc(NC(=O)c3c([O-])cc(Cl)cc3Cl)cc2[nH]1 ZINC000436758564 1041455842 /nfs/dbraw/zinc/45/58/42/1041455842.db2.gz ZQXJJCVSHAXQFH-UHFFFAOYSA-N -1 1 336.178 4.136 20 0 EIADMM Cc1ccc([C@H](C)N(C)C(=O)c2ccc(Br)cc2[O-])cc1 ZINC000436756280 1041456095 /nfs/dbraw/zinc/45/60/95/1041456095.db2.gz PJJDWNWOSCLYLA-LBPRGKRZSA-N -1 1 348.240 4.296 20 0 EIADMM CCCN(Cc1ccccc1)C(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC000436750959 1041463022 /nfs/dbraw/zinc/46/30/22/1041463022.db2.gz PWFMZHVJUJJZPK-UHFFFAOYSA-N -1 1 333.815 4.107 20 0 EIADMM CC[C@@]1(C(=O)[O-])CCCN(Cc2cc(C(F)(F)F)ccc2Cl)C1 ZINC000904402357 1041468560 /nfs/dbraw/zinc/46/85/60/1041468560.db2.gz WSSGTQIOPBNEGK-OAHLLOKOSA-N -1 1 349.780 4.436 20 0 EIADMM CN(C(=O)c1ccc(C(F)(F)F)cc1[O-])[C@H]1CCc2ccccc21 ZINC000436765791 1041474429 /nfs/dbraw/zinc/47/44/29/1041474429.db2.gz YVFBZVMUXUYSCS-HNNXBMFYSA-N -1 1 335.325 4.171 20 0 EIADMM O=C(Nc1cccc(-c2cnco2)c1)c1cc2ccccc2cc1[O-] ZINC000436783954 1041479294 /nfs/dbraw/zinc/47/92/94/1041479294.db2.gz JGLJFMGYEOVNNK-UHFFFAOYSA-N -1 1 330.343 4.453 20 0 EIADMM C[C@@H]1c2ccsc2CCN1C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436797230 1041484933 /nfs/dbraw/zinc/48/49/33/1041484933.db2.gz ZGWUUTQJTYBTST-SECBINFHSA-N -1 1 341.354 4.232 20 0 EIADMM O=C(Nc1ccc(Oc2ccccc2F)nc1)c1ccc([O-])cc1F ZINC000436819202 1041487280 /nfs/dbraw/zinc/48/72/80/1041487280.db2.gz CYVVVTYQPSYRQR-UHFFFAOYSA-N -1 1 342.301 4.110 20 0 EIADMM C[C@H](NC(=O)c1ccc(Cl)cc1[O-])c1nc(C(C)(C)C)cs1 ZINC000436819099 1041487653 /nfs/dbraw/zinc/48/76/53/1041487653.db2.gz NCFOEZQVDZVUFW-VIFPVBQESA-N -1 1 338.860 4.291 20 0 EIADMM O=C(Nc1nc(-c2cccnc2)cs1)c1ccc2ccccc2c1[O-] ZINC000436816738 1041487704 /nfs/dbraw/zinc/48/77/04/1041487704.db2.gz FVLMRYPMJZHUSI-UHFFFAOYSA-N -1 1 347.399 4.316 20 0 EIADMM O=C(Nc1nc(-c2ccccn2)cs1)c1ccc2ccccc2c1[O-] ZINC000436832176 1041496944 /nfs/dbraw/zinc/49/69/44/1041496944.db2.gz ZRDGQEGDNHGWQP-UHFFFAOYSA-N -1 1 347.399 4.316 20 0 EIADMM C[C@@H](NC(=O)c1ccc([O-])cc1F)c1cc(Cl)ccc1Cl ZINC000436825649 1041503924 /nfs/dbraw/zinc/50/39/24/1041503924.db2.gz GZMWQLNAPGJQMK-MRVPVSSYSA-N -1 1 328.170 4.329 20 0 EIADMM CC[C@H](c1ccccc1OC)N(C)C(=O)c1ccc(Cl)cc1[O-] ZINC000436847333 1041516067 /nfs/dbraw/zinc/51/60/67/1041516067.db2.gz JQKDWVSGNXGPSR-OAHLLOKOSA-N -1 1 333.815 4.278 20 0 EIADMM O=C(N[C@H](Cc1ccccc1)c1ccccc1)c1ccc([O-])cc1F ZINC000436861654 1041519494 /nfs/dbraw/zinc/51/94/94/1041519494.db2.gz LXRJVJOKDRMROS-HXUWFJFHSA-N -1 1 335.378 4.245 20 0 EIADMM [O-]c1ccc(-c2noc(-c3ccn(C4CCCCC4)n3)n2)c(Cl)c1 ZINC000436870043 1041527399 /nfs/dbraw/zinc/52/73/99/1041527399.db2.gz GJXRRMWASBGUQG-UHFFFAOYSA-N -1 1 344.802 4.464 20 0 EIADMM Cc1nc2ccc(-c3nc(-c4ccc([O-])cc4F)no3)cc2s1 ZINC000436873156 1041529503 /nfs/dbraw/zinc/52/95/03/1041529503.db2.gz MAQHHPTVTMPLOW-UHFFFAOYSA-N -1 1 327.340 4.166 20 0 EIADMM COc1ccc(-c2nc(-c3ccc([O-])cc3F)no2)c(OC(C)C)c1 ZINC000436878185 1041536577 /nfs/dbraw/zinc/53/65/77/1041536577.db2.gz IXGKGOXFDMEDPC-UHFFFAOYSA-N -1 1 344.342 4.044 20 0 EIADMM C/C=C(\C)c1nc(-c2cc(Br)c([O-])c(OCC)c2)no1 ZINC000436907698 1041549150 /nfs/dbraw/zinc/54/91/50/1041549150.db2.gz STWBIQLLHQKVLX-XBXARRHUSA-N -1 1 339.189 4.027 20 0 EIADMM [O-]c1c(-c2nc(-c3ccc4nccnc4c3)no2)ccc2ccccc21 ZINC000436933875 1041564976 /nfs/dbraw/zinc/56/49/76/1041564976.db2.gz VMMADZNWFKQYSA-UHFFFAOYSA-N -1 1 340.342 4.206 20 0 EIADMM CCC[C@@H](C)[C@H]1CCCN1C(=O)c1cc(Cl)c([O-])c(OCC)c1 ZINC000436963343 1041571287 /nfs/dbraw/zinc/57/12/87/1041571287.db2.gz CBFXQMVSRDUGHS-IUODEOHRSA-N -1 1 339.863 4.485 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1CC=C(c2ccccc2F)C1 ZINC000436961775 1041572034 /nfs/dbraw/zinc/57/20/34/1041572034.db2.gz UTZJKWSFJDTFPT-UHFFFAOYSA-N -1 1 333.362 4.224 20 0 EIADMM O=C(c1cc(Cl)ccc1[O-])N1CC2(CCC2)[C@@H]1c1ccccc1 ZINC000436973838 1041578250 /nfs/dbraw/zinc/57/82/50/1041578250.db2.gz VJUGDEWNXPJKGX-KRWDZBQOSA-N -1 1 327.811 4.413 20 0 EIADMM C[C@H](CCCc1ccccc1)C(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC000540623465 1041578459 /nfs/dbraw/zinc/57/84/59/1041578459.db2.gz BMFJQCJTVRHQAM-OAHLLOKOSA-N -1 1 349.434 4.380 20 0 EIADMM CCC(C)(C)OCc1ccccc1NC(=O)c1ccc([O-])cc1F ZINC000436991824 1041583954 /nfs/dbraw/zinc/58/39/54/1041583954.db2.gz UPMWSYTYDATRPR-UHFFFAOYSA-N -1 1 331.387 4.489 20 0 EIADMM O=S(=O)([N-]C1(c2ccc(Cl)cc2)CC1)c1cc2ccccc2o1 ZINC000516534047 1041621653 /nfs/dbraw/zinc/62/16/53/1041621653.db2.gz DRGUGRYMYSPBDZ-UHFFFAOYSA-N -1 1 347.823 4.054 20 0 EIADMM O=S(=O)([N-]c1cccc(F)c1Cl)c1c(F)cccc1Cl ZINC000516993512 1041833647 /nfs/dbraw/zinc/83/36/47/1041833647.db2.gz ZKLCYCFINXPUTH-UHFFFAOYSA-N -1 1 338.162 4.072 20 0 EIADMM O=C([N-]c1nnc(-c2ccco2)s1)c1ccc(-c2cccs2)o1 ZINC000541186745 1041840719 /nfs/dbraw/zinc/84/07/19/1041840719.db2.gz MZMOOKXHZGUVOL-UHFFFAOYSA-N -1 1 343.389 4.372 20 0 EIADMM Cc1ccc(C)c(S(=O)(=O)[N-]c2ccc(SC(F)F)cc2)c1 ZINC000007052036 1042011631 /nfs/dbraw/zinc/01/16/31/1042011631.db2.gz MXNWNKKQDGGROM-UHFFFAOYSA-N -1 1 343.420 4.419 20 0 EIADMM CCOCc1ccc([N-]S(=O)(=O)c2ccc(C(C)C)cc2)cc1 ZINC000438722305 1042325623 /nfs/dbraw/zinc/32/56/23/1042325623.db2.gz LASVXMQLIVAFAW-UHFFFAOYSA-N -1 1 333.453 4.147 20 0 EIADMM O=S(=O)([N-]c1cccc(-c2cccs2)c1)c1cccc(F)c1 ZINC000509576892 1042386084 /nfs/dbraw/zinc/38/60/84/1042386084.db2.gz ILFFUNCNKBVXEF-UHFFFAOYSA-N -1 1 333.409 4.355 20 0 EIADMM Cc1cscc1[N-]S(=O)(=O)c1ccc(OCCC(C)C)cc1 ZINC000439059438 1042477393 /nfs/dbraw/zinc/47/73/93/1042477393.db2.gz XCXYQAJVRJJFNT-UHFFFAOYSA-N -1 1 339.482 4.282 20 0 EIADMM CCC[C@H](C)c1cc([N-]S(=O)(=O)c2cccc(C(F)F)c2)[nH]n1 ZINC000780398347 1042550630 /nfs/dbraw/zinc/55/06/30/1042550630.db2.gz MELCHHBVEWVDGY-JTQLQIEISA-N -1 1 343.399 4.052 20 0 EIADMM Cc1cc(Br)c([O-])c(NC(=O)c2cccc3cc[nH]c32)c1 ZINC000182931112 1043035179 /nfs/dbraw/zinc/03/51/79/1043035179.db2.gz CRVWESLPFAITNJ-UHFFFAOYSA-N -1 1 345.196 4.197 20 0 EIADMM CCOc1cc(C(=O)Nc2cnc(Cl)cc2C)cc(Cl)c1[O-] ZINC000186876643 1043108383 /nfs/dbraw/zinc/10/83/83/1043108383.db2.gz ZTBOXPVXJMTGOK-UHFFFAOYSA-N -1 1 341.194 4.053 20 0 EIADMM O=C(N[C@H]1C[C@H](c2ccc(Cl)cc2)C1)c1c([O-])cccc1Cl ZINC001626064719 1043132156 /nfs/dbraw/zinc/13/21/56/1043132156.db2.gz AAGGRMVWSFMFRM-AULYBMBSSA-N -1 1 336.218 4.375 20 0 EIADMM O=S(=O)([N-]c1ccc(CCC(F)(F)F)cc1)c1ccsc1 ZINC000507918238 1043189986 /nfs/dbraw/zinc/18/99/86/1043189986.db2.gz DUMGTFBAEVDYBH-UHFFFAOYSA-N -1 1 335.372 4.044 20 0 EIADMM O=C(CSc1ccc2c(c1)CCC2)Nc1ccc([O-])c(Cl)c1 ZINC000509177169 1043202669 /nfs/dbraw/zinc/20/26/69/1043202669.db2.gz FYFUOPDRXLRNBV-UHFFFAOYSA-N -1 1 333.840 4.265 20 0 EIADMM Cc1cc(F)ccc1S(=O)(=O)[N-]c1cccc(SC(F)F)c1 ZINC000727363036 1043205230 /nfs/dbraw/zinc/20/52/30/1043205230.db2.gz KYBSMKTUAVOSDG-UHFFFAOYSA-N -1 1 347.383 4.250 20 0 EIADMM Cc1ccc(N)cc1S(=O)(=O)[N-]c1ccc(C2CCCC2)cc1 ZINC001212457322 1043234000 /nfs/dbraw/zinc/23/40/00/1043234000.db2.gz BHSOROZPXGFEMY-UHFFFAOYSA-N -1 1 330.453 4.036 20 0 EIADMM [O-]c1cccnc1-c1nc(-c2cc(Cl)ccc2C(F)(F)F)no1 ZINC001212481024 1043436768 /nfs/dbraw/zinc/43/67/68/1043436768.db2.gz VUARIJIJJZMGFP-UHFFFAOYSA-N -1 1 341.676 4.176 20 0 EIADMM CSCc1ccc([N-]S(=O)(=O)c2ccc(SC)cc2)cc1 ZINC000171346702 1043540402 /nfs/dbraw/zinc/54/04/02/1043540402.db2.gz WPWJBDWNKDBLSW-UHFFFAOYSA-N -1 1 339.507 4.072 20 0 EIADMM CCOc1cc(NC(=O)Nc2ccc([O-])c(Cl)c2)ccc1OC ZINC000190943918 1043753230 /nfs/dbraw/zinc/75/32/30/1043753230.db2.gz IOFLYEKIMKZUIB-UHFFFAOYSA-N -1 1 336.775 4.097 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)Nc1ccccc1OCC(F)F ZINC000190978348 1043755206 /nfs/dbraw/zinc/75/52/06/1043755206.db2.gz WIHUYXTWTFRMMO-UHFFFAOYSA-N -1 1 342.729 4.334 20 0 EIADMM CCCCOc1cccc(NC(=O)c2cc(Cl)c([O-])c(OC)c2)c1 ZINC000442951924 1043898807 /nfs/dbraw/zinc/89/88/07/1043898807.db2.gz PTBYNRFCCLCCER-UHFFFAOYSA-N -1 1 349.814 4.485 20 0 EIADMM COc1cc(C(=O)N2CCC[C@H](C(C)(C)C)CC2)cc(Cl)c1[O-] ZINC000442964612 1043927746 /nfs/dbraw/zinc/92/77/46/1043927746.db2.gz KTTUVVCZXMDPBJ-ZDUSSCGKSA-N -1 1 339.863 4.343 20 0 EIADMM CCN(C(=O)c1cc(Cl)c([O-])c(OC)c1)[C@@H]1CCCC[C@@H]1C ZINC000442966745 1043929228 /nfs/dbraw/zinc/92/92/28/1043929228.db2.gz NGVZAAAUCLYKPQ-SMDDNHRTSA-N -1 1 325.836 4.095 20 0 EIADMM COc1cc(C(=O)NCC(C)(C)c2ccc(C)cc2)cc(Cl)c1[O-] ZINC000442968283 1043929414 /nfs/dbraw/zinc/92/94/14/1043929414.db2.gz PRLZCOCLTRARSM-UHFFFAOYSA-N -1 1 347.842 4.070 20 0 EIADMM COc1cc(-c2nc(-c3ccc(Cl)cc3)no2)cc(Cl)c1[O-] ZINC000443086451 1043994473 /nfs/dbraw/zinc/99/44/73/1043994473.db2.gz NCKZWPIBRAKLFT-UHFFFAOYSA-N -1 1 337.162 4.425 20 0 EIADMM CCOc1cc(-c2nc(Cc3ccc(F)cc3)no2)cc(Cl)c1[O-] ZINC000443097355 1044028480 /nfs/dbraw/zinc/02/84/80/1044028480.db2.gz UTWSKZSJJHLLMK-UHFFFAOYSA-N -1 1 348.761 4.224 20 0 EIADMM CCC[C@@H]1[C@@H](C)CCCN1C(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC000443278216 1044155336 /nfs/dbraw/zinc/15/53/36/1044155336.db2.gz DGKQQDKKGKYNDA-SMDDNHRTSA-N -1 1 325.836 4.095 20 0 EIADMM COc1cc(C(=O)N2CC[C@@H](c3ccccc3)[C@@H]2C)cc(Cl)c1[O-] ZINC000443302011 1044166585 /nfs/dbraw/zinc/16/65/85/1044166585.db2.gz OCZSDARFNGTFBH-SWLSCSKDSA-N -1 1 345.826 4.072 20 0 EIADMM Cc1cc(C)c(C(=O)CSc2nc(C(F)F)cc(=O)[n-]2)cc1C ZINC000522038105 1044178333 /nfs/dbraw/zinc/17/83/33/1044178333.db2.gz RZMNOYCDRAJGPE-UHFFFAOYSA-N -1 1 338.379 4.020 20 0 EIADMM COc1cc(C(=O)Nc2ccc(COC(C)C)cc2)cc(Cl)c1[O-] ZINC000443334397 1044200525 /nfs/dbraw/zinc/20/05/25/1044200525.db2.gz MDIRRWHWPITUQZ-UHFFFAOYSA-N -1 1 349.814 4.232 20 0 EIADMM CC(C)[C@@H]1c2ccccc2CCN1Cc1nc(=O)c2sccc2[n-]1 ZINC000675663652 1044419889 /nfs/dbraw/zinc/41/98/89/1044419889.db2.gz IPRJZNSPJJPQIZ-QGZVFWFLSA-N -1 1 339.464 4.152 20 0 EIADMM CCCN(CCC)C(=O)c1ccc(NC(=O)OC(C)(C)C)cc1[O-] ZINC000093900646 1044425669 /nfs/dbraw/zinc/42/56/69/1044425669.db2.gz KVUPTVBISZSOLY-UHFFFAOYSA-N -1 1 336.432 4.001 20 0 EIADMM CCN(C(=O)c1ccc(NC(=O)OC(C)(C)C)cc1[O-])C1CCCC1 ZINC000094015376 1044472181 /nfs/dbraw/zinc/47/21/81/1044472181.db2.gz AYNAEOCHCPIVGE-UHFFFAOYSA-N -1 1 348.443 4.144 20 0 EIADMM CCCN(CCc1ccccn1)C(=O)c1ccc2ccccc2c1[O-] ZINC000094069205 1044504954 /nfs/dbraw/zinc/50/49/54/1044504954.db2.gz CQROJUSPKBBLIS-UHFFFAOYSA-N -1 1 334.419 4.035 20 0 EIADMM CSc1ccc([O-])c(C(=O)Nc2ccc(N3CCCC3)cc2C)c1 ZINC000665352735 1044521436 /nfs/dbraw/zinc/52/14/36/1044521436.db2.gz OLEXHHQAFJTWNU-UHFFFAOYSA-N -1 1 342.464 4.275 20 0 EIADMM Cc1cnc(C(=O)N([C@@H](C)c2ccc(Cl)cc2)C2CC2)c([O-])c1 ZINC000495111427 1044688351 /nfs/dbraw/zinc/68/83/51/1044688351.db2.gz LXEVIGUMLFMLFZ-LBPRGKRZSA-N -1 1 330.815 4.115 20 0 EIADMM O=S(=O)([N-]c1ccc2c(c1)N=NC2)c1cccc(C(F)(F)F)c1 ZINC000039957858 1044808576 /nfs/dbraw/zinc/80/85/76/1044808576.db2.gz NZMZWWPFNCCNCT-UHFFFAOYSA-N -1 1 341.314 4.104 20 0 EIADMM CC(C)(C)C1CCN(C(=O)c2ccc(Br)c([O-])c2)CC1 ZINC000231347282 1044843852 /nfs/dbraw/zinc/84/38/52/1044843852.db2.gz FUXWNGZEZWOXJK-UHFFFAOYSA-N -1 1 340.261 4.053 20 0 EIADMM O=C(Cc1cccc(Cl)c1Cl)Nc1cc([O-])c(F)cc1F ZINC001141833864 1044854986 /nfs/dbraw/zinc/85/49/86/1044854986.db2.gz OFHCSEZMCKJSSM-UHFFFAOYSA-N -1 1 332.133 4.158 20 0 EIADMM CCSc1cccc([N-]S(=O)(=O)c2cccc(SC)c2)c1 ZINC000509073708 1045065207 /nfs/dbraw/zinc/06/52/07/1045065207.db2.gz CRVKLDAVAKMTAD-UHFFFAOYSA-N -1 1 339.507 4.321 20 0 EIADMM CSc1cccc(S(=O)(=O)[N-]c2cc(F)cc(Cl)c2)c1 ZINC000509383546 1045076333 /nfs/dbraw/zinc/07/63/33/1045076333.db2.gz DHLIGZBKIWCFJP-UHFFFAOYSA-N -1 1 331.821 4.002 20 0 EIADMM CSc1cccc(S(=O)(=O)[N-]c2cccc(C(F)(F)F)c2)c1 ZINC000509102964 1045128044 /nfs/dbraw/zinc/12/80/44/1045128044.db2.gz LREGXAFWIFZFBD-UHFFFAOYSA-N -1 1 347.383 4.228 20 0 EIADMM O=S(=O)(/C=C\c1ccccc1Cl)[N-]c1cc(Cl)ccc1O ZINC000740811322 1045228056 /nfs/dbraw/zinc/22/80/56/1045228056.db2.gz BADCOZVLGIKNBZ-FPLPWBNLSA-N -1 1 344.219 4.112 20 0 EIADMM Cc1cc(C)c([N-]S(=O)(=O)c2ccccc2C(C)(C)C)cc1O ZINC000762455953 1045245845 /nfs/dbraw/zinc/24/58/45/1045245845.db2.gz OXPDGSMATOAINZ-UHFFFAOYSA-N -1 1 333.453 4.107 20 0 EIADMM Cc1c(=O)[n-]c(SCC(F)(F)C(F)F)nc1-c1ccccc1 ZINC000767438311 1045537344 /nfs/dbraw/zinc/53/73/44/1045537344.db2.gz RNYAQQBLHQDFIM-UHFFFAOYSA-N -1 1 332.322 4.150 20 0 EIADMM O=C(Nc1ccc(N2CCCCCC2)cc1)c1ccc([O-])c(F)c1 ZINC000767951874 1045681406 /nfs/dbraw/zinc/68/14/06/1045681406.db2.gz CRYYLAVDLCGBEH-UHFFFAOYSA-N -1 1 328.387 4.164 20 0 EIADMM O=C(Nc1ccc(N2CCCC2)c(Cl)c1)c1ccc([O-])c(F)c1 ZINC000768031076 1045697419 /nfs/dbraw/zinc/69/74/19/1045697419.db2.gz OIJUJICSMKUXEZ-UHFFFAOYSA-N -1 1 334.778 4.037 20 0 EIADMM Cc1ccccc1S(=O)(=O)[N-]c1ccc(Cl)c(C(F)(F)F)c1 ZINC000244541856 1045779337 /nfs/dbraw/zinc/77/93/37/1045779337.db2.gz ZZAXEFYDYMPCNR-UHFFFAOYSA-N -1 1 349.761 4.468 20 0 EIADMM CCCCN(CC)C(=O)c1ccc(NC(=O)OC(C)(C)C)cc1[O-] ZINC000124805208 1046266659 /nfs/dbraw/zinc/26/66/59/1046266659.db2.gz PQOFDIFHRWEMTQ-UHFFFAOYSA-N -1 1 336.432 4.001 20 0 EIADMM O=S(=O)([N-]c1ccc(SC(F)F)cc1)c1ccc(Cl)cc1 ZINC000005392763 1046321117 /nfs/dbraw/zinc/32/11/17/1046321117.db2.gz LPACAQQORCJSHE-UHFFFAOYSA-N -1 1 349.811 4.456 20 0 EIADMM CCC(=O)c1cccc(S(=O)(=O)[N-]c2cc(Cl)ccc2C)c1 ZINC000126142927 1046444117 /nfs/dbraw/zinc/44/41/17/1046444117.db2.gz HZODEMSVCZNPFM-UHFFFAOYSA-N -1 1 337.828 4.042 20 0 EIADMM O=S(=O)([N-]c1cccc(-c2cc[nH]n2)c1)c1cccc2ccccc21 ZINC000327943901 1047411598 /nfs/dbraw/zinc/41/15/98/1047411598.db2.gz AELQQQFCKQHSGL-UHFFFAOYSA-N -1 1 349.415 4.031 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@H]1SCCc2sccc21 ZINC000129654330 1047458724 /nfs/dbraw/zinc/45/87/24/1047458724.db2.gz IYSWQLUHDWAVJJ-ZDUSSCGKSA-N -1 1 325.842 4.076 20 0 EIADMM C[C@H](c1cccs1)N(C)C(=O)c1ccc(Br)cc1[O-] ZINC000044491166 1047646970 /nfs/dbraw/zinc/64/69/70/1047646970.db2.gz ALXBKNVJPFZSQU-SECBINFHSA-N -1 1 340.242 4.049 20 0 EIADMM CC(C)c1cccc(S(=O)(=O)[N-]c2cccc(-c3cc[nH]n3)c2)c1 ZINC000460411922 1047778836 /nfs/dbraw/zinc/77/88/36/1047778836.db2.gz KKEFIKXMSOSOGS-UHFFFAOYSA-N -1 1 341.436 4.001 20 0 EIADMM CC(C)(C)c1ccccc1S(=O)(=O)[N-]c1ccc(F)c(F)c1 ZINC000460421462 1047785141 /nfs/dbraw/zinc/78/51/41/1047785141.db2.gz QXEWSHYINFIIFG-UHFFFAOYSA-N -1 1 325.380 4.063 20 0 EIADMM Cc1ccsc1CNc1cc(C)cc(C[N-]C(=O)C(F)(F)F)c1 ZINC000825011435 1048009964 /nfs/dbraw/zinc/00/99/64/1048009964.db2.gz KBOYSBZWDKDGDN-UHFFFAOYSA-N -1 1 342.386 4.156 20 0 EIADMM CC[C@@H]([N-]C(=O)C(F)(F)c1cccc(Cl)c1Cl)c1ncc[nH]1 ZINC000843855887 1048127631 /nfs/dbraw/zinc/12/76/31/1048127631.db2.gz BECRCIPSOGEDHU-SNVBAGLBSA-N -1 1 348.180 4.076 20 0 EIADMM CSc1cc2c(cc1NCc1cccc([O-])c1Cl)OCCO2 ZINC000815130964 1048340518 /nfs/dbraw/zinc/34/05/18/1048340518.db2.gz VELXVYKZQBYEBK-UHFFFAOYSA-N -1 1 337.828 4.151 20 0 EIADMM CC(C)c1ccc(S(=O)(=O)[N-]c2cccc(-c3ncco3)c2)cc1 ZINC000132795681 1048499731 /nfs/dbraw/zinc/49/97/31/1048499731.db2.gz YESJARFMVMWXJR-UHFFFAOYSA-N -1 1 342.420 4.266 20 0 EIADMM Cc1c(Cl)cccc1S(=O)(=O)[N-]c1cccc(-c2ncco2)c1 ZINC000132817204 1048504297 /nfs/dbraw/zinc/50/42/97/1048504297.db2.gz VTICJULUQZPACS-UHFFFAOYSA-N -1 1 348.811 4.104 20 0 EIADMM CCCOc1ccc([C@H](C)NC(=O)c2c([O-])cccc2Cl)cc1 ZINC000920444793 1048674169 /nfs/dbraw/zinc/67/41/69/1048674169.db2.gz LEOYJOOWEBERHR-LBPRGKRZSA-N -1 1 333.815 4.325 20 0 EIADMM CC(C)Oc1cccc([C@H](C)NC(=O)c2c([O-])cccc2Cl)c1 ZINC000920451417 1048676745 /nfs/dbraw/zinc/67/67/45/1048676745.db2.gz DAMVSMZCAXPVHW-LBPRGKRZSA-N -1 1 333.815 4.324 20 0 EIADMM CC(C)(C)Oc1ccc(CNC(=O)c2c([O-])cccc2Cl)cc1 ZINC000920469621 1048690935 /nfs/dbraw/zinc/69/09/35/1048690935.db2.gz TUELPIQRJMLTSF-UHFFFAOYSA-N -1 1 333.815 4.153 20 0 EIADMM Cc1ccccc1OC1CCN(Cc2c(F)cc([O-])cc2F)CC1 ZINC001144541466 1048719738 /nfs/dbraw/zinc/71/97/38/1048719738.db2.gz GNIHMGOXWQKZNG-UHFFFAOYSA-N -1 1 333.378 4.022 20 0 EIADMM COc1cccc([C@@H]2CCCCN2Cc2c(F)cc([O-])cc2F)c1 ZINC001144554909 1048724561 /nfs/dbraw/zinc/72/45/61/1048724561.db2.gz LUTMJDSOPXOYLG-IBGZPJMESA-N -1 1 333.378 4.406 20 0 EIADMM [O-]c1cc(F)c(CN2CCc3cccc(C(F)(F)F)c3C2)c(F)c1 ZINC001144561865 1048730981 /nfs/dbraw/zinc/73/09/81/1048730981.db2.gz PIKYDWWJBHFUJL-UHFFFAOYSA-N -1 1 343.295 4.248 20 0 EIADMM [O-]c1cc(F)c(CN2CC[C@@H](c3ccccc3)C(F)(F)C2)c(F)c1 ZINC001144567630 1048734220 /nfs/dbraw/zinc/73/42/20/1048734220.db2.gz WBQUGSPQIICMJC-HNNXBMFYSA-N -1 1 339.332 4.295 20 0 EIADMM CN(Cc1ccccc1Br)Cc1cc(F)c([O-])cc1F ZINC001144646589 1048770669 /nfs/dbraw/zinc/77/06/69/1048770669.db2.gz CKPPBUUBUSRVFX-UHFFFAOYSA-N -1 1 342.183 4.065 20 0 EIADMM COc1cccc([C@H]2CCCCN2Cc2cc(F)c([O-])cc2F)c1 ZINC001144667604 1048785132 /nfs/dbraw/zinc/78/51/32/1048785132.db2.gz WRVVESPPOWQDJN-GOSISDBHSA-N -1 1 333.378 4.406 20 0 EIADMM Cc1ccc(O[C@@H]2CCCN(Cc3cc(F)c([O-])cc3F)C2)cc1 ZINC001144667588 1048785941 /nfs/dbraw/zinc/78/59/41/1048785941.db2.gz WKJDWOOZDUCPMN-MRXNPFEDSA-N -1 1 333.378 4.022 20 0 EIADMM Cc1ccccc1O[C@@H]1CCCN(Cc2cc(F)c([O-])cc2F)C1 ZINC001144666491 1048786248 /nfs/dbraw/zinc/78/62/48/1048786248.db2.gz KTICEOVWRSVHEE-OAHLLOKOSA-N -1 1 333.378 4.022 20 0 EIADMM [O-]c1cc(F)c(CN2CCC[C@H]2c2c(F)cccc2F)cc1F ZINC001144659488 1048792055 /nfs/dbraw/zinc/79/20/55/1048792055.db2.gz KMWGGDKYOSMNDC-HNNXBMFYSA-N -1 1 325.305 4.286 20 0 EIADMM O=C([O-])c1ccsc1CN(Cc1ccccc1)Cc1cccnc1 ZINC001144678111 1048799494 /nfs/dbraw/zinc/79/94/94/1048799494.db2.gz OUCWFKJDORAJRE-UHFFFAOYSA-N -1 1 338.432 4.044 20 0 EIADMM C[C@@H]([N-]C(=O)C(F)(F)c1ccc(F)cc1)c1cc(F)ccc1F ZINC000920845083 1048802518 /nfs/dbraw/zinc/80/25/18/1048802518.db2.gz NBLIUNWHEYWXTH-SECBINFHSA-N -1 1 329.268 4.073 20 0 EIADMM C/C(=C/CN1Cc2cc(Cl)ccc2C[C@H]1c1ccccc1)C(=O)[O-] ZINC000846254030 1048849494 /nfs/dbraw/zinc/84/94/94/1048849494.db2.gz BEQCFVCGGJYJQC-SZJVNEJHSA-N -1 1 341.838 4.470 20 0 EIADMM Cc1nc(C(C)C)[n-]c(=O)c1C(=O)Nc1ccc2c(c1)CCCCC2 ZINC000846484458 1048867736 /nfs/dbraw/zinc/86/77/36/1048867736.db2.gz YJZRDAFLSSUUSH-UHFFFAOYSA-N -1 1 339.439 4.135 20 0 EIADMM CSc1ccc([O-])c(C(=O)Nc2ccc(C(F)(F)F)cc2)c1 ZINC001135746547 1048880241 /nfs/dbraw/zinc/88/02/41/1048880241.db2.gz UKDVUXJHCJKJJJ-UHFFFAOYSA-N -1 1 327.327 4.385 20 0 EIADMM Cc1ccc2c(c1)N(C(=O)c1ccc3ccc(O)cc3c1[O-])CCC2 ZINC001146308834 1049017320 /nfs/dbraw/zinc/01/73/20/1049017320.db2.gz ZSEHFDJBJDHXLV-UHFFFAOYSA-N -1 1 333.387 4.152 20 0 EIADMM Cc1ccc(C[C@@H]2CCCN2C(=O)c2ncc3ccccc3c2[O-])cc1 ZINC001146420528 1049023840 /nfs/dbraw/zinc/02/38/40/1049023840.db2.gz SRIWWYIOIGZIOA-SFHVURJKSA-N -1 1 346.430 4.096 20 0 EIADMM CSCc1cc(C(=O)Nc2ccc([O-])c(Cl)c2)ccc1F ZINC000175006152 1049057896 /nfs/dbraw/zinc/05/78/96/1049057896.db2.gz HPCNYOCXHTWIHQ-UHFFFAOYSA-N -1 1 325.792 4.300 20 0 EIADMM CSCc1cccc([N-]S(=O)(=O)c2ccc(C)c(Cl)c2)c1 ZINC000609459566 1049072645 /nfs/dbraw/zinc/07/26/45/1049072645.db2.gz YBHLWXXSSSXONB-UHFFFAOYSA-N -1 1 341.885 4.312 20 0 EIADMM CSCc1cccc([N-]S(=O)(=O)c2cccc(Cl)c2)c1 ZINC000609459803 1049072758 /nfs/dbraw/zinc/07/27/58/1049072758.db2.gz MYQHMFALHPPHQD-UHFFFAOYSA-N -1 1 327.858 4.004 20 0 EIADMM C[C@@]1(Cc2ccccc2Cl)CCCN1C(=O)c1ccc(F)c([O-])c1 ZINC001146989531 1049075025 /nfs/dbraw/zinc/07/50/25/1049075025.db2.gz YTCSMPNKYJCVJO-IBGZPJMESA-N -1 1 347.817 4.422 20 0 EIADMM CCc1ccc(C(=O)Nc2ncc(Cc3ccccc3)s2)c([O-])c1 ZINC001136121399 1049095096 /nfs/dbraw/zinc/09/50/96/1049095096.db2.gz QTFVSBCHUFULIT-UHFFFAOYSA-N -1 1 338.432 4.254 20 0 EIADMM O=C(Cc1ccc([O-])c(Cl)c1)N1CCC(c2ccccc2F)CC1 ZINC001147199292 1049103524 /nfs/dbraw/zinc/10/35/24/1049103524.db2.gz VXUHFFHAVFTMHD-UHFFFAOYSA-N -1 1 347.817 4.133 20 0 EIADMM CC[C@H](C)c1ccc([C@H](NC(=O)c2cncc([O-])c2)C(C)C)cc1 ZINC001136136769 1049145259 /nfs/dbraw/zinc/14/52/59/1049145259.db2.gz UAWGWEUJWDELMZ-IFXJQAMLSA-N -1 1 326.440 4.428 20 0 EIADMM O=C(N[C@@H](c1ccccc1)C1CC1)c1ccc2ccc(O)cc2c1[O-] ZINC001136149588 1049178596 /nfs/dbraw/zinc/17/85/96/1049178596.db2.gz QMKUPNCBAHREHF-IBGZPJMESA-N -1 1 333.387 4.132 20 0 EIADMM Cc1ccc([C@H]2CCCCCN2C(=O)c2cc(C)cc(C=O)c2[O-])o1 ZINC001147733532 1049202408 /nfs/dbraw/zinc/20/24/08/1049202408.db2.gz FIODYRXQKHDECS-QGZVFWFLSA-N -1 1 341.407 4.172 20 0 EIADMM CCN(Cc1ccc(C)cc1)C(=O)c1ccc2ccc(O)cc2c1[O-] ZINC001136183489 1049236469 /nfs/dbraw/zinc/23/64/69/1049236469.db2.gz GZEXREJDDOETDD-UHFFFAOYSA-N -1 1 335.403 4.222 20 0 EIADMM COc1c(C)cc(Cl)cc1NC(=O)Cc1ccc([O-])c(Cl)c1 ZINC001147936884 1049236327 /nfs/dbraw/zinc/23/63/27/1049236327.db2.gz LVOIGNBESGKYDZ-UHFFFAOYSA-N -1 1 340.206 4.197 20 0 EIADMM CC(C)[C@H](CNC(=O)Cc1ccc([O-])c(Cl)c1)c1ccccc1 ZINC001136187955 1049253572 /nfs/dbraw/zinc/25/35/72/1049253572.db2.gz RPPUEXAPVLFNBN-INIZCTEOSA-N -1 1 331.843 4.144 20 0 EIADMM CCN(Cc1ccccc1Cl)C(=O)Cc1ccc([O-])c(Cl)c1 ZINC001136184658 1049257513 /nfs/dbraw/zinc/25/75/13/1049257513.db2.gz ZCZKVEIJAGSVHQ-UHFFFAOYSA-N -1 1 338.234 4.290 20 0 EIADMM Cc1c(Cl)nccc1[N-]S(=O)(=O)c1ccc(CC(C)C)cc1 ZINC000811836006 1049285441 /nfs/dbraw/zinc/28/54/41/1049285441.db2.gz ZMPPJQONZVTUAJ-UHFFFAOYSA-N -1 1 338.860 4.043 20 0 EIADMM CC(C)c1ncncc1C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC001148253982 1049289755 /nfs/dbraw/zinc/28/97/55/1049289755.db2.gz ZFLTVKKTUAKVSA-UHFFFAOYSA-N -1 1 341.798 4.365 20 0 EIADMM Cc1ccncc1CC(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC001148260794 1049291423 /nfs/dbraw/zinc/29/14/23/1049291423.db2.gz LGYQUKYUOTXMSY-UHFFFAOYSA-N -1 1 326.783 4.083 20 0 EIADMM O=C(Nc1cccc2cnncc21)c1cccc(-c2ccccc2)c1[O-] ZINC001148869624 1049392115 /nfs/dbraw/zinc/39/21/15/1049392115.db2.gz MSLMCOCLGDMBMY-UHFFFAOYSA-N -1 1 341.370 4.255 20 0 EIADMM O=C(Nc1cccc2nccnc21)c1cccc(-c2ccccc2)c1[O-] ZINC001148870002 1049392176 /nfs/dbraw/zinc/39/21/76/1049392176.db2.gz OCPCHEDHODJTJX-UHFFFAOYSA-N -1 1 341.370 4.255 20 0 EIADMM O=C(N[C@@H]1CCCC(F)(F)C1)c1cccc(-c2ccccc2)c1[O-] ZINC001148871769 1049393386 /nfs/dbraw/zinc/39/33/86/1049393386.db2.gz DFSULZKKVGNLMP-CQSZACIVSA-N -1 1 331.362 4.367 20 0 EIADMM O=C(NCc1ccc2ocnc2c1)c1cccc(-c2ccccc2)c1[O-] ZINC001148873355 1049394523 /nfs/dbraw/zinc/39/45/23/1049394523.db2.gz VDURQFGFWOTINS-UHFFFAOYSA-N -1 1 344.370 4.130 20 0 EIADMM CCOc1cc(C)ccc1NC(=O)c1ccc2ccc(O)cc2c1[O-] ZINC001136316002 1049466764 /nfs/dbraw/zinc/46/67/64/1049466764.db2.gz OQMYICIOXWCWDG-UHFFFAOYSA-N -1 1 337.375 4.210 20 0 EIADMM Cc1cc(C)cc(Oc2ccc(NC(=O)c3ccc([O-])cn3)cc2)c1 ZINC001136337223 1049507526 /nfs/dbraw/zinc/50/75/26/1049507526.db2.gz ZETHIESABQUKOJ-UHFFFAOYSA-N -1 1 334.375 4.449 20 0 EIADMM CCC1CCC(CNC(=O)c2ccc(C(F)(F)F)c([O-])c2)CC1 ZINC001136345555 1049521478 /nfs/dbraw/zinc/52/14/78/1049521478.db2.gz BWYUTGGWTJZJFV-UHFFFAOYSA-N -1 1 329.362 4.357 20 0 EIADMM C[C@@H]1CCCC[C@@H]1CNC(=O)c1cc(-c2ccc(C=O)o2)ccc1[O-] ZINC001136512335 1049704937 /nfs/dbraw/zinc/70/49/37/1049704937.db2.gz XVTRRTKCRGNCSM-UKRRQHHQSA-N -1 1 341.407 4.021 20 0 EIADMM O=C(Nc1cccc(F)c1[O-])c1cc(C(F)(F)F)ccc1Cl ZINC001171636640 1049779925 /nfs/dbraw/zinc/77/99/25/1049779925.db2.gz IITJMVMNNNNGKJ-UHFFFAOYSA-N -1 1 333.668 4.456 20 0 EIADMM COc1ccccc1[C@@H]1CCCCN1C(=O)c1ccc(Cl)cc1[O-] ZINC001136632417 1049800301 /nfs/dbraw/zinc/80/03/01/1049800301.db2.gz XAIONHBKJFHEHF-INIZCTEOSA-N -1 1 345.826 4.422 20 0 EIADMM O=S(=O)([N-]c1ccc(F)c(F)c1)c1ccc(-c2ccccc2)cc1 ZINC000615919482 1049809945 /nfs/dbraw/zinc/80/99/45/1049809945.db2.gz IVRYBBWVIQYZFH-UHFFFAOYSA-N -1 1 345.370 4.433 20 0 EIADMM O=C(N[C@H](c1nccs1)c1ccccc1)c1cc(Cl)ccc1[O-] ZINC001136718974 1049849938 /nfs/dbraw/zinc/84/99/38/1049849938.db2.gz NACRPMFHBICKJP-HNNXBMFYSA-N -1 1 344.823 4.022 20 0 EIADMM Cc1nc(C(C)(C)NC(=O)c2ccc3ccccc3c2[O-])sc1C ZINC001136835584 1049905115 /nfs/dbraw/zinc/90/51/15/1049905115.db2.gz ZRCVZCGCHJKGIK-UHFFFAOYSA-N -1 1 340.448 4.284 20 0 EIADMM CSCc1ccccc1[N-]S(=O)(=O)c1cccc(Cl)c1C ZINC000564376071 1049924654 /nfs/dbraw/zinc/92/46/54/1049924654.db2.gz BNLSISOOCULRDP-UHFFFAOYSA-N -1 1 341.885 4.312 20 0 EIADMM Cc1cc2ccccc2cc1[N-]S(=O)(=O)c1cccc(F)c1C ZINC001185836429 1050167955 /nfs/dbraw/zinc/16/79/55/1050167955.db2.gz IQSDYSBQWWYINY-UHFFFAOYSA-N -1 1 329.396 4.397 20 0 EIADMM CCCc1nc2ccc([N-]S(=O)(=O)c3cccc(F)c3C)cc2o1 ZINC001185824846 1050172930 /nfs/dbraw/zinc/17/29/30/1050172930.db2.gz ULXAIPWTLZUHKP-UHFFFAOYSA-N -1 1 348.399 4.029 20 0 EIADMM Cc1cc(Nc2c(F)ccc([O-])c2Cl)cnc1Br ZINC001250228817 1050235063 /nfs/dbraw/zinc/23/50/63/1050235063.db2.gz LUOOZOURICRMLZ-UHFFFAOYSA-N -1 1 331.572 4.394 20 0 EIADMM Cc1cc(Oc2ccccc2)ncc1NC(=O)c1ccc([O-])c(F)c1 ZINC001186209576 1050272332 /nfs/dbraw/zinc/27/23/32/1050272332.db2.gz YNBIQSIUAULGAR-UHFFFAOYSA-N -1 1 338.338 4.279 20 0 EIADMM CC(C)(Cc1cccnc1)C(=O)Nc1cccc(C(F)(F)F)c1[O-] ZINC001178061694 1050366193 /nfs/dbraw/zinc/36/61/93/1050366193.db2.gz QWZKZOHODUCIEG-UHFFFAOYSA-N -1 1 338.329 4.013 20 0 EIADMM O=C(Nc1cccc(Br)c1)Nc1ccc(Cl)cc1[O-] ZINC001187464485 1050546021 /nfs/dbraw/zinc/54/60/21/1050546021.db2.gz UWHRQEVJZJDIAB-UHFFFAOYSA-N -1 1 341.592 4.452 20 0 EIADMM COc1cc(Nc2cc(Cl)c([O-])cc2Cl)cc(OC)c1OC ZINC001173906027 1050619315 /nfs/dbraw/zinc/61/93/15/1050619315.db2.gz IBUYKDRCMWMESH-UHFFFAOYSA-N -1 1 344.194 4.468 20 0 EIADMM Cc1c(Cl)cc(Nc2ccccc2S(C)(=O)=O)c([O-])c1Cl ZINC001173992415 1050667511 /nfs/dbraw/zinc/66/75/11/1050667511.db2.gz WSKJRYVZQPFDNL-UHFFFAOYSA-N -1 1 346.235 4.155 20 0 EIADMM CCCc1cc(=O)[n-]c(S[C@@H](C)Cc2ccc3ccccc3n2)n1 ZINC001188162747 1050713028 /nfs/dbraw/zinc/71/30/28/1050713028.db2.gz LJHFEXWKNKUTML-ZDUSSCGKSA-N -1 1 339.464 4.406 20 0 EIADMM CC(C)(Oc1ccc(F)cc1)C(=O)Nc1cc(F)c([O-])cc1Cl ZINC001179655576 1050737856 /nfs/dbraw/zinc/73/78/56/1050737856.db2.gz IICFDLYEWVCSSU-UHFFFAOYSA-N -1 1 341.741 4.120 20 0 EIADMM COc1cc(Cl)ccc1C(=O)Nc1cc(F)c([O-])cc1Cl ZINC001179655505 1050738670 /nfs/dbraw/zinc/73/86/70/1050738670.db2.gz GXSDBHVYYSFKMG-UHFFFAOYSA-N -1 1 330.142 4.099 20 0 EIADMM O=C(Nc1ccccc1)c1ccc(Nc2ccnc(Cl)c2[O-])cc1 ZINC001174161442 1050802834 /nfs/dbraw/zinc/80/28/34/1050802834.db2.gz HOSRJJRHBXZGCA-UHFFFAOYSA-N -1 1 339.782 4.437 20 0 EIADMM O=S(=O)([N-]c1cc(Cl)cc(Cl)c1Cl)c1ccoc1 ZINC001188615170 1050806596 /nfs/dbraw/zinc/80/65/96/1050806596.db2.gz IYZRPMWZPUTGHN-UHFFFAOYSA-N -1 1 326.588 4.041 20 0 EIADMM Cc1nc2c(cccc2NC(=O)c2ccc([O-])c(C(F)(F)F)c2)o1 ZINC001188585777 1050809864 /nfs/dbraw/zinc/80/98/64/1050809864.db2.gz IFAIAYZJFZJYBQ-UHFFFAOYSA-N -1 1 336.269 4.113 20 0 EIADMM O=C(c1cccc(Nc2cc([O-])c(F)c(F)c2)c1)N1CCCCC1 ZINC001174174316 1050815492 /nfs/dbraw/zinc/81/54/92/1050815492.db2.gz KVAPQVBYPIKEHS-UHFFFAOYSA-N -1 1 332.350 4.040 20 0 EIADMM [O-]c1c(Br)c(F)ccc1Nc1cccc(-n2cccn2)c1 ZINC001174304221 1050869613 /nfs/dbraw/zinc/86/96/13/1050869613.db2.gz ZHQAXAHUTWAGBE-UHFFFAOYSA-N -1 1 348.175 4.223 20 0 EIADMM Cc1nc(SC[C@@H]2CCC[C@H](c3ccccc3)O2)[n-]c(=O)c1C ZINC001189061719 1050897183 /nfs/dbraw/zinc/89/71/83/1050897183.db2.gz RZBUAAYSLCWJGH-JKSUJKDBSA-N -1 1 330.453 4.202 20 0 EIADMM CC(=O)NCc1cccc(Nc2cc(Cl)c([O-])cc2Cl)c1 ZINC001174369734 1050932740 /nfs/dbraw/zinc/93/27/40/1050932740.db2.gz VMHKTDVPISHMSJ-UHFFFAOYSA-N -1 1 325.195 4.079 20 0 EIADMM CC(C)(C)[C@@H]1CCC[C@@H]([N-]S(=O)(=O)c2cc(F)ccc2F)CC1 ZINC001189289493 1050947382 /nfs/dbraw/zinc/94/73/82/1050947382.db2.gz OLTXCRUHWSBHGI-TZMCWYRMSA-N -1 1 345.455 4.238 20 0 EIADMM O=C(NC[C@H]1CCC=CCCC1)c1ccc(Br)cc1[O-] ZINC001180306810 1050947556 /nfs/dbraw/zinc/94/75/56/1050947556.db2.gz JEXDXZTXROHICY-LBPRGKRZSA-N -1 1 338.245 4.021 20 0 EIADMM O=C(Nc1nccs1)Nc1c([O-])cc(C(F)(F)F)cc1Cl ZINC001189386172 1050976415 /nfs/dbraw/zinc/97/64/15/1050976415.db2.gz BTGMBYOTONENPD-UHFFFAOYSA-N -1 1 337.710 4.165 20 0 EIADMM Cc1n[nH]cc1[N-]c1onc(-c2ccccc2)c1C(=O)OC(C)(C)C ZINC001174472819 1051016434 /nfs/dbraw/zinc/01/64/34/1051016434.db2.gz BQDNNHJRRKHTHS-UHFFFAOYSA-N -1 1 340.383 4.072 20 0 EIADMM Cc1ccc(-c2nc3ccc(Oc4ccccc4)cc3c(=O)[n-]2)cn1 ZINC000620127075 1051029620 /nfs/dbraw/zinc/02/96/20/1051029620.db2.gz MKDDIYNVGGXCFJ-UHFFFAOYSA-N -1 1 329.359 4.498 20 0 EIADMM Cc1cccc(C)c1[N-]S(=O)(=O)c1cc(F)cc(C(F)(F)F)c1 ZINC001189948842 1051087919 /nfs/dbraw/zinc/08/79/19/1051087919.db2.gz OSNMYCVSVCCXPR-UHFFFAOYSA-N -1 1 347.333 4.262 20 0 EIADMM [O-]c1c(Cl)cc(Cl)cc1Nc1cnn([C@@H]2CCCCO2)c1 ZINC001174610877 1051109146 /nfs/dbraw/zinc/10/91/46/1051109146.db2.gz JYSDPHZYGLMYNH-ZDUSSCGKSA-N -1 1 328.199 4.338 20 0 EIADMM O=C(NCc1ccc(Cl)cc1Cl)Nc1c(F)cc([O-])cc1F ZINC001190098676 1051113689 /nfs/dbraw/zinc/11/36/89/1051113689.db2.gz PTKYHMWELDBDKY-UHFFFAOYSA-N -1 1 347.148 4.299 20 0 EIADMM CC(C)(C[N-]S(=O)(=O)c1cc(Cl)sc1Cl)C1CCC1 ZINC001190402177 1051168470 /nfs/dbraw/zinc/16/84/70/1051168470.db2.gz LPDDPODBHNYOHJ-UHFFFAOYSA-N -1 1 342.313 4.160 20 0 EIADMM CC(C)c1cccc(F)c1[N-]S(=O)(=O)c1cc(F)cc(F)c1F ZINC001190403071 1051169027 /nfs/dbraw/zinc/16/90/27/1051169027.db2.gz GTNMTISTEHHMJN-UHFFFAOYSA-N -1 1 347.333 4.167 20 0 EIADMM Cc1noc(-c2ccccc2)c1NC(=O)Nc1cc(F)c([O-])c(F)c1 ZINC001190369504 1051170858 /nfs/dbraw/zinc/17/08/58/1051170858.db2.gz VIRBLDOMSBJKBP-UHFFFAOYSA-N -1 1 345.305 4.278 20 0 EIADMM CCC(C)(C)c1ccc(S(=O)(=O)[N-]c2ccc3oncc3c2)cc1 ZINC001190446926 1051187780 /nfs/dbraw/zinc/18/77/80/1051187780.db2.gz BJYBFOXHXHJJRR-UHFFFAOYSA-N -1 1 344.436 4.316 20 0 EIADMM COc1cc(Cl)cc([N-]S(=O)(=O)c2ccc(C3CC3)cc2)c1 ZINC001190499332 1051211664 /nfs/dbraw/zinc/21/16/64/1051211664.db2.gz BJFNVULIYFBJAP-UHFFFAOYSA-N -1 1 337.828 4.027 20 0 EIADMM [O-]c1c(Cl)cc(Br)cc1Nc1ccc2c(c1)OCO2 ZINC001174868417 1051225474 /nfs/dbraw/zinc/22/54/74/1051225474.db2.gz FSSPIBINWWNAPT-UHFFFAOYSA-N -1 1 342.576 4.280 20 0 EIADMM COc1ccc(Nc2cc(Cl)cc(Cl)c2[O-])c(OC)c1OC ZINC001174900984 1051235927 /nfs/dbraw/zinc/23/59/27/1051235927.db2.gz ILLBFHRXINFHTG-UHFFFAOYSA-N -1 1 344.194 4.468 20 0 EIADMM COc1ccc(Nc2ccc(Cl)c(Cl)c2[O-])c(OC)c1OC ZINC001174902269 1051236508 /nfs/dbraw/zinc/23/65/08/1051236508.db2.gz HVMNIEVSMPVFCK-UHFFFAOYSA-N -1 1 344.194 4.468 20 0 EIADMM COc1cc(C(=O)Nc2ccccc2OCC2CC2)cc(Cl)c1[O-] ZINC000153879657 1051240667 /nfs/dbraw/zinc/24/06/67/1051240667.db2.gz PAFLESXSMZMVPL-UHFFFAOYSA-N -1 1 347.798 4.095 20 0 EIADMM CC(C)c1ccc(C(=O)Nc2cc(Cl)c3c(c2)OCCO3)c([O-])c1 ZINC001181823450 1051320217 /nfs/dbraw/zinc/32/02/17/1051320217.db2.gz JBBBBCOUZNNMHP-UHFFFAOYSA-N -1 1 347.798 4.193 20 0 EIADMM COc1cc(C(=O)N(C)C(C)(C)Cc2ccccc2)cc(Cl)c1[O-] ZINC001191146740 1051362391 /nfs/dbraw/zinc/36/23/91/1051362391.db2.gz GXGKITZQAAILCZ-UHFFFAOYSA-N -1 1 347.842 4.148 20 0 EIADMM CCCCc1ccc(S(=O)(=O)[N-]c2cc(Cl)ncc2C)cc1 ZINC001191233818 1051407884 /nfs/dbraw/zinc/40/78/84/1051407884.db2.gz SSVMGHFOCLCVBJ-UHFFFAOYSA-N -1 1 338.860 4.187 20 0 EIADMM CCCCc1ccc(S(=O)(=O)[N-]c2cccc3ccncc32)cc1 ZINC001191248798 1051411379 /nfs/dbraw/zinc/41/13/79/1051411379.db2.gz JUMQBIZCOVMIHI-UHFFFAOYSA-N -1 1 340.448 4.378 20 0 EIADMM CCCCc1ccc(S(=O)(=O)[N-]c2cccc(OC)c2C)cc1 ZINC001191248761 1051411501 /nfs/dbraw/zinc/41/15/01/1051411501.db2.gz HSFLWWAXILJSQW-UHFFFAOYSA-N -1 1 333.453 4.147 20 0 EIADMM CCCCc1ccc(S(=O)(=O)[N-]c2cc(C(C)=O)ccc2C)cc1 ZINC001191248747 1051411621 /nfs/dbraw/zinc/41/16/21/1051411621.db2.gz HBYWZCKETKVZMR-UHFFFAOYSA-N -1 1 345.464 4.341 20 0 EIADMM [O-]c1ccc(CNc2ccc(SC(F)(F)F)nc2)c(F)c1F ZINC001182284104 1051466729 /nfs/dbraw/zinc/46/67/29/1051466729.db2.gz DOVIGGRADMGWTF-UHFFFAOYSA-N -1 1 336.285 4.289 20 0 EIADMM Cc1ccc(Cl)c(NC(=O)Nc2cc3ccc([O-])cc3oc2=O)c1 ZINC001191677477 1051505659 /nfs/dbraw/zinc/50/56/59/1051505659.db2.gz WCOOUUKNKOZQCA-UHFFFAOYSA-N -1 1 344.754 4.104 20 0 EIADMM O=S(=O)([N-][C@H](C1CCC1)C1CCCC1)c1cc(Cl)ccc1F ZINC001191720183 1051519517 /nfs/dbraw/zinc/51/95/17/1051519517.db2.gz OBCSTJFRLCFZHQ-INIZCTEOSA-N -1 1 345.867 4.116 20 0 EIADMM O=S(=O)([N-][C@H]1CCC[C@@H](F)C1)c1sc2ccccc2c1Cl ZINC001191755283 1051538849 /nfs/dbraw/zinc/53/88/49/1051538849.db2.gz CIISKPJAUGGMMD-ZJUUUORDSA-N -1 1 347.864 4.114 20 0 EIADMM COc1ncc(Nc2cc(Br)cc(Cl)c2[O-])s1 ZINC001175393319 1051570808 /nfs/dbraw/zinc/57/08/08/1051570808.db2.gz MTCDZOVMRZVNJP-UHFFFAOYSA-N -1 1 335.610 4.017 20 0 EIADMM COc1ccc2cc(S(=O)(=O)[N-]c3ccc(C)c(F)c3)ccc2c1 ZINC001191931476 1051586879 /nfs/dbraw/zinc/58/68/79/1051586879.db2.gz IGPPDEQFNUWYQL-UHFFFAOYSA-N -1 1 345.395 4.097 20 0 EIADMM O=C(Cc1occ2ccccc21)Nc1cccc(C(F)(F)F)c1[O-] ZINC001182504159 1051623180 /nfs/dbraw/zinc/62/31/80/1051623180.db2.gz WCIFEYRVJMLYJG-UHFFFAOYSA-N -1 1 335.281 4.338 20 0 EIADMM COC(=O)c1ccc([O-])c(NC(=O)Nc2ccc3sccc3c2)c1 ZINC001192448620 1051737092 /nfs/dbraw/zinc/73/70/92/1051737092.db2.gz HYGRBCZJQKCSCH-UHFFFAOYSA-N -1 1 342.376 4.038 20 0 EIADMM Cc1c(NC(=O)c2c(F)ccc([O-])c2F)snc1-c1ccccc1 ZINC001192525718 1051762401 /nfs/dbraw/zinc/76/24/01/1051762401.db2.gz YWMJUVLIPIXDLT-UHFFFAOYSA-N -1 1 346.358 4.355 20 0 EIADMM C[C@@H](NC(=O)c1c(F)ccc([O-])c1F)C12CC3CC(CC(C3)C1)C2 ZINC001192540583 1051764765 /nfs/dbraw/zinc/76/47/65/1051764765.db2.gz XVSNJFSOHKAYGC-BHWZJQCCSA-N -1 1 335.394 4.005 20 0 EIADMM CCCC[C@@H](CC)COCCCNC(=O)c1cc([O-])cc(F)c1F ZINC001192678456 1051791024 /nfs/dbraw/zinc/79/10/24/1051791024.db2.gz BQINAGZHZVEYEI-CYBMUJFWSA-N -1 1 343.414 4.023 20 0 EIADMM Nc1ccccc1N(C(=O)c1cc([O-])cc(F)c1F)c1ccccc1 ZINC001192664581 1051796320 /nfs/dbraw/zinc/79/63/20/1051796320.db2.gz CQBRLVLPEVXQRN-UHFFFAOYSA-N -1 1 340.329 4.231 20 0 EIADMM Cc1c(Cl)cc(NC(=O)c2c([O-])c(F)ccc2F)c(O)c1Cl ZINC001192716251 1051804579 /nfs/dbraw/zinc/80/45/79/1051804579.db2.gz KITQHIZJBSZCEL-UHFFFAOYSA-N -1 1 348.132 4.244 20 0 EIADMM CCCn1nc(C)cc1Nc1cc(Br)cc(Cl)c1[O-] ZINC001175806766 1051805089 /nfs/dbraw/zinc/80/50/89/1051805089.db2.gz CLYGKGUMPMVRJD-UHFFFAOYSA-N -1 1 344.640 4.467 20 0 EIADMM O=C(Nc1cc(C(F)(F)F)ccn1)c1ccc2ccccc2c1[O-] ZINC001183165827 1051806214 /nfs/dbraw/zinc/80/62/14/1051806214.db2.gz NINMDSFZEBYJAK-UHFFFAOYSA-N -1 1 332.281 4.212 20 0 EIADMM O=C(Nc1ccc([C@H](F)C(F)(F)F)cc1)c1ccc([O-])cc1F ZINC001175874972 1051831720 /nfs/dbraw/zinc/83/17/20/1051831720.db2.gz YJTZYUZDLXTDED-ZDUSSCGKSA-N -1 1 331.240 4.357 20 0 EIADMM O=S(=O)(Cc1ccccc1Oc1ccccc1)c1ccc([O-])cc1 ZINC000621568648 1051889939 /nfs/dbraw/zinc/88/99/39/1051889939.db2.gz MFNNVBDCHWTOLU-UHFFFAOYSA-N -1 1 340.400 4.158 20 0 EIADMM Cc1cnc([N-]S(=O)(=O)c2ccc(C)c3ccccc32)c(Cl)c1 ZINC001193834138 1052007742 /nfs/dbraw/zinc/00/77/42/1052007742.db2.gz VDFWEIFYMIGTSO-UHFFFAOYSA-N -1 1 346.839 4.306 20 0 EIADMM [O-]c1c(Br)ccc(Cl)c1Nc1ccc(O)cc1F ZINC001176417366 1052067817 /nfs/dbraw/zinc/06/78/17/1052067817.db2.gz NNIWHYFIFMLWHJ-UHFFFAOYSA-N -1 1 332.556 4.396 20 0 EIADMM CC(C)c1cccc(F)c1[N-]S(=O)(=O)Cc1noc2ccccc21 ZINC001194104284 1052086345 /nfs/dbraw/zinc/08/63/45/1052086345.db2.gz INWYAGLXDTZHEG-UHFFFAOYSA-N -1 1 348.399 4.032 20 0 EIADMM COc1ccc(-c2ccccn2)nc1Nc1c(F)cc(F)c([O-])c1F ZINC001176664387 1052157834 /nfs/dbraw/zinc/15/78/34/1052157834.db2.gz XIHQMVMUWAFURA-UHFFFAOYSA-N -1 1 347.296 4.019 20 0 EIADMM Cc1ncc(Br)cc1Nc1c(F)cc(F)c([O-])c1F ZINC001176664672 1052158063 /nfs/dbraw/zinc/15/80/63/1052158063.db2.gz UINJQRFGQKRHBH-UHFFFAOYSA-N -1 1 333.107 4.019 20 0 EIADMM CCc1ccccc1[N-]S(=O)(=O)c1cccc2c(Cl)nccc21 ZINC001194498173 1052160037 /nfs/dbraw/zinc/16/00/37/1052160037.db2.gz DVVAUWRFMJYWEA-UHFFFAOYSA-N -1 1 346.839 4.251 20 0 EIADMM [O-]c1c(F)cc(F)c(Nc2ccc(Br)cc2F)c1F ZINC001176671469 1052160018 /nfs/dbraw/zinc/16/00/18/1052160018.db2.gz FHFRSQBRNSIUAI-UHFFFAOYSA-N -1 1 336.082 4.455 20 0 EIADMM O=c1oc2cc([O-])ccc2cc1Nc1ccc(-c2ccncc2)cc1 ZINC001176696231 1052166532 /nfs/dbraw/zinc/16/65/32/1052166532.db2.gz UJTODDKARFHTEA-UHFFFAOYSA-N -1 1 330.343 4.304 20 0 EIADMM O=C(Nc1cc(F)c(F)cc1[O-])Oc1ccc(Br)cc1 ZINC001194599960 1052176460 /nfs/dbraw/zinc/17/64/60/1052176460.db2.gz MGAZOINPNTTZRL-UHFFFAOYSA-N -1 1 344.111 4.044 20 0 EIADMM Cc1cccc(C)c1S(=O)(=O)[N-]c1cc(Cl)cc2cnccc21 ZINC001194643282 1052185847 /nfs/dbraw/zinc/18/58/47/1052185847.db2.gz KBRMEDBVKLTYOI-UHFFFAOYSA-N -1 1 346.839 4.306 20 0 EIADMM COc1ccsc1C(=O)/C=C/c1ccc([O-])c(Br)c1 ZINC000184770862 1052202562 /nfs/dbraw/zinc/20/25/62/1052202562.db2.gz XEKXUJMGDOULTH-HWKANZROSA-N -1 1 339.210 4.121 20 0 EIADMM C/C(=C\c1cccc(Cl)c1)C(=O)NCc1ccc([O-])c(Cl)c1 ZINC001176988896 1052212549 /nfs/dbraw/zinc/21/25/49/1052212549.db2.gz UFLRFXOTPOTOEO-YRNVUSSQSA-N -1 1 336.218 4.419 20 0 EIADMM CC(C)(C)COc1cccc(F)c1[N-]S(=O)(=O)c1ccsc1 ZINC001185391983 1052228801 /nfs/dbraw/zinc/22/88/01/1052228801.db2.gz GVCWJGDUKDHTMU-UHFFFAOYSA-N -1 1 343.445 4.113 20 0 EIADMM O=C(NCc1ccc(F)cc1)Nc1cc(Cl)c(Cl)cc1[O-] ZINC001185471896 1052246875 /nfs/dbraw/zinc/24/68/75/1052246875.db2.gz MWCMUCDSQFURSQ-UHFFFAOYSA-N -1 1 329.158 4.160 20 0 EIADMM CSc1cccc([N-]S(=O)(=O)c2ccc(Cl)c(C)c2)c1 ZINC001185520614 1052254966 /nfs/dbraw/zinc/25/49/66/1052254966.db2.gz HAPSUMPBSPISKX-UHFFFAOYSA-N -1 1 327.858 4.171 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2ccc3ccc(O)cc3c2)ccc1Cl ZINC001185525121 1052255664 /nfs/dbraw/zinc/25/56/64/1052255664.db2.gz RIBSGVONOMPTFR-UHFFFAOYSA-N -1 1 347.823 4.308 20 0 EIADMM CC(C)(C)[C@H]1CCCN(C(=O)c2ccc(C(F)(F)F)cc2[O-])C1 ZINC000622574680 1052341187 /nfs/dbraw/zinc/34/11/87/1052341187.db2.gz VTSFEDVJNCZMAN-LBPRGKRZSA-N -1 1 329.362 4.309 20 0 EIADMM Cc1c(=O)[n-]c(SCc2cccc(Cl)n2)nc1-c1ccccc1 ZINC000185050877 1052377893 /nfs/dbraw/zinc/37/78/93/1052377893.db2.gz AIOQYAHNAQJXNL-UHFFFAOYSA-N -1 1 343.839 4.086 20 0 EIADMM Cc1c(C(=O)[N-]c2c(F)cc(Cl)cc2F)oc2c1C(=O)CCC2 ZINC000180326728 1052794324 /nfs/dbraw/zinc/79/43/24/1052794324.db2.gz OQSUXEMFEIJHLP-UHFFFAOYSA-N -1 1 339.725 4.291 20 0 EIADMM CSCc1ccccc1[N-]S(=O)(=O)c1ccc(Cl)cc1 ZINC000184028135 1052989789 /nfs/dbraw/zinc/98/97/89/1052989789.db2.gz QIKHSAPUSUBERV-UHFFFAOYSA-N -1 1 327.858 4.004 20 0 EIADMM Cc1ccc([C@@H]2CCCCN2C(=O)c2cc([O-])cnc2Cl)cc1C ZINC001195309552 1053373383 /nfs/dbraw/zinc/37/33/83/1053373383.db2.gz RSPQEWFJLSDXMW-KRWDZBQOSA-N -1 1 344.842 4.425 20 0 EIADMM CCOC(=O)NC(=S)[N-]c1ccc2c(c1)c1ccccc1n2CC ZINC001195486494 1053422589 /nfs/dbraw/zinc/42/25/89/1053422589.db2.gz GRGWDOWVULSZRQ-UHFFFAOYSA-N -1 1 341.436 4.257 20 0 EIADMM O=C([N-]Cc1ccc(C(F)F)cc1)C(F)(F)c1c(F)cccc1F ZINC000765338141 1053509046 /nfs/dbraw/zinc/50/90/46/1053509046.db2.gz YUQIPPGGEQHCQR-UHFFFAOYSA-N -1 1 347.258 4.311 20 0 EIADMM [O-]c1cc(NC(=S)NCc2cccc(Cl)c2)c(F)cc1Cl ZINC001195980421 1053539514 /nfs/dbraw/zinc/53/95/14/1053539514.db2.gz XYMSLIDBEBZLHG-UHFFFAOYSA-N -1 1 345.226 4.325 20 0 EIADMM Cc1cc2c(ncnc2[N-]C(=O)c2snc(Cl)c2Cl)s1 ZINC001196329253 1053640650 /nfs/dbraw/zinc/64/06/50/1053640650.db2.gz JMHOQYHLZCHGEQ-UHFFFAOYSA-N -1 1 345.236 4.015 20 0 EIADMM CC(C)c1ccc(-c2cc(C(=O)[N-]c3noc4cnccc43)no2)cc1 ZINC001196742753 1053746612 /nfs/dbraw/zinc/74/66/12/1053746612.db2.gz PTTIYBVEDOVGTA-UHFFFAOYSA-N -1 1 348.362 4.254 20 0 EIADMM [O-]c1ccc(NC(=S)Nc2ccccc2C(F)(F)F)c(F)c1F ZINC001197258319 1053863624 /nfs/dbraw/zinc/86/36/24/1053863624.db2.gz OFEFPIMNHLSJEC-UHFFFAOYSA-N -1 1 348.296 4.498 20 0 EIADMM [O-]c1cnc(Cl)cc1NC(=S)Nc1ccccc1C(F)(F)F ZINC001197233948 1053867712 /nfs/dbraw/zinc/86/77/12/1053867712.db2.gz UAGUXXHBIZMQJS-UHFFFAOYSA-N -1 1 347.749 4.268 20 0 EIADMM Cc1cc2[nH]c(-c3cc(F)cc(Br)c3O)nc2cc1F ZINC001251406892 1053922173 /nfs/dbraw/zinc/92/21/73/1053922173.db2.gz UXSWQQRKLVXZLV-UHFFFAOYSA-N -1 1 339.139 4.285 20 0 EIADMM Cc1cc([N-]S(=O)(=O)Cc2c(F)cccc2F)c(F)cc1Cl ZINC001197609009 1053943117 /nfs/dbraw/zinc/94/31/17/1053943117.db2.gz QOBHRGYQKTZCNP-UHFFFAOYSA-N -1 1 349.761 4.008 20 0 EIADMM Cc1cccc(-c2nnc([C@H](C)Sc3nc(C)c(C)c(=O)[n-]3)o2)c1 ZINC000776869109 1054015566 /nfs/dbraw/zinc/01/55/66/1054015566.db2.gz ZEMTUAAKAVVHKD-LBPRGKRZSA-N -1 1 342.424 4.011 20 0 EIADMM Cc1cccc([N-]S(=O)(=O)c2ccc(OC(F)F)c(Cl)c2)c1 ZINC000032585473 1054107678 /nfs/dbraw/zinc/10/76/78/1054107678.db2.gz VMEMXRUNSTVXCK-UHFFFAOYSA-N -1 1 347.770 4.051 20 0 EIADMM O=S(=O)([N-]c1ccc2c3c(cccc31)CC2)c1ccc(F)c(F)c1 ZINC000039536388 1054136793 /nfs/dbraw/zinc/13/67/93/1054136793.db2.gz FUGAZYFCGBSUQY-UHFFFAOYSA-N -1 1 345.370 4.017 20 0 EIADMM Cc1ccc(-c2nc(C(=O)[N-]c3nnc(CC(C)C)s3)cs2)o1 ZINC000041760005 1054147727 /nfs/dbraw/zinc/14/77/27/1054147727.db2.gz OIBFADWPCWXMFO-UHFFFAOYSA-N -1 1 348.453 4.014 20 0 EIADMM O=S(=O)([N-]c1ccc(Cl)c(F)c1)c1ccc2occc2c1 ZINC001198855081 1054277927 /nfs/dbraw/zinc/27/79/27/1054277927.db2.gz FNPUBKOLJCMMAS-UHFFFAOYSA-N -1 1 325.748 4.026 20 0 EIADMM Cc1ccnc2cc([N-]S(=O)(=O)c3ccc4occc4c3)ccc12 ZINC001198858700 1054284702 /nfs/dbraw/zinc/28/47/02/1054284702.db2.gz GEPDAWGMQCHHND-UHFFFAOYSA-N -1 1 338.388 4.090 20 0 EIADMM CCc1ccc(Cl)cc1[N-]S(=O)(=O)c1ccc2occc2c1 ZINC001198869601 1054295312 /nfs/dbraw/zinc/29/53/12/1054295312.db2.gz XGDURNODUDNVMG-UHFFFAOYSA-N -1 1 335.812 4.449 20 0 EIADMM [O-]c1cc(NC(=S)Nc2ccc(F)cc2F)c(F)cc1Cl ZINC001200927808 1054579727 /nfs/dbraw/zinc/57/97/27/1054579727.db2.gz GTXRLSFNMDOTBL-UHFFFAOYSA-N -1 1 332.734 4.272 20 0 EIADMM O=C(NCCc1ccc(-c2ccccc2)cc1)c1ccc([O-])cc1F ZINC000776176607 1054804256 /nfs/dbraw/zinc/80/42/56/1054804256.db2.gz MISVFBJUHMOUMW-UHFFFAOYSA-N -1 1 335.378 4.171 20 0 EIADMM CN(C)C(=O)c1cc(F)cc(Nc2c(Cl)ccc([O-])c2Cl)c1 ZINC001201526543 1054844246 /nfs/dbraw/zinc/84/42/46/1054844246.db2.gz AFZZUCBGRWJXCU-UHFFFAOYSA-N -1 1 343.185 4.284 20 0 EIADMM Cc1c(C)c(C)c(S(=O)(=O)[N-]c2ccc3ocnc3c2)c(C)c1C ZINC001201799853 1054910027 /nfs/dbraw/zinc/91/00/27/1054910027.db2.gz RTWSUIPSAHWQRL-UHFFFAOYSA-N -1 1 344.436 4.171 20 0 EIADMM O=C(Nc1ccccc1Br)Nc1cc(F)c([O-])cc1F ZINC001201979245 1054956767 /nfs/dbraw/zinc/95/67/67/1054956767.db2.gz UFNWSMPCPJQCCA-UHFFFAOYSA-N -1 1 343.127 4.077 20 0 EIADMM O=C([N-]c1nc(-c2cccc(Cl)c2)ns1)c1ccc(Cl)o1 ZINC000065813190 1054961818 /nfs/dbraw/zinc/96/18/18/1054961818.db2.gz PRWBSGMPYAMDET-UHFFFAOYSA-N -1 1 340.191 4.357 20 0 EIADMM O=C(Nc1ccc(F)cc1F)Nc1cccc(C(F)(F)F)c1[O-] ZINC001202022485 1054982690 /nfs/dbraw/zinc/98/26/90/1054982690.db2.gz PZNRPTPEEUFYSN-UHFFFAOYSA-N -1 1 332.228 4.333 20 0 EIADMM O=C(Nc1ccc(Br)cc1)Nc1ccc(Cl)cc1[O-] ZINC001202333565 1055142694 /nfs/dbraw/zinc/14/26/94/1055142694.db2.gz YPBPNXLQCWIHIX-UHFFFAOYSA-N -1 1 341.592 4.452 20 0 EIADMM O=C(Nc1ccc(Br)cc1)Nc1cc(F)cc(F)c1[O-] ZINC001202335881 1055144359 /nfs/dbraw/zinc/14/43/59/1055144359.db2.gz HQHQEUWHSMMKOJ-UHFFFAOYSA-N -1 1 343.127 4.077 20 0 EIADMM CC[C@@H]1CCC[C@@]1(C)C(=O)N1CCC(C(=O)c2ccc([O-])cc2)CC1 ZINC000878046094 1055178615 /nfs/dbraw/zinc/17/86/15/1055178615.db2.gz QTHQIHQZPFNCTN-DYESRHJHSA-N -1 1 343.467 4.030 20 0 EIADMM C[C@H](c1ccc(Br)cc1)N1CCC(CCC(=O)[O-])CC1 ZINC000086755667 1055268291 /nfs/dbraw/zinc/26/82/91/1055268291.db2.gz DIBJJOVPAKXYCJ-GFCCVEGCSA-N -1 1 340.261 4.087 20 0 EIADMM COc1ccc(N[C@H](C)c2cc(Br)cc(F)c2[O-])cc1 ZINC000186243656 1055271622 /nfs/dbraw/zinc/27/16/22/1055271622.db2.gz DXXYQUNEORRQEV-SECBINFHSA-N -1 1 340.192 4.476 20 0 EIADMM CCOc1cc(-c2nc(CCCCSC)no2)cc(Cl)c1[O-] ZINC000903784596 1056387363 /nfs/dbraw/zinc/38/73/63/1056387363.db2.gz APBWTSOYGOYCGV-UHFFFAOYSA-N -1 1 342.848 4.180 20 0 EIADMM CC(C)c1nc(CSc2nc(C(F)(F)F)cc(=O)[n-]2)cs1 ZINC000109713924 1056518622 /nfs/dbraw/zinc/51/86/22/1056518622.db2.gz KJTQIFMJZMTSAM-UHFFFAOYSA-N -1 1 335.376 4.073 20 0 EIADMM Nc1ccc(Cl)cc1Nc1ccc(F)c(Br)c1[O-] ZINC001212441806 1056695994 /nfs/dbraw/zinc/69/59/94/1056695994.db2.gz WVAPPANCOYSVLK-UHFFFAOYSA-N -1 1 331.572 4.273 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2cccc(Cl)c2Cl)c(F)c1 ZINC000007428143 1056793919 /nfs/dbraw/zinc/79/39/19/1056793919.db2.gz KYWWFOPKKBMICM-UHFFFAOYSA-N -1 1 334.199 4.242 20 0 EIADMM Cc1c(F)cccc1S(=O)(=O)[N-]c1ccc(SC(F)F)cc1 ZINC000743249032 1058894796 /nfs/dbraw/zinc/89/47/96/1058894796.db2.gz CSLDWACQMTVJET-UHFFFAOYSA-N -1 1 347.383 4.250 20 0 EIADMM CCC[C@@H](C(=O)OCCc1cc(C(C)=O)ccc1[O-])c1ccccc1 ZINC000744575095 1059585865 /nfs/dbraw/zinc/58/58/65/1059585865.db2.gz YXCBUDKDGJNJMN-LJQANCHMSA-N -1 1 340.419 4.264 20 0 EIADMM C[C@H]([N-]C(=O)C(F)(F)c1ccccc1F)c1cccc(F)c1F ZINC000766628509 1060709881 /nfs/dbraw/zinc/70/98/81/1060709881.db2.gz MQDMMNYWPOEXNL-VIFPVBQESA-N -1 1 329.268 4.073 20 0 EIADMM O=S(=O)([N-]c1ccc(F)cc1F)c1cc(Cl)sc1Cl ZINC000020627217 202051272 /nfs/dbraw/zinc/05/12/72/202051272.db2.gz DXQBMEITWHCWTE-UHFFFAOYSA-N -1 1 344.191 4.134 20 0 EIADMM CC(C)(C)c1nc2cc([N-]S(=O)(=O)c3ccc(F)cc3)ccc2o1 ZINC000032097490 202221600 /nfs/dbraw/zinc/22/16/00/202221600.db2.gz NWQPBCYFSZTBGP-UHFFFAOYSA-N -1 1 348.399 4.065 20 0 EIADMM Cc1c(Cl)cccc1[N-]S(=O)(=O)c1ccc2c(c1)CCCC2 ZINC000005126499 210394941 /nfs/dbraw/zinc/39/49/41/210394941.db2.gz ZBVQBCZVEIMMRJ-UHFFFAOYSA-N -1 1 335.856 4.328 20 0 EIADMM CCC[C@@H](CCc1ccccc1)NC(=O)c1c(F)ccc([O-])c1F ZINC000449992648 1032203594 /nfs/dbraw/zinc/20/35/94/1032203594.db2.gz OLQSVYMBDXVUNT-AWEZNQCLSA-N -1 1 333.378 4.202 20 0 EIADMM C[C@H]1[C@@H](C2CC2)[C@H]1C(=O)Nc1c([O-])cc(Br)cc1Cl ZINC000529368739 1032331965 /nfs/dbraw/zinc/33/19/65/1032331965.db2.gz ZZUYLOCPBRPRLV-QNRPFLCFSA-N -1 1 344.636 4.039 20 0 EIADMM C[C@H]1C[C@H](C(=O)Nc2cc(Cl)c([O-])c3ccccc23)CCC1=O ZINC000529540233 1032428953 /nfs/dbraw/zinc/42/89/53/1032428953.db2.gz VSUFXDQPYKNVNL-WDEREUQCSA-N -1 1 331.799 4.143 20 0 EIADMM CO[C@@H]1CCC[C@@H](C(=O)Nc2cc(Cl)c([O-])c3ccccc23)C1 ZINC000529539037 1032429041 /nfs/dbraw/zinc/42/90/41/1032429041.db2.gz OCUQUPLPCIAYGD-VXGBXAGGSA-N -1 1 333.815 4.343 20 0 EIADMM O=C(Nc1cc(Cl)c([O-])c2ccccc12)C1(C(F)(F)F)CC1 ZINC000529539027 1032429410 /nfs/dbraw/zinc/42/94/10/1032429410.db2.gz NXSYVGQXLAHCGO-UHFFFAOYSA-N -1 1 329.705 4.480 20 0 EIADMM CC(C)(NC(=O)c1ccc(Cl)cc1[O-])c1nc2ccccc2s1 ZINC001168123918 1032616837 /nfs/dbraw/zinc/61/68/37/1032616837.db2.gz ILYGXJIRHWKEFF-UHFFFAOYSA-N -1 1 346.839 4.320 20 0 EIADMM Cc1ccc(NC(=O)N(C)C)cc1NCc1cccc([O-])c1Cl ZINC000339388577 1018831932 /nfs/dbraw/zinc/83/19/32/1018831932.db2.gz FPNXKZAJNPWFAG-UHFFFAOYSA-N -1 1 333.819 4.060 20 0 EIADMM COc1ccc2c(c1)[C@H](C(=O)Nc1ccc([O-])c(Cl)c1)CCC2 ZINC000654936390 1019029411 /nfs/dbraw/zinc/02/94/11/1019029411.db2.gz XNNQAVGGZVLDTN-CQSZACIVSA-N -1 1 331.799 4.113 20 0 EIADMM Cc1cc(F)cc(S(=O)(=O)[N-]c2cccc(C(F)(F)F)c2C)c1 ZINC000471135361 1019070801 /nfs/dbraw/zinc/07/08/01/1019070801.db2.gz AJVTYAHLOWZTGS-UHFFFAOYSA-N -1 1 347.333 4.262 20 0 EIADMM CCCOc1ccc(CN[C@@H](CC(=O)[O-])c2ccc(F)cc2F)cc1 ZINC000683174204 1019096755 /nfs/dbraw/zinc/09/67/55/1019096755.db2.gz RLDUFRYEVXPNPF-SFHVURJKSA-N -1 1 349.377 4.059 20 0 EIADMM CC(C)(C)c1nsc([N-]C(=O)c2cnc(-c3ccccc3)s2)n1 ZINC000068072365 1019638616 /nfs/dbraw/zinc/63/86/16/1019638616.db2.gz MYYNKWGNJIQXFI-UHFFFAOYSA-N -1 1 344.465 4.211 20 0 EIADMM O=C(c1cncc([O-])c1)N(Cc1ccccc1Cl)C1CCCC1 ZINC000339925219 1020117319 /nfs/dbraw/zinc/11/73/19/1020117319.db2.gz VJUHPIAWHVSDJR-UHFFFAOYSA-N -1 1 330.815 4.026 20 0 EIADMM CC(C)N(Cc1ccc(F)cc1)C(=O)c1ncc2ccccc2c1[O-] ZINC001625851748 1020288253 /nfs/dbraw/zinc/28/82/53/1020288253.db2.gz FPZSUQJSWPBGCW-UHFFFAOYSA-N -1 1 338.382 4.130 20 0 EIADMM CCSCc1ccnc([N-]S(=O)(=O)/C=C/c2ccc(C)cc2)c1 ZINC000090367908 1020347730 /nfs/dbraw/zinc/34/77/30/1020347730.db2.gz DDWBVBNUTFXPIN-PKNBQFBNSA-N -1 1 348.493 4.056 20 0 EIADMM COc1cc(C(F)(F)F)ccc1[N-]c1nnc(-c2ccco2)o1 ZINC001209882035 1020582197 /nfs/dbraw/zinc/58/21/97/1020582197.db2.gz RDZVXQMXTKUEJC-UHFFFAOYSA-N -1 1 325.246 4.101 20 0 EIADMM [O-]c1ccc(-c2noc(-c3ccc([C@@H]4CCCOC4)cc3)n2)cc1F ZINC000683593520 1020949060 /nfs/dbraw/zinc/94/90/60/1020949060.db2.gz MNRGNCRXJUWWGC-OAHLLOKOSA-N -1 1 340.354 4.142 20 0 EIADMM O=C(Nc1ccc(Cl)cc1[O-])c1nc2ccccc2cc1Cl ZINC000685797831 1021325166 /nfs/dbraw/zinc/32/51/66/1021325166.db2.gz YTXSPADMCJNIJF-UHFFFAOYSA-N -1 1 333.174 4.500 20 0 EIADMM Cc1csc(Oc2ccc(NC(=O)c3ccccc3[O-])cc2F)n1 ZINC000548059785 1021613880 /nfs/dbraw/zinc/61/38/80/1021613880.db2.gz CNANFKPNZAGCMU-UHFFFAOYSA-N -1 1 344.367 4.341 20 0 EIADMM CC(C)[C@H]1CN([C@@H](C(=O)[O-])c2cccc(Cl)c2Cl)CCS1 ZINC000580085808 1021627558 /nfs/dbraw/zinc/62/75/58/1021627558.db2.gz UJGQBJBZZLPPMX-TZMCWYRMSA-N -1 1 348.295 4.193 20 0 EIADMM Cc1oc(-c2cccs2)nc1C[N@H+]1CCC[C@H](C(C)(C)C(=O)[O-])C1 ZINC000325460259 1021760915 /nfs/dbraw/zinc/76/09/15/1021760915.db2.gz RBFBTJLZTSEACX-ZDUSSCGKSA-N -1 1 348.468 4.034 20 0 EIADMM CCCn1ncc(NC(=O)c2cc3ccccc3cc2[O-])c1C1CC1 ZINC000580284508 1021821067 /nfs/dbraw/zinc/82/10/67/1021821067.db2.gz SPOCRRMNVZTAQL-UHFFFAOYSA-N -1 1 335.407 4.282 20 0 EIADMM COc1ccc2c(c1)C[C@H](C(C)C)CN2C(=O)c1cc(F)ccc1[O-] ZINC000622728734 1021838509 /nfs/dbraw/zinc/83/85/09/1021838509.db2.gz JNJZISZGQMMFQS-AWEZNQCLSA-N -1 1 343.398 4.015 20 0 EIADMM CCCc1nnc([N-]C(=O)c2coc(-c3ccccc3Cl)n2)s1 ZINC000345064563 1033011390 /nfs/dbraw/zinc/01/13/90/1033011390.db2.gz ASEQMRGMWCLTEY-UHFFFAOYSA-N -1 1 348.815 4.051 20 0 EIADMM O=C([O-])c1ccc(CN2CCC(c3cccc(F)c3F)CC2)c(F)c1 ZINC000580456616 1022043303 /nfs/dbraw/zinc/04/33/03/1022043303.db2.gz KCPIGWKTLYZKBQ-UHFFFAOYSA-N -1 1 349.352 4.182 20 0 EIADMM O=S(=O)([N-]c1ccccc1)c1ccc(SC(F)(F)F)cc1 ZINC000064937614 1022069384 /nfs/dbraw/zinc/06/93/84/1022069384.db2.gz CWSDTSVCIRAWIT-UHFFFAOYSA-N -1 1 333.356 4.099 20 0 EIADMM Cc1ccc(CCC(=O)Nc2cc([O-])c(F)cc2F)cc1Cl ZINC001625892942 1022081379 /nfs/dbraw/zinc/08/13/79/1022081379.db2.gz BOTIHACJHQYPPE-UHFFFAOYSA-N -1 1 325.742 4.204 20 0 EIADMM CC/C(=C\C(=O)Nc1cc([O-])c(F)cc1F)c1ccc(OC)cc1 ZINC001625893796 1022173635 /nfs/dbraw/zinc/17/36/35/1022173635.db2.gz NIHPDYVLRWARAZ-DHZHZOJOSA-N -1 1 333.334 4.111 20 0 EIADMM O=C(CCCc1ccccc1Cl)Nc1cc([O-])c(F)cc1F ZINC001625894212 1022291827 /nfs/dbraw/zinc/29/18/27/1022291827.db2.gz SHISLINKNJKEAF-UHFFFAOYSA-N -1 1 325.742 4.285 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1CCS[C@H]2CCCC[C@@H]21 ZINC000175456909 1022358678 /nfs/dbraw/zinc/35/86/78/1022358678.db2.gz HDXZAZNLDOYZRS-WMZOPIPTSA-N -1 1 327.449 4.046 20 0 EIADMM [O-]c1ccc(F)cc1-c1nc(Cc2c(Cl)cccc2Cl)no1 ZINC000317468837 1022659777 /nfs/dbraw/zinc/65/97/77/1022659777.db2.gz XDPJQUOYUMCDDQ-UHFFFAOYSA-N -1 1 339.153 4.479 20 0 EIADMM CCOc1cc(C(=O)N2CCC[C@H]2C2CCCC2)cc(Cl)c1[O-] ZINC000186674384 1022728290 /nfs/dbraw/zinc/72/82/90/1022728290.db2.gz SZHOHERJOGBXQM-HNNXBMFYSA-N -1 1 337.847 4.239 20 0 EIADMM CCOc1cc(C(=O)Nc2ncc(C(C)C)s2)cc(Cl)c1[O-] ZINC000186836216 1022768304 /nfs/dbraw/zinc/76/83/04/1022768304.db2.gz QZGCMGBAJMFMKL-UHFFFAOYSA-N -1 1 340.832 4.277 20 0 EIADMM CC(=O)c1cc(F)c([N-]C(=O)c2ccc(Cl)s2)c(F)c1F ZINC000461092901 1022807840 /nfs/dbraw/zinc/80/78/40/1022807840.db2.gz HANVENJZYXVIPU-UHFFFAOYSA-N -1 1 333.718 4.274 20 0 EIADMM O=C(Nc1cc(-c2ccccc2)ns1)c1c(F)ccc([O-])c1F ZINC000581098524 1022830261 /nfs/dbraw/zinc/83/02/61/1022830261.db2.gz CISCENHEYURAKM-UHFFFAOYSA-N -1 1 332.331 4.046 20 0 EIADMM CC(C)c1cc(C(=O)[N-]c2c(F)cc(Br)cc2F)no1 ZINC000159305296 1022831202 /nfs/dbraw/zinc/83/12/02/1022831202.db2.gz SNUGMXUHYMCKFC-UHFFFAOYSA-N -1 1 345.143 4.091 20 0 EIADMM O=c1cc(C2CC2)nc(SCc2ncc(-c3ccc(F)cc3)o2)[n-]1 ZINC000188148349 1023295111 /nfs/dbraw/zinc/29/51/11/1023295111.db2.gz RGKJORGMKPWXBZ-UHFFFAOYSA-N -1 1 343.383 4.146 20 0 EIADMM Cc1ccc(/C=C/S(=O)(=O)[N-]c2nccc3sccc32)cc1 ZINC000160925344 1023310533 /nfs/dbraw/zinc/31/05/33/1023310533.db2.gz SWGULJZXGDRRTR-DHZHZOJOSA-N -1 1 330.434 4.017 20 0 EIADMM C[C@H](Oc1ccc2c(c1)CCC2)c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000580274419 1023341260 /nfs/dbraw/zinc/34/12/60/1023341260.db2.gz IUWPDKICEFXLEE-NSHDSACASA-N -1 1 340.354 4.210 20 0 EIADMM O=C([O-])[C@H]1C[C@H](NCc2csc(Cl)c2Cl)c2ccccc21 ZINC000417637522 1023390707 /nfs/dbraw/zinc/39/07/07/1023390707.db2.gz ZABGPKPTFJJQRN-RYUDHWBXSA-N -1 1 342.247 4.458 20 0 EIADMM CCc1ccc(-c2ccc(CN[C@H](C(=O)[O-])[C@H](C)C3CC3)o2)cc1 ZINC000417640966 1023391941 /nfs/dbraw/zinc/39/19/41/1023391941.db2.gz NWXRBYNEWUFDQL-YJYMSZOUSA-N -1 1 327.424 4.098 20 0 EIADMM CCCc1cc(C(=O)Nc2ccc(-c3cc(=O)[nH][n-]3)cc2)sc1C ZINC000613665040 1023473459 /nfs/dbraw/zinc/47/34/59/1023473459.db2.gz PUPDQCOJZLYNJO-UHFFFAOYSA-N -1 1 341.436 4.357 20 0 EIADMM O=C(CCc1ccccc1Cl)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC000613667335 1023480418 /nfs/dbraw/zinc/48/04/18/1023480418.db2.gz NXZRAXONOZEGOB-UHFFFAOYSA-N -1 1 341.798 4.007 20 0 EIADMM COc1ccc(C(C)C)cc1CN1CC[C@H](C(=O)[O-])[C@@H]2CCCC[C@@H]21 ZINC000656768006 1023512261 /nfs/dbraw/zinc/51/22/61/1023512261.db2.gz UCYHGTMSBJBPKF-FHWLQOOXSA-N -1 1 345.483 4.284 20 0 EIADMM CC(=O)c1cc(F)c([N-]C(=O)c2occc2C(C)C)c(F)c1F ZINC000341509632 1023813680 /nfs/dbraw/zinc/81/36/80/1023813680.db2.gz HZLQQSGRNAQQTP-UHFFFAOYSA-N -1 1 325.286 4.275 20 0 EIADMM Cc1ccccc1[C@@H](C)CC(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC000341630746 1023993690 /nfs/dbraw/zinc/99/36/90/1023993690.db2.gz UHUKIHGZHFQYHK-AWEZNQCLSA-N -1 1 335.407 4.223 20 0 EIADMM O=S(=O)([N-]c1cccc(F)c1F)c1c(Cl)cccc1Cl ZINC000049375382 1024567841 /nfs/dbraw/zinc/56/78/41/1024567841.db2.gz AMTSTYUNYRKHPP-UHFFFAOYSA-N -1 1 338.162 4.072 20 0 EIADMM Cc1c(Cl)cccc1[N-]S(=O)(=O)c1cccc(Cl)c1C ZINC000048652639 1024670524 /nfs/dbraw/zinc/67/05/24/1024670524.db2.gz NWBAFIWKOASJQO-UHFFFAOYSA-N -1 1 330.236 4.411 20 0 EIADMM Cc1cc(-c2nc(=O)c3c(-c4ccc(C)s4)csc3[n-]2)no1 ZINC000684559698 1024709149 /nfs/dbraw/zinc/70/91/49/1024709149.db2.gz YOBSUWNZYDXJMV-UHFFFAOYSA-N -1 1 329.406 4.397 20 0 EIADMM Cc1ccc(CN(Cc2cccc(C(=O)[O-])c2Cl)CC2CC2)cn1 ZINC000652433011 1024828468 /nfs/dbraw/zinc/82/84/68/1024828468.db2.gz MRJQSUCNTWFTEI-UHFFFAOYSA-N -1 1 344.842 4.154 20 0 EIADMM Cc1ccccc1Nc1nc(CN2CCCC[C@@H]2CC(=O)[O-])cs1 ZINC000652463549 1024842937 /nfs/dbraw/zinc/84/29/37/1024842937.db2.gz KHGKSXHQGRLUAV-OAHLLOKOSA-N -1 1 345.468 4.024 20 0 EIADMM CCc1ccc(-c2nc(CN(CCC(=O)[O-])C(C)C)cs2)cc1 ZINC000652478951 1024846825 /nfs/dbraw/zinc/84/68/25/1024846825.db2.gz BQXIRIORVBCAQO-UHFFFAOYSA-N -1 1 332.469 4.058 20 0 EIADMM C[C@@H](OC(C)(C)C)[C@H](NCc1ccc(-c2cccs2)cc1)C(=O)[O-] ZINC000663264500 1024968375 /nfs/dbraw/zinc/96/83/75/1024968375.db2.gz VKCUFMXKMMDRAW-DYVFJYSZSA-N -1 1 347.480 4.162 20 0 EIADMM CCCOc1ccc(S(=O)(=O)[N-]c2cnccc2C)cc1C(C)C ZINC000663299283 1025018455 /nfs/dbraw/zinc/01/84/55/1025018455.db2.gz ISTMBCHSLZTVDP-UHFFFAOYSA-N -1 1 348.468 4.103 20 0 EIADMM C[C@H]1CO[C@@H](c2ccccc2)CN1C(=O)c1ccc2ccccc2c1[O-] ZINC000110314684 1033267141 /nfs/dbraw/zinc/26/71/41/1033267141.db2.gz CWQIURZJSPOPPV-MGPUTAFESA-N -1 1 347.414 4.148 20 0 EIADMM Cc1nc(-c2c[nH]c(C(=O)Nc3ccc([O-])c(Cl)c3)c2)cs1 ZINC000111667484 1025749032 /nfs/dbraw/zinc/74/90/32/1025749032.db2.gz XVSVPHXNCOLFNY-UHFFFAOYSA-N -1 1 333.800 4.058 20 0 EIADMM CC(C)c1cc([N-]S(=O)(=O)c2cccc(-c3ccccc3)c2)[nH]n1 ZINC000506804185 1025780118 /nfs/dbraw/zinc/78/01/18/1025780118.db2.gz BDZBPIIIQFEDDR-UHFFFAOYSA-N -1 1 341.436 4.001 20 0 EIADMM CCC(C)(C)c1ccc(S(=O)(=O)[N-]c2cccc(C(C)=O)c2)cc1 ZINC000005977805 1025787455 /nfs/dbraw/zinc/78/74/55/1025787455.db2.gz YOPDJDLDAWXEPF-UHFFFAOYSA-N -1 1 345.464 4.378 20 0 EIADMM O=C(c1cc(Cl)ccc1[O-])N1CCC(Cc2ccccc2)CC1 ZINC000028199112 1026027347 /nfs/dbraw/zinc/02/73/47/1026027347.db2.gz PUERZLMCRBEWRB-UHFFFAOYSA-N -1 1 329.827 4.141 20 0 EIADMM Cc1cnc(SCc2ccc(Cl)cc2Br)[n-]c1=O ZINC001307347752 1026145936 /nfs/dbraw/zinc/14/59/36/1026145936.db2.gz VGOACUUFWQTGFN-UHFFFAOYSA-N -1 1 345.649 4.199 20 0 EIADMM Cc1onc(-c2ccc(Cl)c(Cl)c2)c1C(=O)[N-]c1cnoc1 ZINC000684765830 1026223718 /nfs/dbraw/zinc/22/37/18/1026223718.db2.gz MINNAMRBXMSWGI-UHFFFAOYSA-N -1 1 338.150 4.197 20 0 EIADMM Cc1oc([C@@H](C)N(C)Cc2ccc(OC(F)F)cc2)cc1C(=O)[O-] ZINC000563278412 1026314284 /nfs/dbraw/zinc/31/42/84/1026314284.db2.gz JPVMEHLWDDJRKY-SNVBAGLBSA-N -1 1 339.338 4.081 20 0 EIADMM O=C(CCOc1ccccc1Cl)Nc1ccc([O-])c(Cl)c1 ZINC000111668720 1026315164 /nfs/dbraw/zinc/31/51/64/1026315164.db2.gz UMXOAVZDIJIDJX-UHFFFAOYSA-N -1 1 326.179 4.107 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N1CCC(Cc2ccccc2)CC1 ZINC000320081306 1026343222 /nfs/dbraw/zinc/34/32/22/1026343222.db2.gz WBUVJMIQGXKTCS-UHFFFAOYSA-N -1 1 329.827 4.141 20 0 EIADMM O=C([O-])C[C@H](NCc1ccc(-c2ccccc2F)o1)c1ccsc1 ZINC000426683414 1026474643 /nfs/dbraw/zinc/47/46/43/1026474643.db2.gz RWBKAPMEYGQEKW-INIZCTEOSA-N -1 1 345.395 4.453 20 0 EIADMM Cc1ccc([C@@H](NCc2cc(C(F)(F)F)ccc2F)C(=O)[O-])cc1 ZINC000426700601 1026487410 /nfs/dbraw/zinc/48/74/10/1026487410.db2.gz SFGPBPFHGISNDI-OAHLLOKOSA-N -1 1 341.304 4.068 20 0 EIADMM CO[C@@H](c1ccccc1Cl)[C@H](C)[NH2+]Cc1c(F)ccc(O)c1F ZINC000512216079 1026488383 /nfs/dbraw/zinc/48/83/83/1026488383.db2.gz ADUDVOGXVIOVFR-DYZYQPBXSA-N -1 1 341.785 4.190 20 0 EIADMM O=C([O-])C[C@@H](NCc1ccc(Oc2ccccc2)o1)c1ccsc1 ZINC000426690406 1026492497 /nfs/dbraw/zinc/49/24/97/1026492497.db2.gz AFRDLFDBHZOCSS-MRXNPFEDSA-N -1 1 343.404 4.439 20 0 EIADMM O=C([O-])[C@@H](NCc1ccc(F)c(Cl)c1)c1ccc(Cl)c(F)c1 ZINC000426727122 1026502551 /nfs/dbraw/zinc/50/25/51/1026502551.db2.gz MUVCGMKRTAUMOZ-AWEZNQCLSA-N -1 1 346.160 4.187 20 0 EIADMM O=C([O-])[C@H](NCc1cc(Cl)ccc1Cl)c1cccc(F)c1 ZINC000426809647 1026574154 /nfs/dbraw/zinc/57/41/54/1026574154.db2.gz WATNIVIOWZILBP-CQSZACIVSA-N -1 1 328.170 4.048 20 0 EIADMM Cc1cc(C)c(CN[C@@H](CC(=O)[O-])c2ccc(F)cc2F)cc1C ZINC000426825091 1026581826 /nfs/dbraw/zinc/58/18/26/1026581826.db2.gz KVZDKBNHQOOTMW-SFHVURJKSA-N -1 1 333.378 4.196 20 0 EIADMM Cc1cc([C@@H](NCc2ccc(Cl)cc2F)C(=O)[O-])ccc1Cl ZINC000426826566 1026584236 /nfs/dbraw/zinc/58/42/36/1026584236.db2.gz FKKRTVQXUJQBQL-OAHLLOKOSA-N -1 1 342.197 4.356 20 0 EIADMM C[C@@H]1[C@@H](C)CCCN1Cc1csc(-c2cccc(C(=O)[O-])c2)n1 ZINC000582425795 1026623561 /nfs/dbraw/zinc/62/35/61/1026623561.db2.gz NXCYXBWQKUGMCF-QWHCGFSZSA-N -1 1 330.453 4.129 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2ccc3cc[nH]c3c2)ccc1OC(C)C ZINC000432613293 1026637874 /nfs/dbraw/zinc/63/78/74/1026637874.db2.gz AAOOPMZVCZWKPK-UHFFFAOYSA-N -1 1 344.436 4.064 20 0 EIADMM O=C(c1ncccc1[O-])N(Cc1ccccc1Cl)C1CCCC1 ZINC000427079181 1026713395 /nfs/dbraw/zinc/71/33/95/1026713395.db2.gz XUONEYBFSAAGPY-UHFFFAOYSA-N -1 1 330.815 4.026 20 0 EIADMM Cc1nc2ccc(S(=O)(=O)[N-]c3cc(C)ccc3C)cc2s1 ZINC000427137005 1026738629 /nfs/dbraw/zinc/73/86/29/1026738629.db2.gz NWFWGAZACUIWNA-UHFFFAOYSA-N -1 1 332.450 4.022 20 0 EIADMM COc1c(C)ccc([N-]S(=O)(=O)c2ccc(Cl)cc2C)c1C ZINC000511146548 1026746162 /nfs/dbraw/zinc/74/61/62/1026746162.db2.gz QMFZCYHNQDMLAS-UHFFFAOYSA-N -1 1 339.844 4.075 20 0 EIADMM CCN(C(=O)c1ncccc1[O-])C(c1ccccc1)c1ccccc1 ZINC000427179372 1026754325 /nfs/dbraw/zinc/75/43/25/1026754325.db2.gz QADPNCUUAYUTKV-UHFFFAOYSA-N -1 1 332.403 4.039 20 0 EIADMM Cc1cnc(C(=O)N(C)[C@H](C)[C@H](C)c2ccc(Cl)cc2)c([O-])c1 ZINC000427249482 1026788011 /nfs/dbraw/zinc/78/80/11/1026788011.db2.gz NCNYTKJDVVGDBC-QWHCGFSZSA-N -1 1 332.831 4.013 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2cccc(-c3ncco3)c2C)c(C)s1 ZINC000427307115 1026815286 /nfs/dbraw/zinc/81/52/86/1026815286.db2.gz FQXQDFGUEGNCDL-UHFFFAOYSA-N -1 1 348.449 4.129 20 0 EIADMM Cc1ccc(C)c(S(=O)(=O)[N-]c2cccc(-c3ncco3)c2C)c1 ZINC000427307800 1026815637 /nfs/dbraw/zinc/81/56/37/1026815637.db2.gz IUMCXTSNCFMKTD-UHFFFAOYSA-N -1 1 342.420 4.068 20 0 EIADMM Cc1ccc(-c2csc3[nH]c(-c4ccc([O-])cn4)nc(=O)c23)c(C)c1 ZINC000427444703 1026850469 /nfs/dbraw/zinc/85/04/69/1026850469.db2.gz SUMMVKSIHFZATG-UHFFFAOYSA-N -1 1 349.415 4.448 20 0 EIADMM Cc1ccc(C(=O)C2CCN(Cc3cccc([O-])c3Cl)CC2)cc1 ZINC000507648343 1026861150 /nfs/dbraw/zinc/86/11/50/1026861150.db2.gz GLLYYVUMKWBOLY-UHFFFAOYSA-N -1 1 343.854 4.449 20 0 EIADMM COc1ccccc1[C@@H]1CCN(C(=O)c2ccc3ccccc3c2[O-])C1 ZINC000152932714 1026904994 /nfs/dbraw/zinc/90/49/94/1026904994.db2.gz GAXDUFKUKMVIKD-MRXNPFEDSA-N -1 1 347.414 4.184 20 0 EIADMM COC[C@@H]([N-]c1nc(-c2ccc(C)cc2)no1)c1ccc(F)c(F)c1 ZINC000302075617 1027208175 /nfs/dbraw/zinc/20/81/75/1027208175.db2.gz WBIGORIQYCADTA-MRXNPFEDSA-N -1 1 345.349 4.123 20 0 EIADMM CC(C)N(Cc1ccco1)Cc1oc(-c2ccccc2)nc1C(=O)[O-] ZINC000520240475 1027346111 /nfs/dbraw/zinc/34/61/11/1027346111.db2.gz YEMBDVNGJPNGOR-UHFFFAOYSA-N -1 1 340.379 4.043 20 0 EIADMM [O-]c1c(-c2nc(COc3ccccc3F)no2)ccc2ccccc21 ZINC000188333895 1027389542 /nfs/dbraw/zinc/38/95/42/1027389542.db2.gz CCUPKEPKRGGBEV-UHFFFAOYSA-N -1 1 336.322 4.314 20 0 EIADMM Cc1ccc(Cl)cc1S(=O)(=O)[N-]c1cccc(-c2cnco2)c1 ZINC000511206772 1027481283 /nfs/dbraw/zinc/48/12/83/1027481283.db2.gz PVIHEHNJXVKYOD-UHFFFAOYSA-N -1 1 348.811 4.104 20 0 EIADMM CN(C)C(=O)c1cc(Nc2ccc(Cl)c(Cl)c2[O-])ccc1F ZINC001211859619 1027751382 /nfs/dbraw/zinc/75/13/82/1027751382.db2.gz FYVRVQUCALCBRY-UHFFFAOYSA-N -1 1 343.185 4.284 20 0 EIADMM O=C(Nc1ccccc1Nc1c(F)cccc1F)c1cncc([O-])c1 ZINC000550395803 1027757922 /nfs/dbraw/zinc/75/79/22/1027757922.db2.gz HNIUIRSQTZSYSF-UHFFFAOYSA-N -1 1 341.317 4.061 20 0 EIADMM CCOc1cc(C(=O)N(CC2CCC2)C(C)C)cc(Cl)c1[O-] ZINC000444528876 1027857160 /nfs/dbraw/zinc/85/71/60/1027857160.db2.gz YQDZDSOEGAGFNU-UHFFFAOYSA-N -1 1 325.836 4.095 20 0 EIADMM O=C(c1cc(F)ccc1[O-])N1C[C@H](c2ccccc2)c2ccccc21 ZINC000444509726 1027858998 /nfs/dbraw/zinc/85/89/98/1027858998.db2.gz CUOHNILADYMQGN-GOSISDBHSA-N -1 1 333.362 4.324 20 0 EIADMM CCOc1cc(-c2nc([C@H]3CC3(Cl)Cl)no2)cc(Cl)c1[O-] ZINC000896812121 1027876701 /nfs/dbraw/zinc/87/67/01/1027876701.db2.gz XNOQKNAXRIMYOX-SSDOTTSWSA-N -1 1 349.601 4.156 20 0 EIADMM Cc1ccc(F)c(-c2cc(=NC(=O)c3sccc3C3CC3)[nH][n-]2)c1 ZINC000444806979 1028069914 /nfs/dbraw/zinc/06/99/14/1028069914.db2.gz NTHXFXAAJFSZBD-UHFFFAOYSA-N -1 1 341.411 4.137 20 0 EIADMM O=C(c1ccc([O-])cc1F)N1CCC[C@H]1c1nc2ccccc2s1 ZINC000154766975 1028283108 /nfs/dbraw/zinc/28/31/08/1028283108.db2.gz KUQAEJFZFAQRBN-HNNXBMFYSA-N -1 1 342.395 4.118 20 0 EIADMM COc1cc(C(=O)N2CCC[C@@H]2c2ccccc2)cc(Cl)c1[O-] ZINC000343134524 1028339125 /nfs/dbraw/zinc/33/91/25/1028339125.db2.gz MUZVZZSFMXTBQH-OAHLLOKOSA-N -1 1 331.799 4.032 20 0 EIADMM CCOc1cc(-c2noc([C@H](C)CCCOC)n2)cc(Cl)c1[O-] ZINC000278158994 1028344244 /nfs/dbraw/zinc/34/42/44/1028344244.db2.gz VLCZJUJPDKHYFA-SNVBAGLBSA-N -1 1 340.807 4.024 20 0 EIADMM CCOc1cc(-c2noc(Cc3ccc(F)cc3)n2)cc(Cl)c1[O-] ZINC000445430467 1028529635 /nfs/dbraw/zinc/52/96/35/1028529635.db2.gz HRXACHBCMMGMAZ-UHFFFAOYSA-N -1 1 348.761 4.224 20 0 EIADMM CCOc1cc(-c2noc(-c3cccc(C)c3O)n2)cc(Cl)c1[O-] ZINC000445430164 1028530598 /nfs/dbraw/zinc/53/05/98/1028530598.db2.gz FTMZNTNGIFLBQS-UHFFFAOYSA-N -1 1 346.770 4.175 20 0 EIADMM CCOc1ccccc1CCc1nc(-c2ccc([O-])cc2Cl)no1 ZINC000445450705 1028540330 /nfs/dbraw/zinc/54/03/30/1028540330.db2.gz VJOHVJYHHLIGRN-UHFFFAOYSA-N -1 1 344.798 4.280 20 0 EIADMM COc1ccccc1[C@H](C)Cc1nc(-c2ccc([O-])cc2Cl)no1 ZINC000445450715 1028541181 /nfs/dbraw/zinc/54/11/81/1028541181.db2.gz VOLWIKMSOQBPDB-LLVKDONJSA-N -1 1 344.798 4.450 20 0 EIADMM Cc1ccc(OCc2nc(-c3ccc([O-])cc3Cl)no2)cc1C ZINC000445445999 1028577532 /nfs/dbraw/zinc/57/75/32/1028577532.db2.gz BUZAPEIZCJHVAV-UHFFFAOYSA-N -1 1 330.771 4.291 20 0 EIADMM [O-]c1ccc(-c2noc([C@@H]3CCOc4ccc(Cl)cc43)n2)c(F)c1 ZINC000445454971 1028609828 /nfs/dbraw/zinc/60/98/28/1028609828.db2.gz BQWHVWHCOWHOCC-LLVKDONJSA-N -1 1 346.745 4.149 20 0 EIADMM Cc1nc(-c2ccccc2)ncc1-c1nc(-c2ccc([O-])cc2F)no1 ZINC000445461569 1028618114 /nfs/dbraw/zinc/61/81/14/1028618114.db2.gz YEGDREUOFYDGGV-UHFFFAOYSA-N -1 1 348.337 4.014 20 0 EIADMM [O-]c1ccc(-c2noc(CCCc3ccc(F)c(F)c3)n2)c(F)c1 ZINC000445463346 1028621510 /nfs/dbraw/zinc/62/15/10/1028621510.db2.gz OJYPOVAVFMPMSK-UHFFFAOYSA-N -1 1 334.297 4.035 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cccc(C(F)(F)F)c3F)n2)cc1F ZINC000445482455 1028631270 /nfs/dbraw/zinc/63/12/70/1028631270.db2.gz PXYDWVPBPJFYLR-UHFFFAOYSA-N -1 1 342.223 4.406 20 0 EIADMM Cc1c(Br)cccc1-c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445482998 1028632635 /nfs/dbraw/zinc/63/26/35/1028632635.db2.gz SBMZAIIJTDGZCA-UHFFFAOYSA-N -1 1 349.159 4.319 20 0 EIADMM [O-]c1ccc(-c2noc(CCSc3ccc(F)cc3)n2)cc1F ZINC000445486503 1028636839 /nfs/dbraw/zinc/63/68/39/1028636839.db2.gz NOLKBRAHDMPUFN-UHFFFAOYSA-N -1 1 334.347 4.055 20 0 EIADMM COc1ccccc1C/C(C)=C/c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445476572 1028646769 /nfs/dbraw/zinc/64/67/69/1028646769.db2.gz DZLWFHLGFQGCFC-ZRDIBKRKSA-N -1 1 340.354 4.236 20 0 EIADMM COc1cc(-c2nc(-c3ccc(C(C)C)nc3)no2)cc(Cl)c1[O-] ZINC000445521019 1028683069 /nfs/dbraw/zinc/68/30/69/1028683069.db2.gz POKMLMDHZASUBD-UHFFFAOYSA-N -1 1 345.786 4.290 20 0 EIADMM COc1cc(-c2nc(-c3ccc(Cl)s3)no2)cc(Cl)c1[O-] ZINC000445562608 1028726242 /nfs/dbraw/zinc/72/62/42/1028726242.db2.gz FCHZJVCTUOLDSM-UHFFFAOYSA-N -1 1 343.191 4.486 20 0 EIADMM Cc1ccc(C)c(S(=O)(=O)[N-]c2ccccc2N2CCCCC2)c1 ZINC000016130941 1028764886 /nfs/dbraw/zinc/76/48/86/1028764886.db2.gz BRFURZSFHIYNFD-UHFFFAOYSA-N -1 1 344.480 4.095 20 0 EIADMM CC(C)c1ccccc1[N-]S(=O)(=O)c1ccc(F)c(Cl)c1 ZINC000016129178 1028786121 /nfs/dbraw/zinc/78/61/21/1028786121.db2.gz CUTGRDKWOUGKLQ-UHFFFAOYSA-N -1 1 327.808 4.403 20 0 EIADMM CC(=O)Nc1ccc([O-])c(-c2nc(-c3cc4cc(C)ccc4o3)no2)c1 ZINC000445751900 1028869540 /nfs/dbraw/zinc/86/95/40/1028869540.db2.gz UBDONZYXLYRTDR-UHFFFAOYSA-N -1 1 349.346 4.122 20 0 EIADMM CCc1ccc(CN(C)c2ccc(-c3nc(C)c(C)c(=O)[n-]3)cn2)cc1 ZINC000301183658 1029682498 /nfs/dbraw/zinc/68/24/98/1029682498.db2.gz QJEONFBTLWQHHU-UHFFFAOYSA-N -1 1 348.450 4.060 20 0 EIADMM O=C(c1cc(F)ccc1[O-])N1CC=C(c2ccc(Cl)cc2)CC1 ZINC000082972750 1029816137 /nfs/dbraw/zinc/81/61/37/1029816137.db2.gz CHZGLHBUPOXPAZ-UHFFFAOYSA-N -1 1 331.774 4.114 20 0 EIADMM C[C@@H]1C[C@@H](c2cccnc2)N(C(=O)c2ccc3ccccc3c2[O-])C1 ZINC000182821498 1029968470 /nfs/dbraw/zinc/96/84/70/1029968470.db2.gz WPWSPDJUKMBBSL-KUHUBIRLSA-N -1 1 332.403 4.164 20 0 EIADMM Cc1noc(-c2ccccc2)c1[N-]C(=O)c1cnc(C(C)C)s1 ZINC000183385845 1030004708 /nfs/dbraw/zinc/00/47/08/1030004708.db2.gz JBYBUHHLJSAEBD-UHFFFAOYSA-N -1 1 327.409 4.482 20 0 EIADMM Cc1ccc(CN(C)c2ccc(-c3nc(C)c(C)c(=O)[n-]3)cn2)cc1C ZINC000450937963 1030117108 /nfs/dbraw/zinc/11/71/08/1030117108.db2.gz YHHATKPSNVZZAN-UHFFFAOYSA-N -1 1 348.450 4.114 20 0 EIADMM Cc1cc(Cl)ccc1C1=CCN(Cc2occc2C(=O)[O-])CC1 ZINC000530172960 1030193227 /nfs/dbraw/zinc/19/32/27/1030193227.db2.gz PODULNRUSPFLSE-UHFFFAOYSA-N -1 1 331.799 4.229 20 0 EIADMM CCOc1cc(C(=O)N(C)Cc2ccc(C)s2)cc(Cl)c1[O-] ZINC000186776778 1030306671 /nfs/dbraw/zinc/30/66/71/1030306671.db2.gz IQNLENJNLSMYLM-UHFFFAOYSA-N -1 1 339.844 4.086 20 0 EIADMM Cc1c(C)c(C)c(CNC(=O)c2c(F)ccc([O-])c2F)c(C)c1C ZINC000685452088 1030328975 /nfs/dbraw/zinc/32/89/75/1030328975.db2.gz CPTFVQIRVJBRAA-UHFFFAOYSA-N -1 1 333.378 4.143 20 0 EIADMM CSCc1c2ccccc2oc1C(=O)Nc1c([O-])cccc1F ZINC000610339730 1030494484 /nfs/dbraw/zinc/49/44/84/1030494484.db2.gz IIUBNFRVDDCFJX-UHFFFAOYSA-N -1 1 331.368 4.393 20 0 EIADMM COc1cc(C(=O)N2CCCSc3ccccc32)cc(Cl)c1[O-] ZINC000527194428 1030531374 /nfs/dbraw/zinc/53/13/74/1030531374.db2.gz JDWPPMORZSCNED-UHFFFAOYSA-N -1 1 349.839 4.197 20 0 EIADMM CCC[C@H]1CCCC[C@H]1NC(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC000527487392 1030700689 /nfs/dbraw/zinc/70/06/89/1030700689.db2.gz PRCHMHPUZDNHSX-SMDDNHRTSA-N -1 1 325.836 4.143 20 0 EIADMM CC1CCC([N@@H+](C)Cc2ccc(C(=O)[O-])cc2Br)CC1 ZINC000226722324 1031103821 /nfs/dbraw/zinc/10/38/21/1031103821.db2.gz VWSNEUDTTUXJKS-UHFFFAOYSA-N -1 1 340.261 4.158 20 0 EIADMM O=C(CCc1cnc2ccccc2c1)Nc1ccc([O-])c(Cl)c1 ZINC000472399151 1031178826 /nfs/dbraw/zinc/17/88/26/1031178826.db2.gz VLZLZFDKOOKWHF-UHFFFAOYSA-N -1 1 326.783 4.165 20 0 EIADMM COc1ccc(-c2nc(-c3ccccc3OC3CCC3)no2)c([O-])c1 ZINC000528256144 1031303164 /nfs/dbraw/zinc/30/31/64/1031303164.db2.gz ALDZKHKTRLDFMJ-UHFFFAOYSA-N -1 1 338.363 4.049 20 0 EIADMM CC1(C)CN(Cc2ccc(C(=O)[O-])c(Cl)c2)CC[C@H]1C(F)(F)F ZINC000584475575 1031436740 /nfs/dbraw/zinc/43/67/40/1031436740.db2.gz PHHRHMIOZCSOLJ-CYBMUJFWSA-N -1 1 349.780 4.449 20 0 EIADMM O=c1nc(-c2ccccc2)[n-]c2cc(-c3ccc4c(c3)OCO4)sc21 ZINC000614112269 1033393174 /nfs/dbraw/zinc/39/31/74/1033393174.db2.gz GCJCJKZLBQJBEH-UHFFFAOYSA-N -1 1 348.383 4.047 20 0 EIADMM CCOc1cc(C(=O)N(C)C2CCC(C)(C)CC2)cc(Cl)c1[O-] ZINC000545856928 1035272915 /nfs/dbraw/zinc/27/29/15/1035272915.db2.gz VMVPSIYRJMLNGC-UHFFFAOYSA-N -1 1 339.863 4.485 20 0 EIADMM O=C(Nc1cccc(NC2CCCC2)c1)c1c(F)ccc([O-])c1F ZINC000280682125 1035323697 /nfs/dbraw/zinc/32/36/97/1035323697.db2.gz CKVUQCCGKLEIIT-UHFFFAOYSA-N -1 1 332.350 4.277 20 0 EIADMM O=C1[N-]C(=O)C(=Cc2cccc(OCc3ccccc3Cl)c2)S1 ZINC000059419084 1035568316 /nfs/dbraw/zinc/56/83/16/1035568316.db2.gz BMJDTBQJOVAREV-OQLLNIDSSA-N -1 1 345.807 4.243 20 0 EIADMM Cc1cc([N-]S(=O)(=O)c2ccc(Cl)c(Cl)c2)ccc1F ZINC000485048742 1035652122 /nfs/dbraw/zinc/65/21/22/1035652122.db2.gz JQKOHPSWFBJUJG-UHFFFAOYSA-N -1 1 334.199 4.242 20 0 EIADMM C[C@H](CN1CCOc2c(cccc2C(=O)[O-])C1)c1cccc(Cl)c1 ZINC000905737233 1035878771 /nfs/dbraw/zinc/87/87/71/1035878771.db2.gz DCBPBEWAMFBBOT-CYBMUJFWSA-N -1 1 345.826 4.036 20 0 EIADMM Cc1cccc(C2=CCN(Cc3ccc(/C=C/C(=O)[O-])o3)CC2)c1C ZINC000905820144 1035921100 /nfs/dbraw/zinc/92/11/00/1035921100.db2.gz PBBFMYYFHXQJCM-CMDGGOBGSA-N -1 1 337.419 4.284 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2ccc(C(F)F)cc2)cc1Cl ZINC000571082748 1035932734 /nfs/dbraw/zinc/93/27/34/1035932734.db2.gz UZSSJGGKEYPKAQ-UHFFFAOYSA-N -1 1 331.771 4.387 20 0 EIADMM CC(C)(C)c1cc(C(=O)[N-]c2nnc(CC3CCCCC3)s2)no1 ZINC000460170960 1036496831 /nfs/dbraw/zinc/49/68/31/1036496831.db2.gz WFVUZISOFURLNW-UHFFFAOYSA-N -1 1 348.472 4.199 20 0 EIADMM CCCCC[C@H]1CCCN1c1ccc(-c2nc(C)c(C)c(=O)[n-]2)cn1 ZINC000486893671 1036882430 /nfs/dbraw/zinc/88/24/30/1036882430.db2.gz BSXXGUQPAIVJBY-KRWDZBQOSA-N -1 1 340.471 4.410 20 0 EIADMM O=C([O-])C[C@H](NCc1c(Cl)cccc1Cl)c1cccs1 ZINC000037088040 1036998640 /nfs/dbraw/zinc/99/86/40/1036998640.db2.gz NMBJBIAPEXXKHL-LBPRGKRZSA-N -1 1 330.236 4.361 20 0 EIADMM [O-]c1cccc(CN2C[C@H](C(F)(F)F)[C@@H](C(F)(F)F)C2)c1Cl ZINC000646099176 1037093969 /nfs/dbraw/zinc/09/39/69/1037093969.db2.gz JWVGTDOMEOXDLC-IUCAKERBSA-N -1 1 347.686 4.218 20 0 EIADMM O=C(Nc1cc([O-])c(F)cc1F)[C@@H](OC1CCCC1)c1ccccc1 ZINC000909975491 1037217001 /nfs/dbraw/zinc/21/70/01/1037217001.db2.gz ABIYSADPDXANMU-SFHVURJKSA-N -1 1 347.361 4.309 20 0 EIADMM O=C(Nc1cc([O-])c(F)cc1F)[C@H](c1cccnc1)C1CCCCC1 ZINC000909988299 1037255246 /nfs/dbraw/zinc/25/52/46/1037255246.db2.gz FCQPWPWNOQDQAX-SFHVURJKSA-N -1 1 346.377 4.368 20 0 EIADMM CCCCSc1nnc(SCC(=O)c2ccc([O-])cc2)s1 ZINC000591643464 1037537281 /nfs/dbraw/zinc/53/72/81/1037537281.db2.gz FNFCSERFACZSKU-UHFFFAOYSA-N -1 1 340.495 4.111 20 0 EIADMM Cc1ccc(C(C)C)cc1O[C@@H](C)C(=O)Nc1c([O-])cccc1F ZINC000605439129 1037786142 /nfs/dbraw/zinc/78/61/42/1037786142.db2.gz VCYMVCYWEGSWIN-ZDUSSCGKSA-N -1 1 331.387 4.369 20 0 EIADMM COc1cc(C(=O)Nc2c([O-])cccc2F)ccc1OC1CCCC1 ZINC000605440280 1037787088 /nfs/dbraw/zinc/78/70/88/1037787088.db2.gz NRNUSQYLRCSISX-UHFFFAOYSA-N -1 1 345.370 4.114 20 0 EIADMM O=C(Nc1c([O-])cccc1F)c1ccc(COc2ccc(F)cc2)o1 ZINC000605439431 1037787461 /nfs/dbraw/zinc/78/74/61/1037787461.db2.gz WQGYGANZQKAEML-UHFFFAOYSA-N -1 1 345.301 4.095 20 0 EIADMM Cc1nc(-c2cccs2)sc1C(=O)Nc1c([O-])cccc1F ZINC000605435609 1037787881 /nfs/dbraw/zinc/78/78/81/1037787881.db2.gz HWAARBVCYABUFG-UHFFFAOYSA-N -1 1 334.397 4.277 20 0 EIADMM CC(=O)Nc1cc(-c2nc(-c3ccc([O-])cc3Cl)no2)ccc1C ZINC000570391549 1037895370 /nfs/dbraw/zinc/89/53/70/1037895370.db2.gz DYVGMCULJKEPNI-UHFFFAOYSA-N -1 1 343.770 4.029 20 0 EIADMM COc1cccc(CN[C@@H](CC(=O)[O-])c2ccc(C(C)C)cc2)c1F ZINC000669471849 1037923247 /nfs/dbraw/zinc/92/32/47/1037923247.db2.gz VNIDGSHXJXLYGN-KRWDZBQOSA-N -1 1 345.414 4.263 20 0 EIADMM C[C@@H](c1ccc(C(=O)[O-])o1)N1CCC[C@H](Oc2ccccc2Cl)C1 ZINC000574406462 1038211595 /nfs/dbraw/zinc/21/15/95/1038211595.db2.gz QDJVNGSYUHWHOT-STQMWFEESA-N -1 1 349.814 4.236 20 0 EIADMM C[C@H](c1ccc(C(=O)[O-])o1)N1CCC[C@@H](Oc2ccccc2Cl)C1 ZINC000574406457 1038212034 /nfs/dbraw/zinc/21/20/34/1038212034.db2.gz QDJVNGSYUHWHOT-CHWSQXEVSA-N -1 1 349.814 4.236 20 0 EIADMM Cc1ccc(F)cc1S(=O)(=O)[N-]c1ccc(OC(C)C)c(C)c1 ZINC000607616822 1038240245 /nfs/dbraw/zinc/24/02/45/1038240245.db2.gz SIVZOYPZSJMKRB-UHFFFAOYSA-N -1 1 337.416 4.031 20 0 EIADMM CC(C)Oc1ccc(S(=O)(=O)[N-]c2ccccc2C(F)F)cc1 ZINC000424082290 1038486053 /nfs/dbraw/zinc/48/60/53/1038486053.db2.gz LIMKJWXQIHKJBG-UHFFFAOYSA-N -1 1 341.379 4.212 20 0 EIADMM Cc1nc(CCC(=O)Nc2c([O-])cccc2F)oc1-c1ccccc1 ZINC000608367150 1038804318 /nfs/dbraw/zinc/80/43/18/1038804318.db2.gz KDHFHLWJHFHPIV-UHFFFAOYSA-N -1 1 340.354 4.066 20 0 EIADMM CCc1ccc(-c2ccc(CN3CCC[C@H](C)[C@@H]3C(=O)[O-])o2)cc1 ZINC000424424457 1038843948 /nfs/dbraw/zinc/84/39/48/1038843948.db2.gz WSLQPEGQGYYONA-IFXJQAMLSA-N -1 1 327.424 4.194 20 0 EIADMM COc1cccc(C2(C(=O)Nc3ccc([O-])c(F)c3F)CCCC2)c1 ZINC000456793449 1039612438 /nfs/dbraw/zinc/61/24/38/1039612438.db2.gz MCEKBVGVCWBCGM-UHFFFAOYSA-N -1 1 347.361 4.130 20 0 EIADMM Cc1cccc(C2(C(=O)Nc3ccc([O-])c(F)c3F)CCCC2)c1 ZINC000456793568 1039612820 /nfs/dbraw/zinc/61/28/20/1039612820.db2.gz NLRWASRSIGXIMK-UHFFFAOYSA-N -1 1 331.362 4.429 20 0 EIADMM O=C(c1cc(F)ccc1[O-])N1CCC[C@@H]1c1nc2ccccc2s1 ZINC000093908804 1039771438 /nfs/dbraw/zinc/77/14/38/1039771438.db2.gz WMLNDJQFUDWCBW-CQSZACIVSA-N -1 1 342.395 4.118 20 0 EIADMM Cc1cc(C)c([N-]S(=O)(=O)c2ccc3ncsc3c2)c(C)c1 ZINC000479134017 1040140853 /nfs/dbraw/zinc/14/08/53/1040140853.db2.gz NCVZGHQFWCDCRN-UHFFFAOYSA-N -1 1 332.450 4.022 20 0 EIADMM CC(C)(C)c1ccc(C(=O)Nc2ccc(-c3cc(=O)[nH][n-]3)cc2)s1 ZINC000479336800 1040288087 /nfs/dbraw/zinc/28/80/87/1040288087.db2.gz QAGYUAWPNYCNMN-UHFFFAOYSA-N -1 1 341.436 4.394 20 0 EIADMM Cc1cc(Br)c([O-])c(NC(=O)c2ccc(Cl)s2)c1 ZINC000482571342 1040362450 /nfs/dbraw/zinc/36/24/50/1040362450.db2.gz AYDUXNMFCCPGTM-UHFFFAOYSA-N -1 1 346.633 4.430 20 0 EIADMM O=C(c1c(F)ccc([O-])c1F)N1CC2(CCCC2)c2ccccc21 ZINC000539489886 1040476173 /nfs/dbraw/zinc/47/61/73/1040476173.db2.gz LGKPPGGGFPFHHD-UHFFFAOYSA-N -1 1 329.346 4.143 20 0 EIADMM O=C(Nc1ccc(F)cc1[O-])c1coc(-c2ccccc2Cl)n1 ZINC000539531658 1040525151 /nfs/dbraw/zinc/52/51/51/1040525151.db2.gz WLTRQBIIMYIVPN-UHFFFAOYSA-N -1 1 332.718 4.092 20 0 EIADMM Cc1nc(SCc2ncc(-c3cccc(Cl)c3)o2)[n-]c(=O)c1C ZINC000539617391 1040614414 /nfs/dbraw/zinc/61/44/14/1040614414.db2.gz XWYPKAYOAKXKKL-UHFFFAOYSA-N -1 1 347.827 4.400 20 0 EIADMM Cc1c(F)cccc1S(=O)(=O)[N-]c1cccc(C(C)(F)F)c1 ZINC000436153374 1040926167 /nfs/dbraw/zinc/92/61/67/1040926167.db2.gz LFKBOSAVBOMIFJ-UHFFFAOYSA-N -1 1 329.343 4.047 20 0 EIADMM CCOc1cccc([N-]S(=O)(=O)c2ccc(Cl)c(Cl)c2)c1 ZINC000515649164 1040946650 /nfs/dbraw/zinc/94/66/50/1040946650.db2.gz QEENJMCJCXRMQS-UHFFFAOYSA-N -1 1 346.235 4.193 20 0 EIADMM Cc1cc2cc[nH]c2cc1[N-]S(=O)(=O)c1ccc(OC(C)C)cc1 ZINC000436179745 1040947067 /nfs/dbraw/zinc/94/70/67/1040947067.db2.gz XPZICUAAWQIACI-UHFFFAOYSA-N -1 1 344.436 4.064 20 0 EIADMM CCOc1cccc([N-]S(=O)(=O)c2ccc(C(C)(C)C)cc2)c1 ZINC000515652190 1040954087 /nfs/dbraw/zinc/95/40/87/1040954087.db2.gz AMUZNCJHSCUBDY-UHFFFAOYSA-N -1 1 333.453 4.184 20 0 EIADMM CCc1cc(=O)[n-]c(SCc2c(Cl)ccc3cccnc32)n1 ZINC000436240320 1040988353 /nfs/dbraw/zinc/98/83/53/1040988353.db2.gz AMMZCAHZVWMKNY-UHFFFAOYSA-N -1 1 331.828 4.239 20 0 EIADMM COc1cccc(C2CCN(C(=O)c3ccc(Cl)cc3[O-])CC2)c1 ZINC000194702076 1041039037 /nfs/dbraw/zinc/03/90/37/1041039037.db2.gz XMJLWDQXHMZMMY-UHFFFAOYSA-N -1 1 345.826 4.074 20 0 EIADMM Cc1cccc(S(=O)(=O)[N-]c2ccc(Cl)cc2F)c1Cl ZINC000538307418 1041243105 /nfs/dbraw/zinc/24/31/05/1041243105.db2.gz VCGYXGKOKOSDOH-UHFFFAOYSA-N -1 1 334.199 4.242 20 0 EIADMM CCC[C@H](C)C[C@@H](NCc1ccc(-c2ccc(F)cc2)o1)C(=O)[O-] ZINC000904002851 1041248650 /nfs/dbraw/zinc/24/86/50/1041248650.db2.gz FTHLBEWLNBALKR-SUMWQHHRSA-N -1 1 333.403 4.455 20 0 EIADMM Cc1cc(CN[C@@H](CC(=O)[O-])c2cc(Cl)cc(Cl)c2)sn1 ZINC000904004563 1041266646 /nfs/dbraw/zinc/26/66/46/1041266646.db2.gz MWDJPPZOLFYGBV-ZDUSSCGKSA-N -1 1 345.251 4.064 20 0 EIADMM CN(Cc1cccc(C(F)(F)F)c1)C(=O)c1ccc(Cl)cc1[O-] ZINC000436493428 1041279888 /nfs/dbraw/zinc/27/98/88/1041279888.db2.gz ULLOTJRXPTWKLT-UHFFFAOYSA-N -1 1 343.732 4.337 20 0 EIADMM COc1ccc(-c2nc(-c3ccc([O-])cc3Cl)no2)cc1Cl ZINC000436520740 1041302385 /nfs/dbraw/zinc/30/23/85/1041302385.db2.gz IXOPTIMIRIZOSG-UHFFFAOYSA-N -1 1 337.162 4.425 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1CC[C@H](Cc2ccc(F)cc2)C1 ZINC000436528440 1041312082 /nfs/dbraw/zinc/31/20/82/1041312082.db2.gz LPQZQAPCGALMNX-MRXNPFEDSA-N -1 1 349.405 4.389 20 0 EIADMM CCC(CC)N(CC(C)C)C(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC000436536488 1041320340 /nfs/dbraw/zinc/32/03/40/1041320340.db2.gz VTNVISGCHVKRQH-UHFFFAOYSA-N -1 1 327.852 4.341 20 0 EIADMM COCCCOc1ccccc1NC(=O)c1ccc(C(C)C)cc1[O-] ZINC000436547980 1041323272 /nfs/dbraw/zinc/32/32/72/1041323272.db2.gz KYQHZAPAYBJWIM-UHFFFAOYSA-N -1 1 343.423 4.183 20 0 EIADMM C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1ccc2ccccc2c1[O-] ZINC000436548281 1041326589 /nfs/dbraw/zinc/32/65/89/1041326589.db2.gz QFFKADNVULYHJK-NHYWBVRUSA-N -1 1 337.341 4.348 20 0 EIADMM CCCN(C(=O)c1cc(F)ccc1[O-])[C@@H](C)c1ccccc1OC ZINC000436539173 1041333665 /nfs/dbraw/zinc/33/36/65/1041333665.db2.gz KHAMSKJAPNXDOK-ZDUSSCGKSA-N -1 1 331.387 4.153 20 0 EIADMM C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1cc2ccccc2cc1[O-] ZINC000436545144 1041338039 /nfs/dbraw/zinc/33/80/39/1041338039.db2.gz MQXOOWKGMWMRJK-IAQYHMDHSA-N -1 1 337.341 4.348 20 0 EIADMM CCOc1cc(-c2nc([C@@H](OCC)C(C)C)no2)cc(Cl)c1[O-] ZINC000904121190 1041339510 /nfs/dbraw/zinc/33/95/10/1041339510.db2.gz JRLIKIREGZKTJT-AWEZNQCLSA-N -1 1 340.807 4.228 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N1C[C@H](c2ccccc2)[C@@H]2CCC[C@@H]21 ZINC000436557198 1041340697 /nfs/dbraw/zinc/34/06/97/1041340697.db2.gz SWXMUMGFGCRSBT-JQHSSLGASA-N -1 1 341.838 4.454 20 0 EIADMM O=C(Nc1nc2c(s1)CSCC2)c1ccc2ccccc2c1[O-] ZINC000436562427 1041344464 /nfs/dbraw/zinc/34/44/64/1041344464.db2.gz FNBGKFRNHBNFCN-UHFFFAOYSA-N -1 1 342.445 4.044 20 0 EIADMM Cc1c[nH]c(-c2ccccc2NC(=O)c2cc3ccccc3cc2[O-])n1 ZINC000436597344 1041354164 /nfs/dbraw/zinc/35/41/64/1041354164.db2.gz UYOWNXDBLHHGDT-UHFFFAOYSA-N -1 1 343.386 4.496 20 0 EIADMM COc1c(F)cc(F)cc1NC(=O)c1cc2ccccc2cc1[O-] ZINC000436583606 1041361279 /nfs/dbraw/zinc/36/12/79/1041361279.db2.gz DTXVRIMNTSFWPN-UHFFFAOYSA-N -1 1 329.302 4.085 20 0 EIADMM O=C(Nc1cccc(Cl)c1O)c1c([O-])cc(Cl)cc1Cl ZINC000436603046 1041368157 /nfs/dbraw/zinc/36/81/57/1041368157.db2.gz KZUMUJAHNXKJGA-UHFFFAOYSA-N -1 1 332.570 4.310 20 0 EIADMM Cc1cc(C)cc(C2=CCN(C(=O)c3cc(F)ccc3[O-])CC2)c1 ZINC000436617510 1041375929 /nfs/dbraw/zinc/37/59/29/1041375929.db2.gz NSBDCGYOYGBHKS-UHFFFAOYSA-N -1 1 325.383 4.078 20 0 EIADMM Cc1cc(C(=O)Nc2ccc([O-])c(Cl)c2)nn1C1CCCCC1 ZINC000436631203 1041381663 /nfs/dbraw/zinc/38/16/63/1041381663.db2.gz SOVOXJNLYCDWDJ-UHFFFAOYSA-N -1 1 333.819 4.308 20 0 EIADMM Cc1nc(C(F)(F)F)sc1-c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000436661520 1041415748 /nfs/dbraw/zinc/41/57/48/1041415748.db2.gz YFJIXOYEQGUANI-UHFFFAOYSA-N -1 1 345.277 4.032 20 0 EIADMM Cc1ccc(Cc2ccccn2)cc1NC(=O)c1ccc([O-])cc1F ZINC000436683938 1041419277 /nfs/dbraw/zinc/41/92/77/1041419277.db2.gz WVGIXXXXCSOBMC-UHFFFAOYSA-N -1 1 336.366 4.078 20 0 EIADMM COc1ccc([C@H]2CCCN2C(=O)c2ccc(Cl)cc2[O-])cc1 ZINC000436724193 1041435262 /nfs/dbraw/zinc/43/52/62/1041435262.db2.gz QSAVHSRGHROBFP-MRXNPFEDSA-N -1 1 331.799 4.032 20 0 EIADMM CN(CC[C@H](C(=O)[O-])c1ccccc1)Cc1c(F)cccc1Cl ZINC000516187931 1041453891 /nfs/dbraw/zinc/45/38/91/1041453891.db2.gz NQOMZMOVVHRLJN-AWEZNQCLSA-N -1 1 335.806 4.169 20 0 EIADMM O=C(Nc1ccc(Cl)cc1OCC(F)F)c1ccc([O-])cc1F ZINC000436748763 1041461762 /nfs/dbraw/zinc/46/17/62/1041461762.db2.gz QOOMHZXTZUMMHO-UHFFFAOYSA-N -1 1 345.704 4.081 20 0 EIADMM CCS[C@H]1CC[C@H](N(C)C(=O)c2ccc(C(F)(F)F)cc2[O-])C1 ZINC000436752313 1041465236 /nfs/dbraw/zinc/46/52/36/1041465236.db2.gz QYKDWZSSOMKVAK-RYUDHWBXSA-N -1 1 347.402 4.157 20 0 EIADMM Cc1cccc(OCCN(C)C(=O)c2ccc3ccccc3c2[O-])c1 ZINC000436783499 1041480435 /nfs/dbraw/zinc/48/04/35/1041480435.db2.gz HCQOTVABYANEKT-UHFFFAOYSA-N -1 1 335.403 4.005 20 0 EIADMM CO[C@@H]1CCOc2c(NC(=O)c3cc4ccccc4cc3[O-])cccc21 ZINC000436812295 1041493086 /nfs/dbraw/zinc/49/30/86/1041493086.db2.gz LMZXIPCQIKZBNW-LJQANCHMSA-N -1 1 349.386 4.268 20 0 EIADMM O=C(c1cc(F)ccc1[O-])N1CCC(=Cc2ccc(F)c(F)c2)CC1 ZINC000436824200 1041500224 /nfs/dbraw/zinc/50/02/24/1041500224.db2.gz FXGYXHSRRRNHLK-UHFFFAOYSA-N -1 1 347.336 4.129 20 0 EIADMM O=C(NCc1cccc(Oc2ccccc2)c1)c1ccc([O-])cc1F ZINC000436860203 1041520011 /nfs/dbraw/zinc/52/00/11/1041520011.db2.gz FOTGLYZJFSSHSC-UHFFFAOYSA-N -1 1 337.350 4.254 20 0 EIADMM CC(=O)c1cc(NC(=O)c2ccc(C(F)(F)F)cc2[O-])ccc1F ZINC000436859923 1041521045 /nfs/dbraw/zinc/52/10/45/1041521045.db2.gz ZMOIOAQETHDVOJ-UHFFFAOYSA-N -1 1 341.260 4.005 20 0 EIADMM Cc1ccc2c(c1)CC[C@@H](c1nc(-c3ccc([O-])cc3Cl)no1)O2 ZINC000436869879 1041527468 /nfs/dbraw/zinc/52/74/68/1041527468.db2.gz FPAWCMUICXLQHI-INIZCTEOSA-N -1 1 342.782 4.470 20 0 EIADMM [O-]c1ccc(-c2noc(-c3ncsc3C(F)(F)F)n2)c(Cl)c1 ZINC000436869937 1041528659 /nfs/dbraw/zinc/52/86/59/1041528659.db2.gz FWBZEFNKJCXREX-UHFFFAOYSA-N -1 1 347.705 4.238 20 0 EIADMM CCOc1cc(-c2noc(-c3occ4c3CCC4)n2)cc(Cl)c1[O-] ZINC000436870608 1041530036 /nfs/dbraw/zinc/53/00/36/1041530036.db2.gz QMMYFZFYEXDQJA-UHFFFAOYSA-N -1 1 346.770 4.243 20 0 EIADMM CC(C)(COCc1ccccc1)c1nc(-c2ccc([O-])cc2F)no1 ZINC000436876490 1041535645 /nfs/dbraw/zinc/53/56/45/1041535645.db2.gz ZNXDATSTPARWIC-UHFFFAOYSA-N -1 1 342.370 4.076 20 0 EIADMM [O-]c1ccc(-c2noc(-c3ccc(C(F)(F)F)c(F)c3)n2)cc1F ZINC000436876703 1041535807 /nfs/dbraw/zinc/53/58/07/1041535807.db2.gz AUFUTMFNQMEVNL-UHFFFAOYSA-N -1 1 342.223 4.406 20 0 EIADMM CCOc1cc(-c2noc([C@@H](OC)[C@H](C)CC)n2)cc(Cl)c1[O-] ZINC000436876379 1041536128 /nfs/dbraw/zinc/53/61/28/1041536128.db2.gz IDMOKTMYNOVNBZ-OTYXRUKQSA-N -1 1 340.807 4.228 20 0 EIADMM CCOc1cc(-c2noc(C3(F)CCCC3)n2)cc(Cl)c1[O-] ZINC000436876744 1041536196 /nfs/dbraw/zinc/53/61/96/1041536196.db2.gz KBFYMYYPBSMUHE-UHFFFAOYSA-N -1 1 326.755 4.233 20 0 EIADMM [O-]c1ccc(-c2noc(C3CCC(C(F)(F)F)CC3)n2)cc1F ZINC000436876476 1041536533 /nfs/dbraw/zinc/53/65/33/1041536533.db2.gz ZHUORCOAHNJDNT-UHFFFAOYSA-N -1 1 330.281 4.417 20 0 EIADMM CC1(C)CN(C(=O)c2ccc3ccccc3c2[O-])[C@@H]1c1ccncc1 ZINC000436878404 1041537185 /nfs/dbraw/zinc/53/71/85/1041537185.db2.gz CKQUFMJAQDPOKH-LJQANCHMSA-N -1 1 332.403 4.164 20 0 EIADMM C[C@H](CNC(=O)c1ccc([O-])cc1F)c1c(Cl)cccc1Cl ZINC000436881080 1041537243 /nfs/dbraw/zinc/53/72/43/1041537243.db2.gz QUDUBMWRCFJFKA-SECBINFHSA-N -1 1 342.197 4.372 20 0 EIADMM [O-]c1ccc(-c2noc(-c3ncccc3Oc3ccccc3)n2)cc1F ZINC000436880169 1041537378 /nfs/dbraw/zinc/53/73/78/1041537378.db2.gz PQGGVMRLDKWBTG-UHFFFAOYSA-N -1 1 349.321 4.436 20 0 EIADMM CCNc1ccc(Cl)cc1-c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000436881980 1041538719 /nfs/dbraw/zinc/53/87/19/1041538719.db2.gz ZLFSNOVXMXGCBF-UHFFFAOYSA-N -1 1 333.750 4.334 20 0 EIADMM CC(=O)Nc1ccc([O-])c(-c2nc(C3CCC(C)(C)CC3)no2)c1 ZINC000436883504 1041541051 /nfs/dbraw/zinc/54/10/51/1041541051.db2.gz AIZFCJXLBJERJH-UHFFFAOYSA-N -1 1 329.400 4.084 20 0 EIADMM Cc1csc(C(=O)N=c2cc(-c3cc(C)ccc3F)[n-][nH]2)c1Cl ZINC000484937104 1041542471 /nfs/dbraw/zinc/54/24/71/1041542471.db2.gz OSOWHEKPNXEEAI-UHFFFAOYSA-N -1 1 349.818 4.222 20 0 EIADMM COc1ccc(-c2nc(COc3ccc4ccccc4c3)no2)c([O-])c1 ZINC000436912308 1041549705 /nfs/dbraw/zinc/54/97/05/1041549705.db2.gz SJUSVNNIIIQQHA-UHFFFAOYSA-N -1 1 348.358 4.183 20 0 EIADMM CCc1nc(Cc2noc(-c3ccc4ccccc4c3[O-])n2)cs1 ZINC000436918997 1041557814 /nfs/dbraw/zinc/55/78/14/1041557814.db2.gz JWOKDCYOCIVDBQ-UHFFFAOYSA-N -1 1 337.404 4.205 20 0 EIADMM O=C(c1cc(F)ccc1[O-])N1CC2(CCCC2)c2cccc(F)c21 ZINC000436950300 1041563207 /nfs/dbraw/zinc/56/32/07/1041563207.db2.gz BTKNIELGMAIWPC-UHFFFAOYSA-N -1 1 329.346 4.143 20 0 EIADMM CC[C@@H](C)Oc1ccc(-c2noc(-c3ccc(OC)cc3[O-])n2)cc1 ZINC000436938528 1041567156 /nfs/dbraw/zinc/56/71/56/1041567156.db2.gz JCVNYUQJVBBDDM-GFCCVEGCSA-N -1 1 340.379 4.295 20 0 EIADMM C[C@H](NC(=O)c1ccc2ccccc2c1[O-])c1ccc(Cl)cn1 ZINC000436981213 1041580269 /nfs/dbraw/zinc/58/02/69/1041580269.db2.gz QBEJWJBBMRJTDO-NSHDSACASA-N -1 1 326.783 4.085 20 0 EIADMM COc1cccc2c1CCCN2C(=O)c1cc2ccccc2cc1[O-] ZINC000436988121 1041584023 /nfs/dbraw/zinc/58/40/23/1041584023.db2.gz JWWGJYZNUCBQHN-UHFFFAOYSA-N -1 1 333.387 4.147 20 0 EIADMM CSc1ccc(S(=O)(=O)[N-]c2c(C)cccc2C)cc1Cl ZINC000463510450 1041598813 /nfs/dbraw/zinc/59/88/13/1041598813.db2.gz BUELSWIGYZPPSA-UHFFFAOYSA-N -1 1 341.885 4.480 20 0 EIADMM Cc1ccc(-c2cnc(CSc3nc(C)c(C)c(=O)[n-]3)o2)cc1 ZINC000540713998 1041622473 /nfs/dbraw/zinc/62/24/73/1041622473.db2.gz ADKJNFXQMHLKTF-UHFFFAOYSA-N -1 1 327.409 4.055 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2cc(C)c(C)c3ncccc23)cc1F ZINC000437300535 1041743747 /nfs/dbraw/zinc/74/37/47/1041743747.db2.gz DGESBUYJNYLWQW-UHFFFAOYSA-N -1 1 344.411 4.100 20 0 EIADMM Cc1c(C(=O)Nc2ccc([O-])c(Cl)c2)cnn1-c1cccc(C)c1 ZINC000540959146 1041753179 /nfs/dbraw/zinc/75/31/79/1041753179.db2.gz MLWJMOVOAIAPJS-UHFFFAOYSA-N -1 1 341.798 4.100 20 0 EIADMM CCOc1c(Cl)cc([N-]S(=O)(=O)c2ccccc2)cc1Cl ZINC000464542517 1042061611 /nfs/dbraw/zinc/06/16/11/1042061611.db2.gz IFDAYKARNRAKQN-UHFFFAOYSA-N -1 1 346.235 4.193 20 0 EIADMM Cc1cc([N-]S(=O)(=O)c2cccc(F)c2C)ccc1OC(C)C ZINC000438781106 1042345533 /nfs/dbraw/zinc/34/55/33/1042345533.db2.gz UIYXJXHXBCFMFN-UHFFFAOYSA-N -1 1 337.416 4.031 20 0 EIADMM CC(C)C(=O)c1ccc(S(=O)(=O)[N-]c2cccc(C(C)C)c2)cc1 ZINC000438797004 1042352951 /nfs/dbraw/zinc/35/29/51/1042352951.db2.gz SIVZOPCSFCFJOO-UHFFFAOYSA-N -1 1 345.464 4.450 20 0 EIADMM CC[C@H](C)Oc1cccc([N-]S(=O)(=O)c2cccc(F)c2C)c1 ZINC000438809007 1042358412 /nfs/dbraw/zinc/35/84/12/1042358412.db2.gz HAQWARHYWFKCPI-LBPRGKRZSA-N -1 1 337.416 4.112 20 0 EIADMM Cc1cc(Cl)ccc1S(=O)(=O)[N-]c1ccc2scnc2c1 ZINC000509588177 1042394308 /nfs/dbraw/zinc/39/43/08/1042394308.db2.gz UVDVTHHBIYKVJA-UHFFFAOYSA-N -1 1 338.841 4.059 20 0 EIADMM COc1cc(C(=O)N(c2ccccc2)C2CCC2)cc(Cl)c1[O-] ZINC000913672801 1042468707 /nfs/dbraw/zinc/46/87/07/1042468707.db2.gz DSOGYIAXZULSLM-UHFFFAOYSA-N -1 1 331.799 4.254 20 0 EIADMM O=C(N[C@H](c1cccs1)c1ccc(Cl)cc1)c1cncc([O-])c1 ZINC000518346674 1042477324 /nfs/dbraw/zinc/47/73/24/1042477324.db2.gz SRQUCRVOFNNTMD-INIZCTEOSA-N -1 1 344.823 4.022 20 0 EIADMM COc1ccc(C(=O)Nc2sc(C)nc2-c2ccccc2)c([O-])c1 ZINC000439060515 1042477768 /nfs/dbraw/zinc/47/77/68/1042477768.db2.gz PXBZTXVDIXZNMZ-UHFFFAOYSA-N -1 1 340.404 4.085 20 0 EIADMM Cc1ccc(-c2cncc(F)c2)cc1NC(=O)c1ccc([O-])c(F)c1 ZINC000669937790 1042488842 /nfs/dbraw/zinc/48/88/42/1042488842.db2.gz SVRJGMXUNWLLKT-UHFFFAOYSA-N -1 1 340.329 4.293 20 0 EIADMM Cc1ccc(F)cc1S(=O)(=O)[N-]c1ccccc1CC(F)(F)F ZINC000172901383 1042511709 /nfs/dbraw/zinc/51/17/09/1042511709.db2.gz CCHVOLMTKLFTSZ-UHFFFAOYSA-N -1 1 347.333 4.040 20 0 EIADMM C[C@@H]1C[C@@H](c2ccc(F)cc2)CN1C(=O)c1cc(Cl)ccc1[O-] ZINC000303893846 1042526387 /nfs/dbraw/zinc/52/63/87/1042526387.db2.gz SBXDBSALTBGJAI-DGCLKSJQSA-N -1 1 333.790 4.203 20 0 EIADMM CCN(CCC(F)(F)F)C(=O)c1c([O-])cnc2ccc(Cl)cc21 ZINC000669948360 1042611865 /nfs/dbraw/zinc/61/18/65/1042611865.db2.gz TUROFSDMKMRUKE-UHFFFAOYSA-N -1 1 346.736 4.008 20 0 EIADMM CCc1nc(SCc2ccccc2C(F)(F)F)[n-]c(=O)c1C ZINC000578523984 1042708730 /nfs/dbraw/zinc/70/87/30/1042708730.db2.gz XSXQFEMNNISLMI-UHFFFAOYSA-N -1 1 328.359 4.364 20 0 EIADMM COc1cc(C(=O)Nc2ccc(C)c(OC(C)C)c2)cc(Cl)c1[O-] ZINC000427621602 1043008524 /nfs/dbraw/zinc/00/85/24/1043008524.db2.gz NZDAYCJEPKHGMN-UHFFFAOYSA-N -1 1 349.814 4.402 20 0 EIADMM C[C@@H](Cc1nc2ccccc2s1)NC(=O)c1c([O-])cccc1Cl ZINC000729526620 1043092990 /nfs/dbraw/zinc/09/29/90/1043092990.db2.gz AHVJXEIRFJLKOI-JTQLQIEISA-N -1 1 346.839 4.016 20 0 EIADMM Cc1c(=O)[n-]c(SCc2cccc(F)c2)nc1-c1ccccc1 ZINC000185057217 1043153929 /nfs/dbraw/zinc/15/39/29/1043153929.db2.gz IXJPPYBVXGYNQE-UHFFFAOYSA-N -1 1 326.396 4.177 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1c2c(nc3ccccc31)CCC2 ZINC000509184945 1043234735 /nfs/dbraw/zinc/23/47/35/1043234735.db2.gz NLVFYUPYSBCVDT-UHFFFAOYSA-N -1 1 338.794 4.335 20 0 EIADMM O=C(Nc1ccc2c(c1)C(=O)CCC2)c1cc([O-])c2ccccc2c1 ZINC000526927820 1043245493 /nfs/dbraw/zinc/24/54/93/1043245493.db2.gz FIIUFGBRWSUQBQ-UHFFFAOYSA-N -1 1 331.371 4.317 20 0 EIADMM Cc1cnc(C(=O)N2CCCCC[C@H]2/C=C\c2cccs2)c([O-])c1 ZINC000427912189 1043258542 /nfs/dbraw/zinc/25/85/42/1043258542.db2.gz GCVYPZGDYZCUQM-CDNLZTBQSA-N -1 1 342.464 4.255 20 0 EIADMM Cc1cnc(C(=O)N2CCCCC[C@@H]2/C=C\c2cccs2)c([O-])c1 ZINC000427912194 1043258655 /nfs/dbraw/zinc/25/86/55/1043258655.db2.gz GCVYPZGDYZCUQM-WHLNPGIBSA-N -1 1 342.464 4.255 20 0 EIADMM CCc1ccccc1S(=O)(=O)[N-]c1cccc(-c2nc(C)co2)c1 ZINC000187551977 1043359712 /nfs/dbraw/zinc/35/97/12/1043359712.db2.gz PWAJZKDENAYDFL-UHFFFAOYSA-N -1 1 342.420 4.013 20 0 EIADMM CCc1cccc(S(=O)(=O)[N-]c2ccc(-c3coc(C)n3)cc2)c1 ZINC000674336044 1043608400 /nfs/dbraw/zinc/60/84/00/1043608400.db2.gz ZUDHAWASOBYWOJ-UHFFFAOYSA-N -1 1 342.420 4.013 20 0 EIADMM O=S(=O)(/C=C\c1ccc(Cl)cc1)[N-]c1cccc2cccnc21 ZINC000731054800 1043686339 /nfs/dbraw/zinc/68/63/39/1043686339.db2.gz OFBJSVWUFKNIJP-BENRWUELSA-N -1 1 344.823 4.301 20 0 EIADMM CCOc1cc(C(=O)Nc2ccc(SC)cc2)cc(Cl)c1[O-] ZINC000171881849 1043693776 /nfs/dbraw/zinc/69/37/76/1043693776.db2.gz WJMOCSSOCPTLSP-UHFFFAOYSA-N -1 1 337.828 4.419 20 0 EIADMM COc1cc(C(=O)Nc2cccc(OCC(C)C)c2)cc(Cl)c1[O-] ZINC000442736818 1043820205 /nfs/dbraw/zinc/82/02/05/1043820205.db2.gz JPMLQUWRCVDYAE-UHFFFAOYSA-N -1 1 349.814 4.341 20 0 EIADMM O=C([N-]c1nnc(-c2cc3ccccc3o2)s1)c1ccc(Cl)o1 ZINC000191845534 1043853145 /nfs/dbraw/zinc/85/31/45/1043853145.db2.gz MUUSCKLDNAMOCW-UHFFFAOYSA-N -1 1 345.767 4.450 20 0 EIADMM CC[C@H](C)c1ccc(S(=O)(=O)[N-]c2ccccc2CCOC)cc1 ZINC000191887707 1043855654 /nfs/dbraw/zinc/85/56/54/1043855654.db2.gz ONPCGZKTXJDEGX-HNNXBMFYSA-N -1 1 347.480 4.190 20 0 EIADMM CC(C)c1cccnc1[N-]S(=O)(=O)/C=C\c1ccccc1Cl ZINC000751595144 1043861874 /nfs/dbraw/zinc/86/18/74/1043861874.db2.gz RCWDEZVNYXTNME-LUAWRHEFSA-N -1 1 336.844 4.271 20 0 EIADMM COc1cc(C(=O)N2CCC[C@@H]2c2ccsc2)cc(Cl)c1[O-] ZINC000442865606 1043869057 /nfs/dbraw/zinc/86/90/57/1043869057.db2.gz IMRWBDBEJVESIH-CYBMUJFWSA-N -1 1 337.828 4.093 20 0 EIADMM CCSc1cccc(NC(=O)c2cc(Cl)c([O-])c(OC)c2)c1 ZINC000442977554 1043918401 /nfs/dbraw/zinc/91/84/01/1043918401.db2.gz ASKRRRJPIKMVRY-UHFFFAOYSA-N -1 1 337.828 4.419 20 0 EIADMM COc1cc(C(=O)N[C@H]2CCC[C@@H]2c2ccccc2)cc(Cl)c1[O-] ZINC000442963981 1043925860 /nfs/dbraw/zinc/92/58/60/1043925860.db2.gz FTKARBUMNKCYBY-ZBFHGGJFSA-N -1 1 345.826 4.120 20 0 EIADMM COc1cc(C(=O)Nc2ccccc2OC(C)(C)C)cc(Cl)c1[O-] ZINC000442973267 1043931751 /nfs/dbraw/zinc/93/17/51/1043931751.db2.gz DLNZUDMFMQCGQT-UHFFFAOYSA-N -1 1 349.814 4.484 20 0 EIADMM CSc1ccc(S(=O)(=O)[N-]c2cccc(C(F)F)c2)cc1 ZINC000195451277 1044082283 /nfs/dbraw/zinc/08/22/83/1044082283.db2.gz QKCCCCYZXKCVNZ-UHFFFAOYSA-N -1 1 329.393 4.147 20 0 EIADMM COc1cc(-c2nc([C@@H]3CCc4ccccc43)no2)cc(Cl)c1[O-] ZINC000443218051 1044101849 /nfs/dbraw/zinc/10/18/49/1044101849.db2.gz WWNDUQDBXYLPNT-CYBMUJFWSA-N -1 1 342.782 4.182 20 0 EIADMM CCOc1cc(-c2nc([C@H](C)SCC)no2)cc(Cl)c1[O-] ZINC000443218758 1044109839 /nfs/dbraw/zinc/10/98/39/1044109839.db2.gz GVSKNAAMLYVTJF-QMMMGPOBSA-N -1 1 328.821 4.308 20 0 EIADMM COc1cc(C(=O)Nc2ncc(C(C)(C)C)s2)cc(Cl)c1[O-] ZINC000443294589 1044162741 /nfs/dbraw/zinc/16/27/41/1044162741.db2.gz LHEQFGZJWBMATE-UHFFFAOYSA-N -1 1 340.832 4.061 20 0 EIADMM CCCOc1ccc(NC(=O)c2cc(Cl)c([O-])c(OC)c2)c(C)c1 ZINC000443336783 1044202068 /nfs/dbraw/zinc/20/20/68/1044202068.db2.gz YQBXYMASQKRMNR-UHFFFAOYSA-N -1 1 349.814 4.404 20 0 EIADMM Cc1ccncc1[N-]S(=O)(=O)c1c(C)cc(C(C)(C)C)cc1C ZINC000443362154 1044226165 /nfs/dbraw/zinc/22/61/65/1044226165.db2.gz OYSFJZBNFBXMTC-UHFFFAOYSA-N -1 1 332.469 4.105 20 0 EIADMM Cc1nc(S[C@H](C(=O)C2CC2)c2ccccc2)[n-]c(=O)c1C1CC1 ZINC000631023076 1044283394 /nfs/dbraw/zinc/28/33/94/1044283394.db2.gz GTWVZZAUFMDIHQ-KRWDZBQOSA-N -1 1 340.448 4.181 20 0 EIADMM [O-]c1c(Cl)cc(Br)cc1Nc1cccc(O)c1F ZINC001212554063 1044289861 /nfs/dbraw/zinc/28/98/61/1044289861.db2.gz IIVLIBKENSFLLU-UHFFFAOYSA-N -1 1 332.556 4.396 20 0 EIADMM COC(=O)c1c[n-]c(SC[C@H](C)c2ccc(C(F)(F)F)cc2)n1 ZINC000443467895 1044355612 /nfs/dbraw/zinc/35/56/12/1044355612.db2.gz NMWWGFNMPCQNTN-VIFPVBQESA-N -1 1 344.358 4.111 20 0 EIADMM O=C(Nc1ccc(OC2CCCC2)cc1)c1c(F)ccc([O-])c1F ZINC000280849543 1044404946 /nfs/dbraw/zinc/40/49/46/1044404946.db2.gz VXJVGTMVVHHHQO-UHFFFAOYSA-N -1 1 333.334 4.244 20 0 EIADMM O=c1cc(C2CC2)nc(SCc2cc(-c3ccccc3)on2)[n-]1 ZINC000470440984 1044430922 /nfs/dbraw/zinc/43/09/22/1044430922.db2.gz QJRAVBHLBDDIAO-UHFFFAOYSA-N -1 1 325.393 4.007 20 0 EIADMM CCCC[C@@H](CC)CC(=O)N1CCC(C(=O)c2ccc([O-])cc2)CC1 ZINC000117411958 1044443347 /nfs/dbraw/zinc/44/33/47/1044443347.db2.gz WMHNUCULZGBYDS-MRXNPFEDSA-N -1 1 345.483 4.420 20 0 EIADMM CC[C@@]1(C(=O)[O-])CCCN(Cc2csc(C3CCCCC3)n2)C1 ZINC000923470250 1045117235 /nfs/dbraw/zinc/11/72/35/1045117235.db2.gz KDDMFZCIBPZZCE-GOSISDBHSA-N -1 1 336.501 4.268 20 0 EIADMM COc1ccc(C[C@H](C)CN(C)C(=O)c2c([O-])cccc2Cl)cc1 ZINC000762287426 1045166691 /nfs/dbraw/zinc/16/66/91/1045166691.db2.gz KUERDNONZPJBJZ-ZDUSSCGKSA-N -1 1 347.842 4.005 20 0 EIADMM CC(C)(C)OC(=O)Nc1ccc(C(=O)N2CCC(C)(C)CC2)c([O-])c1 ZINC000740926003 1045244864 /nfs/dbraw/zinc/24/48/64/1045244864.db2.gz XECDKGCCMHDWAK-UHFFFAOYSA-N -1 1 348.443 4.001 20 0 EIADMM CCOc1cc(C(=O)N[C@@H](C)c2ccc(C)s2)cc(Cl)c1[O-] ZINC000762584964 1045305410 /nfs/dbraw/zinc/30/54/10/1045305410.db2.gz QTGYNHCVVKJSOO-JTQLQIEISA-N -1 1 339.844 4.305 20 0 EIADMM CC(C)(C)C1CC([N-]S(=O)(=O)c2cc(Cl)sc2Cl)C1 ZINC001211995643 1045626266 /nfs/dbraw/zinc/62/62/66/1045626266.db2.gz ISQJCYNKSHEMQX-UHFFFAOYSA-N -1 1 342.313 4.158 20 0 EIADMM Cc1cccc([C@H]2CCC[N@H+]2Cc2nc(=O)c3sccc3[n-]2)c1 ZINC000055910918 1045762207 /nfs/dbraw/zinc/76/22/07/1045762207.db2.gz AFZAYKBKUJQSEX-OAHLLOKOSA-N -1 1 325.437 4.042 20 0 EIADMM Cc1cccc([C@H]2CCCN2Cc2nc(=O)c3sccc3[n-]2)c1 ZINC000055910918 1045762221 /nfs/dbraw/zinc/76/22/21/1045762221.db2.gz AFZAYKBKUJQSEX-OAHLLOKOSA-N -1 1 325.437 4.042 20 0 EIADMM CC(C)(C)OC(=O)Nc1cccc(C(=O)Nc2ccc(F)cc2[O-])c1 ZINC000768259866 1045768410 /nfs/dbraw/zinc/76/84/10/1045768410.db2.gz WMEUDFOBLFUJAJ-UHFFFAOYSA-N -1 1 346.358 4.131 20 0 EIADMM O=C(Nc1ccc(F)cc1[O-])c1ccc(SC(F)(F)F)cc1 ZINC000768259225 1045772469 /nfs/dbraw/zinc/77/24/69/1045772469.db2.gz SQUWZRGTABPTDF-UHFFFAOYSA-N -1 1 331.290 4.396 20 0 EIADMM COCCCC[C@@H](NC(=O)c1c([O-])cccc1Cl)c1ccccc1 ZINC000792556539 1045914609 /nfs/dbraw/zinc/91/46/09/1045914609.db2.gz NMVBQQKERREBJD-MRXNPFEDSA-N -1 1 347.842 4.333 20 0 EIADMM COCCCCN(Cc1ccccc1)C(=O)c1c([O-])cccc1Cl ZINC000769732475 1046045211 /nfs/dbraw/zinc/04/52/11/1046045211.db2.gz PNGKDSCTFVBOLT-UHFFFAOYSA-N -1 1 347.842 4.115 20 0 EIADMM Cc1cc(NC(=O)C(=O)c2ccc([O-])cc2)ccc1-c1ccccc1 ZINC000792833930 1046075395 /nfs/dbraw/zinc/07/53/95/1046075395.db2.gz AHXXYKBFVOBYGB-UHFFFAOYSA-N -1 1 331.371 4.189 20 0 EIADMM O=C(c1ncc2ccccc2c1[O-])N1CCC[C@H]1CCc1ccccc1 ZINC001626113110 1046123474 /nfs/dbraw/zinc/12/34/74/1046123474.db2.gz IRZDFIFRPHVYTA-SFHVURJKSA-N -1 1 346.430 4.178 20 0 EIADMM CCC[C@@H](NCc1ccc(-c2cccc(C(F)(F)F)c2)o1)C(=O)[O-] ZINC000262714150 1046217546 /nfs/dbraw/zinc/21/75/46/1046217546.db2.gz QYUFUHDRIWZBRB-CQSZACIVSA-N -1 1 341.329 4.308 20 0 EIADMM O=C([O-])CC[C@H]1CCCN(Cc2csc(-c3ccc(F)cc3)n2)C1 ZINC000263127371 1046256498 /nfs/dbraw/zinc/25/64/98/1046256498.db2.gz MPNRALSGJWJFHJ-CYBMUJFWSA-N -1 1 348.443 4.026 20 0 EIADMM COc1ccc2cc(/C=C\C(=O)Nc3c([O-])cccc3F)ccc2c1 ZINC000770860417 1046274162 /nfs/dbraw/zinc/27/41/62/1046274162.db2.gz DFIDMJKQLHJDMR-POHAHGRESA-N -1 1 337.350 4.345 20 0 EIADMM CC[C@H](C)Oc1ccccc1/C=C/C(=O)Nc1c([O-])cccc1F ZINC000770862222 1046277246 /nfs/dbraw/zinc/27/72/46/1046277246.db2.gz LMULTUKKAJLJPQ-YLSINNKHSA-N -1 1 329.371 4.361 20 0 EIADMM O=C(NC(c1cccs1)c1cccs1)c1c([O-])cccc1F ZINC000125509442 1046312452 /nfs/dbraw/zinc/31/24/52/1046312452.db2.gz OMNRRYJGRLMISD-UHFFFAOYSA-N -1 1 333.409 4.174 20 0 EIADMM Cc1oc(-c2cccs2)nc1-c1nc(-c2ccc([O-])cc2F)no1 ZINC000771213688 1046354264 /nfs/dbraw/zinc/35/42/64/1046354264.db2.gz SOAMBXDULWCIGN-UHFFFAOYSA-N -1 1 343.339 4.273 20 0 EIADMM Cc1coc(-c2cccc([N-]S(=O)(=O)c3ccc(C)c(C)c3)c2)n1 ZINC000126757135 1046523795 /nfs/dbraw/zinc/52/37/95/1046523795.db2.gz AXSVOMAJLCSWTH-UHFFFAOYSA-N -1 1 342.420 4.068 20 0 EIADMM O=C(Nc1c([O-])cccc1F)c1cc(F)c(C(F)(F)F)cc1F ZINC000804506620 1046545821 /nfs/dbraw/zinc/54/58/21/1046545821.db2.gz ZWTNRYUOIUAOHX-UHFFFAOYSA-N -1 1 335.203 4.081 20 0 EIADMM O=C(Nc1ccc(F)cc1[O-])c1cc(F)c(C(F)(F)F)cc1F ZINC000804505590 1046546779 /nfs/dbraw/zinc/54/67/79/1046546779.db2.gz DWSXWMPKYHLNQE-UHFFFAOYSA-N -1 1 335.203 4.081 20 0 EIADMM CCOC(=O)Nc1ccc(NC(=O)c2ccc(C(C)C)cc2[O-])cc1 ZINC000917181901 1046801130 /nfs/dbraw/zinc/80/11/30/1046801130.db2.gz ZOGLYKDDGFIGIL-UHFFFAOYSA-N -1 1 342.395 4.336 20 0 EIADMM O=C(Nc1cccc(Cl)c1SC(F)F)c1cncc([O-])c1 ZINC000786056201 1046807181 /nfs/dbraw/zinc/80/71/81/1046807181.db2.gz YXRNOWDRBCLKPG-UHFFFAOYSA-N -1 1 330.743 4.008 20 0 EIADMM CCc1cc(=O)[nH]c(C[NH2+][C@@H](c2oc3ccccc3c2C)C(C)C)n1 ZINC000537059221 1046908541 /nfs/dbraw/zinc/90/85/41/1046908541.db2.gz UUNKXYRMPJZJST-LJQANCHMSA-N -1 1 339.439 4.286 20 0 EIADMM COc1cc(C(=O)N2CCCc3c(C)cc(C)cc32)cc(Cl)c1[O-] ZINC000460190579 1047169702 /nfs/dbraw/zinc/16/97/02/1047169702.db2.gz RADFKBWERSTWBE-UHFFFAOYSA-N -1 1 345.826 4.264 20 0 EIADMM [O-]c1ccc(-c2nc(Cc3cccc(C(F)(F)F)c3)no2)c(F)c1 ZINC000325781404 1047320688 /nfs/dbraw/zinc/32/06/88/1047320688.db2.gz XOHKMFGDTOOVHP-UHFFFAOYSA-N -1 1 338.260 4.191 20 0 EIADMM CC1(C)CN(C(=O)c2ccc(C(F)(F)F)c([O-])c2)c2ccccc21 ZINC001170111900 1047442610 /nfs/dbraw/zinc/44/26/10/1047442610.db2.gz JBZCUCQTKSAZCF-UHFFFAOYSA-N -1 1 335.325 4.349 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@@H]1SCCc2sccc21 ZINC000129654558 1047458784 /nfs/dbraw/zinc/45/87/84/1047458784.db2.gz IYSWQLUHDWAVJJ-CYBMUJFWSA-N -1 1 325.842 4.076 20 0 EIADMM O=C(CCSc1ccc(Cl)cc1)Nc1cc(F)cc(F)c1[O-] ZINC001142537324 1047563445 /nfs/dbraw/zinc/56/34/45/1047563445.db2.gz HZOFRXNZWJBXFV-UHFFFAOYSA-N -1 1 343.782 4.445 20 0 EIADMM O=C(Nc1cc(F)cc(F)c1[O-])[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F ZINC001142545456 1047586568 /nfs/dbraw/zinc/58/65/68/1047586568.db2.gz BTALJTZVAYUHRA-BZADUYSNSA-N -1 1 349.299 4.224 20 0 EIADMM O=C(N[C@H]1CCO[C@@H](c2ccccc2)C1)c1ccc2ccccc2c1[O-] ZINC000131129167 1047832731 /nfs/dbraw/zinc/83/27/31/1047832731.db2.gz ZGBWTABOEKCARG-FXAWDEMLSA-N -1 1 347.414 4.196 20 0 EIADMM Cc1cc(NC(=O)c2cc(F)ccc2[O-])ccc1OCC(F)(F)F ZINC001136924217 1047901484 /nfs/dbraw/zinc/90/14/84/1047901484.db2.gz SMDLUDOGIPWERQ-UHFFFAOYSA-N -1 1 343.276 4.033 20 0 EIADMM Cc1sccc1CNc1cc(C)cc(C[N-]C(=O)C(F)(F)F)c1 ZINC000825011383 1048009018 /nfs/dbraw/zinc/00/90/18/1048009018.db2.gz IGQKATGBVWRZJD-UHFFFAOYSA-N -1 1 342.386 4.156 20 0 EIADMM C[C@H](CC(=O)Nc1c([O-])cc(Br)cc1Cl)C1CC1 ZINC000843887417 1048135995 /nfs/dbraw/zinc/13/59/95/1048135995.db2.gz ULJNXWSCLLQFLJ-SSDOTTSWSA-N -1 1 332.625 4.183 20 0 EIADMM CCCCC[C@@H](NC(=O)c1cnc(C2CC2)[n-]c1=O)c1ccccc1 ZINC001143658637 1048140342 /nfs/dbraw/zinc/14/03/42/1048140342.db2.gz OSCXIPWJMLFQGL-QGZVFWFLSA-N -1 1 339.439 4.111 20 0 EIADMM CC(C)c1cccc(S(=O)(=O)[N-]c2cccc(-c3ncco3)c2)c1 ZINC000132722026 1048468820 /nfs/dbraw/zinc/46/88/20/1048468820.db2.gz JKVNHQFNQOCKRU-UHFFFAOYSA-N -1 1 342.420 4.266 20 0 EIADMM O=S(=O)(c1ccc([O-])cc1)[C@H]1CCc2c1cc(Cl)cc2Cl ZINC000133155298 1048636744 /nfs/dbraw/zinc/63/67/44/1048636744.db2.gz ZOQGFRPHSVYDJZ-HNNXBMFYSA-N -1 1 343.231 4.160 20 0 EIADMM O=C(NCc1c(Cl)cccc1Cl)c1c([O-])cccc1Cl ZINC000920444762 1048674930 /nfs/dbraw/zinc/67/49/30/1048674930.db2.gz DXULSKSZBARRHP-UHFFFAOYSA-N -1 1 330.598 4.282 20 0 EIADMM O=C(NCCc1csc2ccccc12)c1c([O-])cccc1Cl ZINC000920454898 1048676559 /nfs/dbraw/zinc/67/65/59/1048676559.db2.gz ZJSRQZLRQJOHNG-UHFFFAOYSA-N -1 1 331.824 4.233 20 0 EIADMM O=C(c1cc(Cl)ccc1[O-])N1CC[C@@H](CSc2ccccc2)C1 ZINC000075199794 1048700878 /nfs/dbraw/zinc/70/08/78/1048700878.db2.gz KZKVVMBCDCRDLU-CYBMUJFWSA-N -1 1 347.867 4.300 20 0 EIADMM CN(Cc1ccccc1Br)Cc1c(F)cc([O-])cc1F ZINC001144541478 1048720109 /nfs/dbraw/zinc/72/01/09/1048720109.db2.gz GVVNZDQCCUDUIM-UHFFFAOYSA-N -1 1 342.183 4.065 20 0 EIADMM [O-]c1cc(F)c(CN2CCn3cccc3[C@H]2c2ccccc2)c(F)c1 ZINC001144541122 1048720383 /nfs/dbraw/zinc/72/03/83/1048720383.db2.gz BFDNRSTYPCBSPR-HXUWFJFHSA-N -1 1 340.373 4.077 20 0 EIADMM CC(=O)Cc1ccc(OC(=O)c2cc3cc(Cl)sc3[n-]2)cc1 ZINC000816209440 1048722949 /nfs/dbraw/zinc/72/29/49/1048722949.db2.gz YPDGNMAMNZVSRF-UHFFFAOYSA-N -1 1 333.796 4.234 20 0 EIADMM Cc1ccc(OC2CCN(Cc3c(F)cc([O-])cc3F)CC2)cc1 ZINC001144554859 1048723454 /nfs/dbraw/zinc/72/34/54/1048723454.db2.gz JZWNIPDXJCJNSI-UHFFFAOYSA-N -1 1 333.378 4.022 20 0 EIADMM [O-]c1cc(F)c(CN(CCCCCCO)Cc2ccccc2)c(F)c1 ZINC001144560952 1048727969 /nfs/dbraw/zinc/72/79/69/1048727969.db2.gz CYUVJVCZMZIKNJ-UHFFFAOYSA-N -1 1 349.421 4.225 20 0 EIADMM [O-]c1cc(F)c(CN2CCc3cc(C(F)(F)F)ccc3C2)c(F)c1 ZINC001144561360 1048728019 /nfs/dbraw/zinc/72/80/19/1048728019.db2.gz HNEZAYBSOMPMQZ-UHFFFAOYSA-N -1 1 343.295 4.248 20 0 EIADMM [O-]c1cc(F)c(CN2Cc3nc(-c4ccccc4)sc3C2)c(F)c1 ZINC001144567496 1048733394 /nfs/dbraw/zinc/73/33/94/1048733394.db2.gz NYYNCIGAFLMQKU-UHFFFAOYSA-N -1 1 344.386 4.310 20 0 EIADMM Cc1[nH]c2ccc(CNC(=O)c3c([O-])cccc3Cl)cc2c1C ZINC000920863659 1048795624 /nfs/dbraw/zinc/79/56/24/1048795624.db2.gz YPKFDIBOICBPCP-UHFFFAOYSA-N -1 1 328.799 4.074 20 0 EIADMM O=C(Cc1ccc(C2CC2)cc1)Nc1cccc(C(F)(F)F)c1[O-] ZINC001144719625 1048818623 /nfs/dbraw/zinc/81/86/23/1048818623.db2.gz RQRUAICPOZUEAJ-UHFFFAOYSA-N -1 1 335.325 4.470 20 0 EIADMM Cc1cc(=O)oc2cc(N(C)Cc3cccc([O-])c3Cl)ccc12 ZINC000816609421 1048843098 /nfs/dbraw/zinc/84/30/98/1048843098.db2.gz BHPINPHEMCXUJQ-UHFFFAOYSA-N -1 1 329.783 4.097 20 0 EIADMM CC(C)CN(C(=O)c1cc(F)ccc1[O-])[C@@H]1CCCc2cccnc21 ZINC000133889471 1048843788 /nfs/dbraw/zinc/84/37/88/1048843788.db2.gz AMGCXZQDPWBCFI-QGZVFWFLSA-N -1 1 342.414 4.102 20 0 EIADMM CC[C@@H](C)N(Cc1ccccc1)C(=O)Cc1ccc([O-])c(Cl)c1 ZINC001144752187 1048845475 /nfs/dbraw/zinc/84/54/75/1048845475.db2.gz HNSVXSYMKHUJBG-CQSZACIVSA-N -1 1 331.843 4.415 20 0 EIADMM O=C(N[C@@H]1CC[C@@H]2CCCC[C@H]2C1)c1c([O-])cnc2c(F)cccc21 ZINC001135794395 1048888115 /nfs/dbraw/zinc/88/81/15/1048888115.db2.gz KAJNRMMEVFXELL-MELADBBJSA-N -1 1 342.414 4.168 20 0 EIADMM CC(C)(C)[C@H]1OCCC[C@H]1CNC(=O)c1ccc2ccccc2c1[O-] ZINC001146821402 1049057714 /nfs/dbraw/zinc/05/77/14/1049057714.db2.gz CTIUQCIRQRPKRH-KXBFYZLASA-N -1 1 341.451 4.117 20 0 EIADMM CC[C@@H](NC(=O)c1cc(Cl)ccc1[O-])c1cc(F)ccc1F ZINC001147211078 1049105655 /nfs/dbraw/zinc/10/56/55/1049105655.db2.gz NDUHZEYKTRDSTJ-CQSZACIVSA-N -1 1 325.742 4.205 20 0 EIADMM O=C(NCCc1cc2ccccc2o1)c1ccc(C(F)(F)F)cc1[O-] ZINC001147299301 1049121154 /nfs/dbraw/zinc/12/11/54/1049121154.db2.gz XWLUDUYRGGDMRN-UHFFFAOYSA-N -1 1 349.308 4.130 20 0 EIADMM C[C@H]1C[C@H](NC(=O)c2cc(-c3ccc(C=O)o3)ccc2[O-])C[C@@H](C)C1 ZINC001147331813 1049127338 /nfs/dbraw/zinc/12/73/38/1049127338.db2.gz PUQXNQDADZMLAR-NHAGDIPZSA-N -1 1 341.407 4.019 20 0 EIADMM CC[C@@H](Cc1ccc(C)cc1)N(CC)C(=O)c1ccc([O-])cc1F ZINC001147860070 1049228643 /nfs/dbraw/zinc/22/86/43/1049228643.db2.gz CIICBIVXWJCOIQ-INIZCTEOSA-N -1 1 329.415 4.323 20 0 EIADMM C[C@@H](CNC(=O)c1cc2ccccc2cc1[O-])c1ccc(F)cc1F ZINC001148048524 1049255293 /nfs/dbraw/zinc/25/52/93/1049255293.db2.gz VVJJONATNDJMJQ-LBPRGKRZSA-N -1 1 341.357 4.357 20 0 EIADMM COc1cc(C(=O)N(C)[C@@H](C)c2ccc(C)cc2)cc(Cl)c1[O-] ZINC000135772638 1049265721 /nfs/dbraw/zinc/26/57/21/1049265721.db2.gz CROWLJNVUMUUMC-LBPRGKRZSA-N -1 1 333.815 4.196 20 0 EIADMM CC(C)c1ccc(C(=O)N2C[C@H](C)CN(C)c3ccccc32)c([O-])c1 ZINC001148140789 1049270476 /nfs/dbraw/zinc/27/04/76/1049270476.db2.gz JUHDIDHYRYWYDX-OAHLLOKOSA-N -1 1 338.451 4.248 20 0 EIADMM CCCn1cc(C(=O)Nc2cc(Cl)c([O-])c3ccccc23)cn1 ZINC001148253479 1049289941 /nfs/dbraw/zinc/28/99/41/1049289941.db2.gz UIYDSMIAKWEBRO-UHFFFAOYSA-N -1 1 329.787 4.058 20 0 EIADMM O=C(Nc1ccccc1-c1ncco1)c1cc2ccccc2cc1[O-] ZINC001148245667 1049292663 /nfs/dbraw/zinc/29/26/63/1049292663.db2.gz KCHPJEYFSCWYRJ-UHFFFAOYSA-N -1 1 330.343 4.453 20 0 EIADMM Cc1c(F)c(F)ccc1C(=O)Nc1cccc(C(F)(F)F)c1[O-] ZINC001148602831 1049337424 /nfs/dbraw/zinc/33/74/24/1049337424.db2.gz KBJRGJXOUFCBJR-UHFFFAOYSA-N -1 1 331.240 4.250 20 0 EIADMM CC(C)Oc1ccc(NC(=O)c2ccc3ccc(O)cc3c2[O-])cc1 ZINC001136275072 1049383649 /nfs/dbraw/zinc/38/36/49/1049383649.db2.gz UCNSKAVXVLHOMQ-UHFFFAOYSA-N -1 1 337.375 4.291 20 0 EIADMM COc1ccc(NC(=O)c2cccc(-c3ccccc3)c2[O-])c(C)n1 ZINC001148861538 1049391219 /nfs/dbraw/zinc/39/12/19/1049391219.db2.gz SGMROCKPTNYCCB-UHFFFAOYSA-N -1 1 334.375 4.024 20 0 EIADMM Cc1nc(C)c(C[N-]C(=O)C(F)(F)c2cc(Cl)ccc2Cl)o1 ZINC000820704434 1049542544 /nfs/dbraw/zinc/54/25/44/1049542544.db2.gz GFUNRJHURARDFR-UHFFFAOYSA-N -1 1 349.164 4.006 20 0 EIADMM COc1c(Cl)cccc1NC(=O)c1ccc2ccc(O)cc2c1[O-] ZINC001136399131 1049584452 /nfs/dbraw/zinc/58/44/52/1049584452.db2.gz KIWCGALCURLZCT-UHFFFAOYSA-N -1 1 343.766 4.165 20 0 EIADMM O=C([N-]c1ccc(F)c(F)c1F)c1nc(Cl)sc1Cl ZINC000821669784 1049669585 /nfs/dbraw/zinc/66/95/85/1049669585.db2.gz NDKXFFWSOUFGMH-UHFFFAOYSA-N -1 1 327.114 4.120 20 0 EIADMM Cc1ccccc1-n1nc(C(C)(C)C)cc1NC(=O)c1ccccc1[O-] ZINC001136603111 1049779180 /nfs/dbraw/zinc/77/91/80/1049779180.db2.gz LRUNBTDYOBYHPX-UHFFFAOYSA-N -1 1 349.434 4.436 20 0 EIADMM O=C([N-]Cc1cscc1Cl)C(F)(F)c1cc(F)cc(F)c1 ZINC001133826088 1049800847 /nfs/dbraw/zinc/80/08/47/1049800847.db2.gz PYTOMKRGZOCVDL-UHFFFAOYSA-N -1 1 337.725 4.088 20 0 EIADMM O=C(Nc1cccc(Nc2ccccc2)c1)c1cnc(C2CC2)[n-]c1=O ZINC001136657480 1049815429 /nfs/dbraw/zinc/81/54/29/1049815429.db2.gz SNRRZLKNOXQKMX-UHFFFAOYSA-N -1 1 346.390 4.056 20 0 EIADMM CSc1ccc(-c2csc(NC(=O)c3ccccc3[O-])n2)cc1 ZINC001136664557 1049817086 /nfs/dbraw/zinc/81/70/86/1049817086.db2.gz HNJASZYSIXNZKV-UHFFFAOYSA-N -1 1 342.445 4.490 20 0 EIADMM CC1CCN(c2ccc(NC(=O)c3ccc(F)c([O-])c3)cc2)CC1 ZINC001136779054 1049878281 /nfs/dbraw/zinc/87/82/81/1049878281.db2.gz CMDJPRWAVYDBCW-UHFFFAOYSA-N -1 1 328.387 4.020 20 0 EIADMM CC(C)CCc1nnc([N-]C(=O)c2coc(-c3ccccc3)n2)s1 ZINC000617096243 1049949714 /nfs/dbraw/zinc/94/97/14/1049949714.db2.gz MIAXSOOMCUTBBX-UHFFFAOYSA-N -1 1 342.424 4.034 20 0 EIADMM Cc1nc([C@H](C)[N@H+]2CCC[C@H](C(=O)[O-])C2)oc1-c1ccc(Cl)cc1 ZINC000263582061 1050090823 /nfs/dbraw/zinc/09/08/23/1050090823.db2.gz YAYBINXBGRKHAM-JSGCOSHPSA-N -1 1 348.830 4.161 20 0 EIADMM O=C(c1ncc2ccccc2c1[O-])N1CC2(CCCC2)[C@@H]1c1ccco1 ZINC000617922290 1050130429 /nfs/dbraw/zinc/13/04/29/1050130429.db2.gz IMUYOWGWKDIQOV-IBGZPJMESA-N -1 1 348.402 4.291 20 0 EIADMM Cc1cc(Cl)cc(-c2noc(-c3ncc(C(F)(F)F)[n-]3)n2)c1 ZINC001212689401 1050227636 /nfs/dbraw/zinc/22/76/36/1050227636.db2.gz CNEGJHQHFUSNJN-UHFFFAOYSA-N -1 1 328.681 4.107 20 0 EIADMM Cc1cc(Cl)cc(-c2noc(-c3nc(C(F)(F)F)c[n-]3)n2)c1 ZINC001212689401 1050227647 /nfs/dbraw/zinc/22/76/47/1050227647.db2.gz CNEGJHQHFUSNJN-UHFFFAOYSA-N -1 1 328.681 4.107 20 0 EIADMM Cc1cc2ccccc2nc1-c1noc(-c2ncc(C(F)(F)F)[n-]2)n1 ZINC001212689942 1050227835 /nfs/dbraw/zinc/22/78/35/1050227835.db2.gz UWHCYSHGQCSWFJ-UHFFFAOYSA-N -1 1 345.284 4.002 20 0 EIADMM Cc1cc2ccccc2nc1-c1noc(-c2nc(C(F)(F)F)c[n-]2)n1 ZINC001212689942 1050227844 /nfs/dbraw/zinc/22/78/44/1050227844.db2.gz UWHCYSHGQCSWFJ-UHFFFAOYSA-N -1 1 345.284 4.002 20 0 EIADMM Cc1cc(NC(=O)c2ccc([O-])c(F)c2)cc(C)c1Br ZINC001186201941 1050259377 /nfs/dbraw/zinc/25/93/77/1050259377.db2.gz CIRUEWHDRYDIQQ-UHFFFAOYSA-N -1 1 338.176 4.163 20 0 EIADMM O=C(NCCC(c1ccccc1)c1ccccc1)c1ccc([O-])c(F)c1 ZINC001186237159 1050265944 /nfs/dbraw/zinc/26/59/44/1050265944.db2.gz RAPUDXKZGOHNAL-UHFFFAOYSA-N -1 1 349.405 4.483 20 0 EIADMM O=C(Nc1cc(-c2ccc(Cl)s2)on1)c1ccc([O-])cc1F ZINC001186318675 1050284990 /nfs/dbraw/zinc/28/49/90/1050284990.db2.gz PEIKVTQMEJAZPI-UHFFFAOYSA-N -1 1 338.747 4.154 20 0 EIADMM Cc1cc(C(=O)Nc2cccc(C(F)(F)F)c2[O-])c(F)cc1F ZINC001186382393 1050314994 /nfs/dbraw/zinc/31/49/94/1050314994.db2.gz QZLDPAFPBVFMIZ-UHFFFAOYSA-N -1 1 331.240 4.250 20 0 EIADMM CC(=O)OCc1cccc(Cl)c1Nc1ccc(F)c(F)c1[O-] ZINC001212777931 1050320155 /nfs/dbraw/zinc/32/01/55/1050320155.db2.gz HWAKKGLXXLJQIY-UHFFFAOYSA-N -1 1 327.714 4.131 20 0 EIADMM CSC1(CNC(=O)c2ccc3ccc(O)cc3c2[O-])CCCCC1 ZINC001178015676 1050355216 /nfs/dbraw/zinc/35/52/16/1050355216.db2.gz COYOAIDSLIVLIU-UHFFFAOYSA-N -1 1 345.464 4.047 20 0 EIADMM [O-]c1cnccc1-c1nc(-c2ccccc2OCc2ccccc2)no1 ZINC001212721375 1050430206 /nfs/dbraw/zinc/43/02/06/1050430206.db2.gz MSSRZFHGOPYGMA-UHFFFAOYSA-N -1 1 345.358 4.083 20 0 EIADMM Cc1ccc(C(=O)NCCc2c(F)cc([O-])cc2F)c2ccccc12 ZINC001178785184 1050553911 /nfs/dbraw/zinc/55/39/11/1050553911.db2.gz PASISJINUUNSOV-UHFFFAOYSA-N -1 1 341.357 4.105 20 0 EIADMM O=c1[n-]c(-c2nc3ccccc3o2)nc2cc(Cl)c(Cl)cc12 ZINC000670965386 1050559142 /nfs/dbraw/zinc/55/91/42/1050559142.db2.gz JARRPWIGTAQYHL-UHFFFAOYSA-N -1 1 332.146 4.450 20 0 EIADMM COc1ccc(Nc2ccc(F)c(Br)c2[O-])c(OC)c1 ZINC001173892089 1050607311 /nfs/dbraw/zinc/60/73/11/1050607311.db2.gz LEFQAQVTXDPBTK-UHFFFAOYSA-N -1 1 342.164 4.055 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2cccc(-c3ccccc3)c2)cc1N ZINC001173912590 1050624668 /nfs/dbraw/zinc/62/46/68/1050624668.db2.gz ZKMAHRLZHBEITP-UHFFFAOYSA-N -1 1 338.432 4.045 20 0 EIADMM CC1(C)CCCC[C@@H]1[N-]S(=O)(=O)c1cc(Cl)sc1Cl ZINC001188034995 1050685290 /nfs/dbraw/zinc/68/52/90/1050685290.db2.gz PLBQAPMEVVMOGK-VIFPVBQESA-N -1 1 342.313 4.302 20 0 EIADMM O=S(=O)([N-]c1cc(C(F)(F)F)ccc1C(F)(F)F)C1CCC1 ZINC001188131195 1050706246 /nfs/dbraw/zinc/70/62/46/1050706246.db2.gz WOBNEEZONYBTET-UHFFFAOYSA-N -1 1 347.280 4.018 20 0 EIADMM O=C(Nc1cc(F)c([O-])cc1Cl)c1csc2c1CCCC2 ZINC001179654824 1050737489 /nfs/dbraw/zinc/73/74/89/1050737489.db2.gz AGALPMDWTLWRRP-UHFFFAOYSA-N -1 1 325.792 4.377 20 0 EIADMM CC(C)(C)Cc1cc(NC(=O)c2ccc([O-])c(C(F)(F)F)c2)on1 ZINC001188562825 1050792991 /nfs/dbraw/zinc/79/29/91/1050792991.db2.gz IZSHNBATGYKLCI-UHFFFAOYSA-N -1 1 342.317 4.240 20 0 EIADMM CCS[C@@H]1CCCC[C@H]1NC(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC000619582734 1050824640 /nfs/dbraw/zinc/82/46/40/1050824640.db2.gz HXGAAWOXAZRUCV-TZMCWYRMSA-N -1 1 347.402 4.205 20 0 EIADMM CC(C)(C)[C@H]1CCC[C@@H]([N-]S(=O)(=O)c2ccc(C(F)F)o2)CC1 ZINC001189288990 1050948771 /nfs/dbraw/zinc/94/87/71/1050948771.db2.gz LETGUWCEEJPVRO-NWDGAFQWSA-N -1 1 349.443 4.491 20 0 EIADMM CCCCOc1ccc(NC(=O)Nc2ccc([O-])c(F)c2F)cc1 ZINC001189314458 1050960168 /nfs/dbraw/zinc/96/01/68/1050960168.db2.gz JAVSOTAZMQNDNV-UHFFFAOYSA-N -1 1 336.338 4.493 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2ccc(F)c3ccccc32)c(C)c1 ZINC001189347882 1050968579 /nfs/dbraw/zinc/96/85/79/1050968579.db2.gz LIWICYKDRPQHKI-UHFFFAOYSA-N -1 1 329.396 4.397 20 0 EIADMM C[C@H]1CCCC[C@H]1CC(=O)N1CCC(C(=O)c2ccc([O-])cc2)CC1 ZINC000620170554 1051047264 /nfs/dbraw/zinc/04/72/64/1051047264.db2.gz MSZUOUIJTXHJQP-YJBOKZPZSA-N -1 1 343.467 4.030 20 0 EIADMM O=C(Nc1ncc(-c2cccc(F)c2)s1)c1ccc([O-])c(F)c1 ZINC001180658728 1051056944 /nfs/dbraw/zinc/05/69/44/1051056944.db2.gz DJVIHKVHZILFAC-UHFFFAOYSA-N -1 1 332.331 4.046 20 0 EIADMM Cc1nc(SCC2([C@@H]3CCCCO3)CCC2)[n-]c(=O)c1C1CC1 ZINC001189891010 1051079844 /nfs/dbraw/zinc/07/98/44/1051079844.db2.gz ASEXOPOUGKEELR-AWEZNQCLSA-N -1 1 334.485 4.200 20 0 EIADMM CCc1c(Cl)cc(NC2=CCC3(CC2)OCCO3)c([O-])c1Cl ZINC001174643869 1051097622 /nfs/dbraw/zinc/09/76/22/1051097622.db2.gz VSUPDJHFEDTPHI-UHFFFAOYSA-N -1 1 344.238 4.484 20 0 EIADMM Cc1noc(-c2ccccc2)c1NC(=O)Nc1cc(F)c([O-])cc1F ZINC001190373305 1051172470 /nfs/dbraw/zinc/17/24/70/1051172470.db2.gz KUDHABZEBUTEBI-UHFFFAOYSA-N -1 1 345.305 4.278 20 0 EIADMM COc1cc(C(=O)NCc2ccc3ccccc3c2)cc(Cl)c1[O-] ZINC000153549045 1051192980 /nfs/dbraw/zinc/19/29/80/1051192980.db2.gz CQEHVCXPAVFHDV-UHFFFAOYSA-N -1 1 341.794 4.137 20 0 EIADMM O=S(=O)([N-]c1cccc2ncc(F)cc12)c1ccc(C2CC2)cc1 ZINC001190506181 1051198732 /nfs/dbraw/zinc/19/87/32/1051198732.db2.gz JMCBHIBGJUVKNT-UHFFFAOYSA-N -1 1 342.395 4.052 20 0 EIADMM COc1cc([N-]S(=O)(=O)c2ccc(C3CC3)cc2)ccc1SC ZINC001190497809 1051209049 /nfs/dbraw/zinc/20/90/49/1051209049.db2.gz ZHPCYAPJOHLYAY-UHFFFAOYSA-N -1 1 349.477 4.095 20 0 EIADMM O=C(CCCCCCCCCO)Nc1cccc(C(F)(F)F)c1[O-] ZINC001181416247 1051217017 /nfs/dbraw/zinc/21/70/17/1051217017.db2.gz UMSNHZDJYBRZGB-UHFFFAOYSA-N -1 1 347.377 4.463 20 0 EIADMM C[C@H]1Cc2cc(Cl)ccc2N1C(=O)Cc1ccc([O-])c(Cl)c1 ZINC001181548763 1051251412 /nfs/dbraw/zinc/25/14/12/1051251412.db2.gz NXZHYOZKCQZVIT-JTQLQIEISA-N -1 1 336.218 4.219 20 0 EIADMM Cc1c(F)cccc1CC(=O)Nc1cccc(C(F)(F)F)c1[O-] ZINC001181705989 1051280415 /nfs/dbraw/zinc/28/04/15/1051280415.db2.gz KJXXSIWASUWUOP-UHFFFAOYSA-N -1 1 327.277 4.040 20 0 EIADMM O=S(=O)([N-]c1ccc(Cl)c(-c2ccccc2)c1)c1ccncc1 ZINC001190904306 1051309032 /nfs/dbraw/zinc/30/90/32/1051309032.db2.gz XKLWNNKOLMZYJF-UHFFFAOYSA-N -1 1 344.823 4.203 20 0 EIADMM COC(=O)c1ccc(Nc2cc(Cl)c([O-])cc2F)cc1Cl ZINC001250022016 1051316060 /nfs/dbraw/zinc/31/60/60/1051316060.db2.gz CMRLQWBYRDOVLY-UHFFFAOYSA-N -1 1 330.142 4.368 20 0 EIADMM CCOC(=O)c1nc(Cl)sc1[N-]c1c(F)ccc(OC)c1F ZINC001175116977 1051359722 /nfs/dbraw/zinc/35/97/22/1051359722.db2.gz IIWUJQSKVYJTAI-UHFFFAOYSA-N -1 1 348.758 4.004 20 0 EIADMM CSc1ccc([O-])c(C(=O)Nc2n[nH]c(C)c2-c2ccccc2)c1 ZINC001181979471 1051361635 /nfs/dbraw/zinc/36/16/35/1051361635.db2.gz ILTCDEGDTOIVTA-UHFFFAOYSA-N -1 1 339.420 4.065 20 0 EIADMM COc1cc(C(=O)Nc2ccc3cc(C)[nH]c3c2)cc(Cl)c1[O-] ZINC001191149017 1051365367 /nfs/dbraw/zinc/36/53/67/1051365367.db2.gz ZYAZCJRXFNDMHF-UHFFFAOYSA-N -1 1 330.771 4.096 20 0 EIADMM COc1ccc(C(=O)Nc2ccccc2CCC(F)(F)F)c([O-])c1 ZINC000155320079 1051407890 /nfs/dbraw/zinc/40/78/90/1051407890.db2.gz SBXONKHNPBUJSD-UHFFFAOYSA-N -1 1 339.313 4.148 20 0 EIADMM CCS(=O)(=O)c1ccc([O-])c(Nc2ccc(OC(C)C)c(C)c2)c1 ZINC001175192418 1051416109 /nfs/dbraw/zinc/41/61/09/1051416109.db2.gz LXHMZYWVBHZLEW-UHFFFAOYSA-N -1 1 349.452 4.025 20 0 EIADMM O=C(Nc1ccccn1)Nc1c([O-])cc(C(F)(F)F)cc1Cl ZINC001191342399 1051422546 /nfs/dbraw/zinc/42/25/46/1051422546.db2.gz FVNFOMQJNPHWGL-UHFFFAOYSA-N -1 1 331.681 4.103 20 0 EIADMM CC[C@@H](C)C[C@@H](C)NC(=O)c1ccccc1C(=O)c1ccc([O-])cc1 ZINC001191511175 1051473185 /nfs/dbraw/zinc/47/31/85/1051473185.db2.gz YKMOLNMTCPOZAS-HUUCEWRRSA-N -1 1 339.435 4.178 20 0 EIADMM O=S(=O)(CC1CCCC1)[N-]c1ccc(Cl)cc1C(F)(F)F ZINC001191522648 1051474892 /nfs/dbraw/zinc/47/48/92/1051474892.db2.gz FQIPZRIHUDCBPU-UHFFFAOYSA-N -1 1 341.782 4.291 20 0 EIADMM Cc1c(Cl)cc(Nc2ccccc2[S@](C)=O)c([O-])c1Cl ZINC001175311161 1051522193 /nfs/dbraw/zinc/52/21/93/1051522193.db2.gz KBHFILQFTJAAKP-FQEVSTJZSA-N -1 1 330.236 4.488 20 0 EIADMM O=C(NCC1CCCCCCC1)c1ccc(Br)c([O-])c1 ZINC001182424726 1051545721 /nfs/dbraw/zinc/54/57/21/1051545721.db2.gz FHMPUOUBTHRGIY-UHFFFAOYSA-N -1 1 340.261 4.245 20 0 EIADMM Cc1c(Cl)cc(Nc2ccc([S@@](C)=O)cc2)c([O-])c1Cl ZINC001175480257 1051606682 /nfs/dbraw/zinc/60/66/82/1051606682.db2.gz XDUVVXJXEAZVEG-HXUWFJFHSA-N -1 1 330.236 4.488 20 0 EIADMM CCCCOc1ccc(C(=O)Nc2ccc3c(c2)CCCO3)c([O-])c1 ZINC001182552085 1051629304 /nfs/dbraw/zinc/62/93/04/1051629304.db2.gz PHEWXBLXFWOJCW-UHFFFAOYSA-N -1 1 341.407 4.148 20 0 EIADMM CC(C)c1ccccc1NC(=O)Nc1ccc(-n2ccc(=O)[n-]2)cc1 ZINC001192260482 1051676239 /nfs/dbraw/zinc/67/62/39/1051676239.db2.gz KQCVAGIWAXRHEQ-UHFFFAOYSA-N -1 1 336.395 4.345 20 0 EIADMM CC(=O)c1ccc(NC(=O)c2ccc(C(C)(C)C)cc2[O-])c(F)c1 ZINC001192322852 1051689887 /nfs/dbraw/zinc/68/98/87/1051689887.db2.gz QDVQQFLXYPULCV-UHFFFAOYSA-N -1 1 329.371 4.284 20 0 EIADMM O=C(Nc1cc(-c2ccccc2)on1)c1cc2ccccc2cc1[O-] ZINC001182735854 1051694465 /nfs/dbraw/zinc/69/44/65/1051694465.db2.gz CNXGVBHSWQAZTG-UHFFFAOYSA-N -1 1 330.343 4.453 20 0 EIADMM COc1cc(Nc2c([O-])c(Br)ccc2Cl)c(F)cn1 ZINC001175692926 1051704854 /nfs/dbraw/zinc/70/48/54/1051704854.db2.gz QQAGDVIROUOTFP-UHFFFAOYSA-N -1 1 347.571 4.094 20 0 EIADMM Cc1nc2cc(Cl)c(NC(=O)c3c(F)ccc([O-])c3F)cc2o1 ZINC001192541520 1051763800 /nfs/dbraw/zinc/76/38/00/1051763800.db2.gz XPMPKCXHXMKTCM-UHFFFAOYSA-N -1 1 338.697 4.026 20 0 EIADMM COCCOc1ccc(Nc2ccc(Cl)c(Cl)c2[O-])cc1 ZINC001175789994 1051788129 /nfs/dbraw/zinc/78/81/29/1051788129.db2.gz IDRJIWMCGMETLQ-UHFFFAOYSA-N -1 1 328.195 4.468 20 0 EIADMM O=C(N[C@@H](c1ccccc1)C1CCCC1)c1cc([O-])cc(F)c1F ZINC001192679342 1051790005 /nfs/dbraw/zinc/79/00/05/1051790005.db2.gz RWOAHWXVLMBSAR-SFHVURJKSA-N -1 1 331.362 4.332 20 0 EIADMM CN(C)C(=O)c1ccc(F)c(Nc2cc(Cl)cc(Cl)c2[O-])c1 ZINC001176046871 1051893928 /nfs/dbraw/zinc/89/39/28/1051893928.db2.gz UNJZBRZSRAOMMO-UHFFFAOYSA-N -1 1 343.185 4.284 20 0 EIADMM [O-]c1ccc(-c2nc(-c3ccc(C(F)(F)F)cc3Cl)no2)nn1 ZINC001205294181 1051990252 /nfs/dbraw/zinc/99/02/52/1051990252.db2.gz PIGWECZWQGOYIJ-UHFFFAOYSA-N -1 1 342.664 4.132 20 0 EIADMM [O-]c1c(Cl)cc(Br)cc1Nc1ccc2nonc2c1 ZINC001176326912 1051991362 /nfs/dbraw/zinc/99/13/62/1051991362.db2.gz LJQGPVKYZAMWBI-UHFFFAOYSA-N -1 1 340.564 4.088 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2cccc([C@@H](C)O)c2)c2ccccc12 ZINC001193825007 1052004272 /nfs/dbraw/zinc/00/42/72/1052004272.db2.gz REUVFRZJGVYEOJ-CQSZACIVSA-N -1 1 341.432 4.002 20 0 EIADMM COc1cccc([N-]S(=O)(=O)c2ccc(C)c3ccccc32)c1C ZINC001193856247 1052015061 /nfs/dbraw/zinc/01/50/61/1052015061.db2.gz CAVSDIVCOJJUNC-UHFFFAOYSA-N -1 1 341.432 4.266 20 0 EIADMM COc1ccc([N-]S(=O)(=O)c2ccc(C)c3ccccc32)cc1C ZINC001193862695 1052018707 /nfs/dbraw/zinc/01/87/07/1052018707.db2.gz FBMICCDRNMTHLQ-UHFFFAOYSA-N -1 1 341.432 4.266 20 0 EIADMM COc1cccc(F)c1[N-]S(=O)(=O)c1ccc(C)c2ccccc21 ZINC001193865323 1052019727 /nfs/dbraw/zinc/01/97/27/1052019727.db2.gz ZDIQZQWYQIGSFD-UHFFFAOYSA-N -1 1 345.395 4.097 20 0 EIADMM [O-]c1cc(F)cc(F)c1Nc1cccc2c1cnn2[C@H]1CCCCO1 ZINC001176314433 1052020265 /nfs/dbraw/zinc/02/02/65/1052020265.db2.gz AQOPYUMWMYEDDN-QGZVFWFLSA-N -1 1 345.349 4.463 20 0 EIADMM O=C(OCc1coc(-c2ccc(Cl)cc2)n1)c1ccc([O-])cc1F ZINC000773569217 1052037732 /nfs/dbraw/zinc/03/77/32/1052037732.db2.gz KEWMMPWRQFHKKG-UHFFFAOYSA-N -1 1 347.729 4.197 20 0 EIADMM O=S(=O)([N-]c1ccc(F)cc1)c1ccc(-c2cccs2)cc1 ZINC001194131410 1052080808 /nfs/dbraw/zinc/08/08/08/1052080808.db2.gz WWKZQJXNADZICM-UHFFFAOYSA-N -1 1 333.409 4.355 20 0 EIADMM CCOC(=O)c1cc(C)sc1Nc1c(F)cc(F)c([O-])c1F ZINC001176663646 1052157489 /nfs/dbraw/zinc/15/74/89/1052157489.db2.gz JRTQQSCHYSHWGR-UHFFFAOYSA-N -1 1 331.315 4.100 20 0 EIADMM [O-]c1c(F)cc(F)c(Nc2cc(O)ccc2Br)c1F ZINC001176671717 1052160069 /nfs/dbraw/zinc/16/00/69/1052160069.db2.gz MMLSJFUKJGQVLW-UHFFFAOYSA-N -1 1 334.091 4.021 20 0 EIADMM C=Cc1ccc([N-]S(=O)(=O)c2cccc3c(Cl)nccc32)cc1 ZINC001194491161 1052160212 /nfs/dbraw/zinc/16/02/12/1052160212.db2.gz WZVDNHKZILZBNL-UHFFFAOYSA-N -1 1 344.823 4.332 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)Oc1ccc(Br)cc1 ZINC001194598827 1052175043 /nfs/dbraw/zinc/17/50/43/1052175043.db2.gz IGFSLDHGSIVTFV-UHFFFAOYSA-N -1 1 342.576 4.419 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2c(C)cccc2C)c(C(F)(F)F)c1 ZINC001194643067 1052184114 /nfs/dbraw/zinc/18/41/14/1052184114.db2.gz HPSJOWCUFCLRTC-UHFFFAOYSA-N -1 1 343.370 4.431 20 0 EIADMM O=S(=O)([N-]c1ccccc1C1CC1)c1ccc(-c2cnco2)cc1 ZINC001185186061 1052189536 /nfs/dbraw/zinc/18/95/36/1052189536.db2.gz PUSJDKFYDKHLFN-UHFFFAOYSA-N -1 1 340.404 4.020 20 0 EIADMM Cc1cccc(C)c1S(=O)(=O)[N-]c1cnc2cccc(Cl)c2c1 ZINC001194616074 1052190211 /nfs/dbraw/zinc/19/02/11/1052190211.db2.gz NJOUCISASUYLHY-UHFFFAOYSA-N -1 1 346.839 4.306 20 0 EIADMM O=S(=O)([N-]c1ccc(Oc2ccccc2)cc1)c1ccsc1 ZINC001185340961 1052224267 /nfs/dbraw/zinc/22/42/67/1052224267.db2.gz QLKDNUUUUKJFMG-UHFFFAOYSA-N -1 1 331.418 4.341 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2ccc3c(C)ccnc3c2)ccc1Cl ZINC001185529708 1052257090 /nfs/dbraw/zinc/25/70/90/1052257090.db2.gz LKXKPVUKHTZEII-UHFFFAOYSA-N -1 1 346.839 4.306 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2cc(C)c(F)c(F)c2)ccc1Cl ZINC001185532822 1052258920 /nfs/dbraw/zinc/25/89/20/1052258920.db2.gz UKERKSXZXITLGQ-UHFFFAOYSA-N -1 1 331.771 4.036 20 0 EIADMM C[C@H](C1CCCCC1)N(C)C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000622586842 1052338285 /nfs/dbraw/zinc/33/82/85/1052338285.db2.gz MRVBMCFIKFREEB-LLVKDONJSA-N -1 1 329.362 4.452 20 0 EIADMM CSc1cc(Cl)ccc1[N-]C(=O)c1snnc1C1CC1 ZINC000622904343 1052537066 /nfs/dbraw/zinc/53/70/66/1052537066.db2.gz ADBTWLVMXJPGPU-UHFFFAOYSA-N -1 1 325.846 4.043 20 0 EIADMM CC(C)c1ncc(Cl)c(C(=O)[N-]c2c(F)cc(Cl)cc2F)n1 ZINC000180333700 1052794273 /nfs/dbraw/zinc/79/42/73/1052794273.db2.gz ILPXVCVMQVYROM-UHFFFAOYSA-N -1 1 346.164 4.437 20 0 EIADMM CC(C)=CC[C@H](NCc1ccc(-c2ccc(Cl)cc2)o1)C(=O)[O-] ZINC000864528230 1053305674 /nfs/dbraw/zinc/30/56/74/1053305674.db2.gz MCLCKPQXOSJDKN-INIZCTEOSA-N -1 1 333.815 4.499 20 0 EIADMM CCOc1cccc(F)c1[N-]S(=O)(=O)c1cccc(C(C)C)c1 ZINC001195158865 1053308524 /nfs/dbraw/zinc/30/85/24/1053308524.db2.gz HKHGMWSXKVSTPI-UHFFFAOYSA-N -1 1 337.416 4.149 20 0 EIADMM Cc1cc(NC(=O)c2cc([O-])cnc2Cl)cc(C(F)(F)F)c1 ZINC001195308409 1053369864 /nfs/dbraw/zinc/36/98/64/1053369864.db2.gz DCOGTHBGDYHHIW-UHFFFAOYSA-N -1 1 330.693 4.020 20 0 EIADMM Cc1ccc([O-])c(C(=O)Nc2ccc(C(C)C)cc2C(F)(F)F)n1 ZINC001195329490 1053371605 /nfs/dbraw/zinc/37/16/05/1053371605.db2.gz DVTZRIUGQVNWMX-UHFFFAOYSA-N -1 1 338.329 4.490 20 0 EIADMM C[C@H]1CC(C)(C)c2cccc(NC(=O)c3cc([O-])cnc3Cl)c21 ZINC001195306614 1053371797 /nfs/dbraw/zinc/37/17/97/1053371797.db2.gz VIARFKXIUDIYQF-JTQLQIEISA-N -1 1 330.815 4.478 20 0 EIADMM Cc1cccc(Cl)c1S(=O)(=O)[N-]c1c(C)cc(F)cc1C ZINC001195315729 1053373577 /nfs/dbraw/zinc/37/35/77/1053373577.db2.gz HKLKJHNPASZATH-UHFFFAOYSA-N -1 1 327.808 4.205 20 0 EIADMM COc1cc(C)c([N-]S(=O)(=O)c2c(C)cccc2Cl)cc1C ZINC001195316952 1053374473 /nfs/dbraw/zinc/37/44/73/1053374473.db2.gz YLONIXZTBVIALK-UHFFFAOYSA-N -1 1 339.844 4.075 20 0 EIADMM CCOC(=O)NC(=S)[N-]c1cc(Cl)c(Cl)cc1Cl ZINC001195486566 1053421368 /nfs/dbraw/zinc/42/13/68/1053421368.db2.gz HWERFOHULAROHA-UHFFFAOYSA-N -1 1 327.620 4.090 20 0 EIADMM CCOC(=O)NC(=S)[N-]c1ccc(Br)cc1C(C)C ZINC001195492185 1053422648 /nfs/dbraw/zinc/42/26/48/1053422648.db2.gz FKZYJKZJBXETEA-UHFFFAOYSA-N -1 1 345.262 4.015 20 0 EIADMM CC(C)(C)SCCCSc1nc(=O)cc([O-])n1C1CCCC1 ZINC000865353579 1053481877 /nfs/dbraw/zinc/48/18/77/1053481877.db2.gz PQMRHRQRSKVPLN-UHFFFAOYSA-N -1 1 342.530 4.078 20 0 EIADMM CC(C)(C)SCCCSc1nc([O-])cc(=O)n1C1CCCC1 ZINC000865353579 1053481882 /nfs/dbraw/zinc/48/18/82/1053481882.db2.gz PQMRHRQRSKVPLN-UHFFFAOYSA-N -1 1 342.530 4.078 20 0 EIADMM Cc1ccc(F)cc1NC(=S)Nc1cc([O-])c(Cl)cc1F ZINC001195912526 1053525387 /nfs/dbraw/zinc/52/53/87/1053525387.db2.gz VMDKSCMEBOZDEA-UHFFFAOYSA-N -1 1 328.771 4.441 20 0 EIADMM [O-]c1cc(F)ccc1NC(=S)Nc1ccc(C(F)(F)F)cc1 ZINC001196186337 1053599289 /nfs/dbraw/zinc/59/92/89/1053599289.db2.gz CDPDSAPOMAZHTP-UHFFFAOYSA-N -1 1 330.306 4.359 20 0 EIADMM Cc1cc(-n2c(C)cc(C(=O)Nc3ccc([O-])c(Cl)c3)c2C)no1 ZINC000111668184 1053719264 /nfs/dbraw/zinc/71/92/64/1053719264.db2.gz QKTVICDAYARBCN-UHFFFAOYSA-N -1 1 345.786 4.002 20 0 EIADMM O=C(/C=C/c1nc2ccccc2s1)Nc1ccc([O-])c(Cl)c1 ZINC000111667432 1053719434 /nfs/dbraw/zinc/71/94/34/1053719434.db2.gz BBOSAWHGKZITKK-BQYQJAHWSA-N -1 1 330.796 4.307 20 0 EIADMM COc1cc(C)c(S(=O)(=O)[N-]c2ccccc2C(F)F)c(C)c1 ZINC001196877750 1053786630 /nfs/dbraw/zinc/78/66/30/1053786630.db2.gz QLFBCZOWAMCYJF-UHFFFAOYSA-N -1 1 341.379 4.050 20 0 EIADMM [O-]c1c(F)cc(F)cc1NC(=S)Nc1ccccc1C(F)(F)F ZINC001197271826 1053866567 /nfs/dbraw/zinc/86/65/67/1053866567.db2.gz AJIDRIPCPGOXDU-UHFFFAOYSA-N -1 1 348.296 4.498 20 0 EIADMM O=C(Nc1ccc(-c2cc[nH]n2)cc1)c1cc2ccccc2cc1[O-] ZINC000029278433 1053999833 /nfs/dbraw/zinc/99/98/33/1053999833.db2.gz BGARBRZGZJZMNE-UHFFFAOYSA-N -1 1 329.359 4.188 20 0 EIADMM Cc1cc2cc([N-]S(=O)(=O)c3cc(Cl)ccc3C)ccc2[nH]1 ZINC000031721822 1054076875 /nfs/dbraw/zinc/07/68/75/1054076875.db2.gz RHJIIRPDNKKQJZ-UHFFFAOYSA-N -1 1 334.828 4.239 20 0 EIADMM CCC(CC)c1nnc([N-]C(=O)c2oc3c(c2C)C(=O)CCC3)s1 ZINC000041689358 1054148210 /nfs/dbraw/zinc/14/82/10/1054148210.db2.gz XLTHOUZYKNAMHY-UHFFFAOYSA-N -1 1 347.440 4.114 20 0 EIADMM Cc1c(=O)[n-]c(SC[C@H]2CC3(CCC3)CO2)nc1-c1ccccc1 ZINC000871667382 1054243888 /nfs/dbraw/zinc/24/38/88/1054243888.db2.gz JLOHETSRCNFXER-OAHLLOKOSA-N -1 1 342.464 4.209 20 0 EIADMM O=C([N-][C@H](C1CCCCC1)C(F)(F)F)C(F)(F)Cc1ccccc1 ZINC000857462708 1054254723 /nfs/dbraw/zinc/25/47/23/1054254723.db2.gz MRHAVIXHTNXNAS-CQSZACIVSA-N -1 1 349.343 4.492 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2ccc3occc3c2)c2cccnc12 ZINC001198862340 1054287711 /nfs/dbraw/zinc/28/77/11/1054287711.db2.gz RKTXUFCTMACHOP-UHFFFAOYSA-N -1 1 338.388 4.090 20 0 EIADMM CC(C)Cc1ccccc1[N-]S(=O)(=O)c1ccc2occc2c1 ZINC001198867811 1054294388 /nfs/dbraw/zinc/29/43/88/1054294388.db2.gz AYRMQBWQLSWGHH-UHFFFAOYSA-N -1 1 329.421 4.432 20 0 EIADMM Cc1cc(Br)c([O-])c(NC(=O)[C@@H]2C[C@@H]3C[C@@H]3C[C@@H]2C)c1 ZINC001152518662 1054315947 /nfs/dbraw/zinc/31/59/47/1054315947.db2.gz UEZCDDILLFOCLP-FIQHERPVSA-N -1 1 338.245 4.084 20 0 EIADMM O=c1nc(N2CCC[C@H](CCCc3ccccc3)C2)cc(Cl)[n-]1 ZINC000858455130 1054493123 /nfs/dbraw/zinc/49/31/23/1054493123.db2.gz RTNLOVMERZVDIQ-HNNXBMFYSA-N -1 1 331.847 4.075 20 0 EIADMM CCCCCCNC(=S)Nc1cc(Br)cc(F)c1[O-] ZINC001200957434 1054607665 /nfs/dbraw/zinc/60/76/65/1054607665.db2.gz RQSKOPWIOJJLKP-UHFFFAOYSA-N -1 1 349.269 4.161 20 0 EIADMM COc1cc(OC(F)(F)F)ccc1Nc1cc(F)c([O-])c(F)c1 ZINC001201360279 1054759304 /nfs/dbraw/zinc/75/93/04/1054759304.db2.gz FVYVJXWYAVMOIO-UHFFFAOYSA-N -1 1 335.228 4.321 20 0 EIADMM Cc1cc(C)c([N-]S(=O)(=O)c2c(C)c(C)c(C)c(C)c2C)cn1 ZINC001201792437 1054905473 /nfs/dbraw/zinc/90/54/73/1054905473.db2.gz HJBOZZQUSLPZKE-UHFFFAOYSA-N -1 1 332.469 4.041 20 0 EIADMM O=C(Nc1ccc(C(F)(F)F)cc1)Nc1c(F)cc([O-])cc1F ZINC001202412100 1055162240 /nfs/dbraw/zinc/16/22/40/1055162240.db2.gz HQWGFYCXTURRNH-UHFFFAOYSA-N -1 1 332.228 4.333 20 0 EIADMM Cc1nc(C(C)C)[n-]c(=O)c1C(=O)Nc1cccc(C2CCC2)c1 ZINC000794509990 1055181608 /nfs/dbraw/zinc/18/16/08/1055181608.db2.gz HFUGMEKMWPJDDD-UHFFFAOYSA-N -1 1 325.412 4.134 20 0 EIADMM CC(C)[C@H]1c2ccccc2CC[N@@H+]1Cc1nnc(-c2ccccc2O)o1 ZINC000878195127 1055200815 /nfs/dbraw/zinc/20/08/15/1055200815.db2.gz NVAYWVNXVGSFJU-FQEVSTJZSA-N -1 1 349.434 4.198 20 0 EIADMM COc1ccccc1N[C@H](C)c1cc(Br)cc(F)c1[O-] ZINC000186236220 1055258907 /nfs/dbraw/zinc/25/89/07/1055258907.db2.gz SHHZYACQPKZRKZ-SECBINFHSA-N -1 1 340.192 4.476 20 0 EIADMM Oc1ccccc1-c1nnc(C[NH2+][C@@H](CC2CCC2)c2ccccc2)o1 ZINC000878383181 1055282069 /nfs/dbraw/zinc/28/20/69/1055282069.db2.gz KIRPGEDVYZLDQQ-SFHVURJKSA-N -1 1 349.434 4.463 20 0 EIADMM CSc1nsc([N-]C(=O)c2sc3ccccc3c2Cl)n1 ZINC000127142399 1055321332 /nfs/dbraw/zinc/32/13/32/1055321332.db2.gz JWZDOOFRIOFGIP-UHFFFAOYSA-N -1 1 341.870 4.380 20 0 EIADMM Cc1oc2c(ccc([O-])c2C[N@H+](C)C2CC2)c(=O)c1-c1ccccc1 ZINC000073586253 1055430384 /nfs/dbraw/zinc/43/03/84/1055430384.db2.gz VETXPAMSFOCONY-UHFFFAOYSA-N -1 1 335.403 4.068 20 0 EIADMM Cc1oc2c(ccc([O-])c2CN(C)C2CC2)c(=O)c1-c1ccccc1 ZINC000073586253 1055430395 /nfs/dbraw/zinc/43/03/95/1055430395.db2.gz VETXPAMSFOCONY-UHFFFAOYSA-N -1 1 335.403 4.068 20 0 EIADMM CC(=O)c1cc(-c2nc(-c3ccc(Oc4ccccc4)cc3)no2)n[n-]1 ZINC001212429744 1055922729 /nfs/dbraw/zinc/92/27/29/1055922729.db2.gz NRRFHFHOBBTABU-UHFFFAOYSA-N -1 1 346.346 4.122 20 0 EIADMM CC(=O)c1cc(-c2nc(-c3ccc(Oc4ccccc4)cc3)no2)[n-]n1 ZINC001212429744 1055922742 /nfs/dbraw/zinc/92/27/42/1055922742.db2.gz NRRFHFHOBBTABU-UHFFFAOYSA-N -1 1 346.346 4.122 20 0 EIADMM CC(C)CCC[N-]S(=O)(=O)c1c(Cl)cccc1C(F)(F)F ZINC000303798313 1056298952 /nfs/dbraw/zinc/29/89/52/1056298952.db2.gz JDOLMXTYAMEEQT-UHFFFAOYSA-N -1 1 343.798 4.073 20 0 EIADMM Cc1cc(Nc2cc(F)c([O-])c(Cl)c2)cnc1Br ZINC001214480628 1056715735 /nfs/dbraw/zinc/71/57/35/1056715735.db2.gz VUKXORZVGJLLTB-UHFFFAOYSA-N -1 1 331.572 4.394 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1occc1COc1ccccc1 ZINC000111668245 1056812162 /nfs/dbraw/zinc/81/21/62/1056812162.db2.gz IMVBQUODMCJHMP-UHFFFAOYSA-N -1 1 343.766 4.470 20 0 EIADMM C[C@@H]([N-]C(=O)C(F)(F)c1ccc(F)cc1)c1cccc(F)c1F ZINC000766630626 1060712230 /nfs/dbraw/zinc/71/22/30/1060712230.db2.gz YPEWJPOAVGHFIP-SECBINFHSA-N -1 1 329.268 4.073 20 0 EIADMM Cc1cc(C(C)(C)C)ccc1OCCCC(=O)[N-]OCC(F)(F)F ZINC000766764152 1060884257 /nfs/dbraw/zinc/88/42/57/1060884257.db2.gz VRVQQEMZGCIENA-UHFFFAOYSA-N -1 1 347.377 4.062 20 0 EIADMM CCc1cc(=O)[n-]c(SCc2cc3ccccc3c(Cl)n2)n1 ZINC000767057051 1061093053 /nfs/dbraw/zinc/09/30/53/1061093053.db2.gz CMOPWYHSDUWNGG-UHFFFAOYSA-N -1 1 331.828 4.239 20 0 EIADMM CC1CCN(c2ccc(NC(=O)c3ccc([O-])c(F)c3)cc2)CC1 ZINC000767297224 1061186218 /nfs/dbraw/zinc/18/62/18/1061186218.db2.gz UJYCWVSBRPZXRD-UHFFFAOYSA-N -1 1 328.387 4.020 20 0 EIADMM C[C@@H](NC(=O)c1ccc([O-])c(F)c1)c1ccccc1C(F)(F)F ZINC000767327262 1061199391 /nfs/dbraw/zinc/19/93/91/1061199391.db2.gz LEYHDPFQRAIVLS-SECBINFHSA-N -1 1 327.277 4.041 20 0 EIADMM Cc1ccc(F)cc1S(=O)(=O)[N-]c1ccc(OC(C)C)cc1C ZINC000614863588 1032102430 /nfs/dbraw/zinc/10/24/30/1032102430.db2.gz FQAPBBAKOKEITJ-UHFFFAOYSA-N -1 1 337.416 4.031 20 0 EIADMM COc1ccccc1C[C@@H](C)CC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000532749556 1032286947 /nfs/dbraw/zinc/28/69/47/1032286947.db2.gz RFVRUWUIAMKFKK-GFCCVEGCSA-N -1 1 333.815 4.262 20 0 EIADMM O=C(Nc1c([O-])cc(Br)cc1Cl)[C@@H]1CCCC12CC2 ZINC000529363319 1032328804 /nfs/dbraw/zinc/32/88/04/1032328804.db2.gz BKBOYIVQFHZPAV-VIFPVBQESA-N -1 1 344.636 4.327 20 0 EIADMM CCOc1cc(C(=O)N(C)[C@@H](C)c2ccccc2)cc(Cl)c1[O-] ZINC000178124372 1032529281 /nfs/dbraw/zinc/52/92/81/1032529281.db2.gz JJCPDDUZSAPVNB-LBPRGKRZSA-N -1 1 333.815 4.278 20 0 EIADMM C[C@H](NC(=O)c1ccc([O-])cc1F)c1ccc(-c2cccnc2)cc1 ZINC000181249547 1032650252 /nfs/dbraw/zinc/65/02/52/1032650252.db2.gz KAIIAUKQPCVCMR-ZDUSSCGKSA-N -1 1 336.366 4.084 20 0 EIADMM Cc1nc(-c2cccc([N-]S(=O)(=O)c3cccc(C)c3)c2)oc1C ZINC000108928809 1018790330 /nfs/dbraw/zinc/79/03/30/1018790330.db2.gz VHIBGIRJNXAUAG-UHFFFAOYSA-N -1 1 342.420 4.068 20 0 EIADMM Cc1cc(F)ccc1-c1ccc(CNCc2cccc(C(=O)[O-])c2)o1 ZINC000683176506 1019107927 /nfs/dbraw/zinc/10/79/27/1019107927.db2.gz LDURSNREGCNSGF-UHFFFAOYSA-N -1 1 339.366 4.382 20 0 EIADMM CCCCOc1ccc(CN[C@@H](C(=O)[O-])c2cc(F)ccc2F)cc1 ZINC000683174928 1019109614 /nfs/dbraw/zinc/10/96/14/1019109614.db2.gz SATUGPQZKYIZPG-GOSISDBHSA-N -1 1 349.377 4.059 20 0 EIADMM CCSCc1cccc([N-]S(=O)(=O)c2ccc(F)c(F)c2)c1 ZINC000610194096 1019206172 /nfs/dbraw/zinc/20/61/72/1019206172.db2.gz NBJMXFOGTRCXGT-UHFFFAOYSA-N -1 1 343.420 4.019 20 0 EIADMM Cc1nc(-c2ccc([N-]S(=O)(=O)c3ccc(C)cc3C)cc2)co1 ZINC000029433354 1019215403 /nfs/dbraw/zinc/21/54/03/1019215403.db2.gz CQYMINDKLMYTPC-UHFFFAOYSA-N -1 1 342.420 4.068 20 0 EIADMM Cc1nc(-c2ccc([N-]S(=O)(=O)c3cc(C)ccc3C)cc2)co1 ZINC000029433348 1019216491 /nfs/dbraw/zinc/21/64/91/1019216491.db2.gz JLXYHQQULPLIAJ-UHFFFAOYSA-N -1 1 342.420 4.068 20 0 EIADMM COCc1cccc([N-]S(=O)(=O)c2ccc(CCC(C)C)cc2)c1 ZINC000026547488 1019233110 /nfs/dbraw/zinc/23/31/10/1019233110.db2.gz ZLAGUKRLOSRRBJ-UHFFFAOYSA-N -1 1 347.480 4.222 20 0 EIADMM O=C(Cc1ccc([O-])c(Cl)c1)N(C1CC1)[C@H]1CCc2ccccc21 ZINC001625806894 1019654599 /nfs/dbraw/zinc/65/45/99/1019654599.db2.gz GYTKQIZNMXLAAU-SFHVURJKSA-N -1 1 341.838 4.267 20 0 EIADMM Cc1c(Cl)c(CN2CCC(CCC(=O)[O-])CC2)nc2ccccc12 ZINC000324285598 1019868078 /nfs/dbraw/zinc/86/80/78/1019868078.db2.gz QIMDWPWGUHMOLD-UHFFFAOYSA-N -1 1 346.858 4.273 20 0 EIADMM COC(=O)[C@@H](C)Cc1ccc(NCc2cccc([O-])c2Cl)cc1 ZINC000512511177 1032965536 /nfs/dbraw/zinc/96/55/36/1032965536.db2.gz CXDGQKRDSXCDRQ-LBPRGKRZSA-N -1 1 333.815 4.009 20 0 EIADMM CCOc1cc(C(=O)N(CC)Cc2occc2C)cc(Cl)c1[O-] ZINC000413983038 1021568971 /nfs/dbraw/zinc/56/89/71/1021568971.db2.gz SAZLTGFUDXBCTA-UHFFFAOYSA-N -1 1 337.803 4.008 20 0 EIADMM COc1c(F)c(F)c(Nc2cc([O-])c(Cl)cc2F)c(F)c1F ZINC001210763455 1021624002 /nfs/dbraw/zinc/62/40/02/1021624002.db2.gz LUJWGQCRXOLGEH-UHFFFAOYSA-N -1 1 339.647 4.493 20 0 EIADMM CC(C)[C@@H]1CN([C@H](C(=O)[O-])c2cccc(Cl)c2Cl)CCS1 ZINC000580085806 1021626564 /nfs/dbraw/zinc/62/65/64/1021626564.db2.gz UJGQBJBZZLPPMX-JSGCOSHPSA-N -1 1 348.295 4.193 20 0 EIADMM COc1cc(CN(C)[C@H](C)c2cc(C)c(C(=O)[O-])o2)ccc1SC ZINC000580456603 1022044345 /nfs/dbraw/zinc/04/43/45/1022044345.db2.gz JMWUTOCBMLEEGN-GFCCVEGCSA-N -1 1 349.452 4.210 20 0 EIADMM O=c1nc(-c2cccc([O-])c2Cl)[nH]c2sc3c(c21)CCCC3 ZINC000414197445 1022098430 /nfs/dbraw/zinc/09/84/30/1022098430.db2.gz WMDJTXISFOYDLZ-UHFFFAOYSA-N -1 1 332.812 4.302 20 0 EIADMM CSc1cc(O)ccc1NC(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000754494853 1022171754 /nfs/dbraw/zinc/17/17/54/1022171754.db2.gz PNUHJZOWHXMMTE-UHFFFAOYSA-N -1 1 343.326 4.091 20 0 EIADMM [O-]c1c(-c2nc(COCc3ccccc3)no2)ccc2ccccc21 ZINC000395525358 1022356110 /nfs/dbraw/zinc/35/61/10/1022356110.db2.gz MAGRROSOLPMEPA-UHFFFAOYSA-N -1 1 332.359 4.312 20 0 EIADMM CSc1ccc(Cl)cc1[N-]S(=O)(=O)CCc1cccs1 ZINC000685900059 1022383650 /nfs/dbraw/zinc/38/36/50/1022383650.db2.gz BFLGOZSZJFYFHE-UHFFFAOYSA-N -1 1 347.914 4.108 20 0 EIADMM CCOc1cc(C(=O)Nc2ccc(C)cc2OCC)cc(Cl)c1[O-] ZINC000186655868 1022707140 /nfs/dbraw/zinc/70/71/40/1022707140.db2.gz WXHKJGVKZGNGIO-UHFFFAOYSA-N -1 1 349.814 4.404 20 0 EIADMM CC(C)n1ccc(C(=O)Nc2cc(Cl)c([O-])c3ccccc23)n1 ZINC001167439719 1022730415 /nfs/dbraw/zinc/73/04/15/1022730415.db2.gz FUIBZQANKCXXOY-UHFFFAOYSA-N -1 1 329.787 4.229 20 0 EIADMM CCc1ncc(C(=O)Nc2cc(Cl)c([O-])c3ccccc23)s1 ZINC001167440516 1022763635 /nfs/dbraw/zinc/76/36/35/1022763635.db2.gz WEGVGAVVZNRFKD-UHFFFAOYSA-N -1 1 332.812 4.470 20 0 EIADMM COc1cc(C(=O)N2c3ccccc3CC[C@H]2C)cc(Cl)c1[O-] ZINC000647142047 1022834063 /nfs/dbraw/zinc/83/40/63/1022834063.db2.gz OODNHLIZALUNNI-LLVKDONJSA-N -1 1 331.799 4.036 20 0 EIADMM Cc1c(=O)[n-]c(SCc2cccnc2Cl)nc1-c1ccccc1 ZINC000163939288 1022880614 /nfs/dbraw/zinc/88/06/14/1022880614.db2.gz WXRFTILKNKHHFF-UHFFFAOYSA-N -1 1 343.839 4.086 20 0 EIADMM O=S(=O)([N-][C@@H]1CC=CCC1)c1c(Cl)cc(Cl)cc1Cl ZINC000605593684 1022942813 /nfs/dbraw/zinc/94/28/13/1022942813.db2.gz WQPCSTXJLBMYAK-SECBINFHSA-N -1 1 340.659 4.034 20 0 EIADMM Cc1oc(-c2ccccc2)nc1CSc1nc(C(F)F)cc(=O)[n-]1 ZINC000581279118 1022959711 /nfs/dbraw/zinc/95/97/11/1022959711.db2.gz MXALYKSZXCCJTJ-UHFFFAOYSA-N -1 1 349.362 4.376 20 0 EIADMM Cc1nc(-c2ccc([N-]S(=O)(=O)c3cccc(F)c3)cc2)cs1 ZINC000007726294 1023079110 /nfs/dbraw/zinc/07/91/10/1023079110.db2.gz TZGJVSQPZQXQKR-UHFFFAOYSA-N -1 1 348.424 4.058 20 0 EIADMM CCOc1cc(C(=O)N2CC3(CC3)c3ccccc32)cc(Cl)c1[O-] ZINC000186827355 1023170578 /nfs/dbraw/zinc/17/05/78/1023170578.db2.gz QZNCBQQCLMKPBS-UHFFFAOYSA-N -1 1 343.810 4.136 20 0 EIADMM O=c1nc([C@H]2CCCO2)[n-]c2scc(-c3ccccc3Cl)c21 ZINC000178983994 1023194001 /nfs/dbraw/zinc/19/40/01/1023194001.db2.gz JKEZWZCZVGCFBI-GFCCVEGCSA-N -1 1 332.812 4.157 20 0 EIADMM O=C(N[C@@H](Cc1ccccc1)c1cccs1)c1ccc([O-])cc1F ZINC000181223396 1023235620 /nfs/dbraw/zinc/23/56/20/1023235620.db2.gz VJPHGRCMNRASBH-KRWDZBQOSA-N -1 1 341.407 4.307 20 0 EIADMM Cc1nc(C(C)C)sc1[C@@H](C)[N@@H+](C)Cc1ccccc1C(=O)[O-] ZINC000584724428 1023245614 /nfs/dbraw/zinc/24/56/14/1023245614.db2.gz BZCRUCCOGTVGER-CYBMUJFWSA-N -1 1 332.469 4.466 20 0 EIADMM CCc1cccc2cc(CN[C@@H](C(=O)[O-])[C@H](C)c3ccccc3)oc21 ZINC000656570335 1023248831 /nfs/dbraw/zinc/24/88/31/1023248831.db2.gz XPXLWDAGBYEKES-AUUYWEPGSA-N -1 1 337.419 4.342 20 0 EIADMM O=C(CSc1nc2ccccc2n1C(F)F)c1ccc([O-])cc1 ZINC000031782034 1023256167 /nfs/dbraw/zinc/25/61/67/1023256167.db2.gz QHSMQGVQQCQCRD-UHFFFAOYSA-N -1 1 334.347 4.112 20 0 EIADMM Cc1cc2cc(CN[C@H](CCc3ccccc3)C(=O)[O-])oc2cc1C ZINC000417604055 1023369483 /nfs/dbraw/zinc/36/94/83/1023369483.db2.gz TUTIVPMLNQVJKZ-LJQANCHMSA-N -1 1 337.419 4.225 20 0 EIADMM CCOc1c(Cl)cccc1CN[C@H]1C[C@@H](C(=O)[O-])c2ccccc21 ZINC000417624518 1023386505 /nfs/dbraw/zinc/38/65/05/1023386505.db2.gz KWVCHFGFNBQDHH-WBVHZDCISA-N -1 1 345.826 4.142 20 0 EIADMM Cc1cc(F)ccc1-c1ccc(CN[C@@H](CC2CCC2)C(=O)[O-])o1 ZINC000417714430 1023414774 /nfs/dbraw/zinc/41/47/74/1023414774.db2.gz ZUOBKSXBLFHJME-KRWDZBQOSA-N -1 1 331.387 4.127 20 0 EIADMM O=C(/C=C\c1nc2ccccc2s1)Nc1ccc([O-])c(Cl)c1 ZINC000255337617 1023466620 /nfs/dbraw/zinc/46/66/20/1023466620.db2.gz BBOSAWHGKZITKK-FPLPWBNLSA-N -1 1 330.796 4.307 20 0 EIADMM COc1ccc(C(C)C)cc1CN1CC[C@H](C(=O)[O-])[C@@H]2CCCC[C@H]21 ZINC000656768007 1023510973 /nfs/dbraw/zinc/51/09/73/1023510973.db2.gz UCYHGTMSBJBPKF-GBESFXJTSA-N -1 1 345.483 4.284 20 0 EIADMM COC1(CSc2nc(-c3ccccc3)c(C)c(=O)[n-]2)CCCC1 ZINC000276529093 1023650205 /nfs/dbraw/zinc/65/02/05/1023650205.db2.gz FWUYHNRKDSVUJD-UHFFFAOYSA-N -1 1 330.453 4.209 20 0 EIADMM O=S(=O)([N-]c1cc(Cl)ccc1Cl)c1cc(F)ccc1F ZINC000008104882 1023685123 /nfs/dbraw/zinc/68/51/23/1023685123.db2.gz OTFKEUQNDHUIAT-UHFFFAOYSA-N -1 1 338.162 4.072 20 0 EIADMM CCC(CC)(CNC(=O)c1ccc(F)c([O-])c1)c1ccc(F)cc1 ZINC001167721084 1023702805 /nfs/dbraw/zinc/70/28/05/1023702805.db2.gz ZMYIKKQBTNVONR-UHFFFAOYSA-N -1 1 333.378 4.158 20 0 EIADMM COc1ccc(N(CCC(C)C)C(=O)c2ccc([O-])c(F)c2)cc1 ZINC000684508484 1024038724 /nfs/dbraw/zinc/03/87/24/1024038724.db2.gz SDGLHQNOGHVHQP-UHFFFAOYSA-N -1 1 331.387 4.233 20 0 EIADMM C[C@H](CC[N-]S(=O)(=O)c1cc2cc(F)ccc2o1)CC(C)(C)C ZINC001211526109 1024523690 /nfs/dbraw/zinc/52/36/90/1024523690.db2.gz PYDIQQMJSVDMRM-GFCCVEGCSA-N -1 1 341.448 4.313 20 0 EIADMM Cc1ccc(Cl)cc1[N-]S(=O)(=O)c1cccc(Cl)c1C ZINC000048653301 1024671660 /nfs/dbraw/zinc/67/16/60/1024671660.db2.gz CTUIENHHSRHXLL-UHFFFAOYSA-N -1 1 330.236 4.411 20 0 EIADMM Cc1cc([C@H](C)N2CC[C@@H](Oc3ccccc3Cl)C2)oc1C(=O)[O-] ZINC000652434840 1024829908 /nfs/dbraw/zinc/82/99/08/1024829908.db2.gz GBWKAHGQUWGLLF-QWHCGFSZSA-N -1 1 349.814 4.154 20 0 EIADMM [O-]c1ccc(Oc2ccccc2)cc1-c1nc(-c2ccncc2)no1 ZINC000184863718 1024980399 /nfs/dbraw/zinc/98/03/99/1024980399.db2.gz KYWPJBMEZMWJJS-UHFFFAOYSA-N -1 1 331.331 4.297 20 0 EIADMM C[C@H](NC(=O)c1ccc(C(F)(F)F)cc1[O-])[C@H]1CCC[C@@H](C)C1 ZINC001626589424 1025206235 /nfs/dbraw/zinc/20/62/35/1025206235.db2.gz QPTVBXMJJBSINA-WOPDTQHZSA-N -1 1 329.362 4.356 20 0 EIADMM Fc1ccc([N-]c2nnc(Br)s2)c(C(F)(F)F)c1 ZINC000709655824 1025262596 /nfs/dbraw/zinc/26/25/96/1025262596.db2.gz DKIYVZLOEHUEBM-UHFFFAOYSA-N -1 1 342.115 4.202 20 0 EIADMM CCc1nc(SCc2nc(-c3ccccc3)oc2C)[n-]c(=O)c1C ZINC000657263904 1025454875 /nfs/dbraw/zinc/45/48/75/1025454875.db2.gz FCKDRECNFXMFQF-UHFFFAOYSA-N -1 1 341.436 4.309 20 0 EIADMM Cc1cc(N(C)C)ccc1[N-]S(=O)(=O)c1csc2ccccc21 ZINC000506834069 1025846533 /nfs/dbraw/zinc/84/65/33/1025846533.db2.gz XCKQKJRAHAHGGY-UHFFFAOYSA-N -1 1 346.477 4.077 20 0 EIADMM COc1ccc(S[C@H](C)C(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000111667007 1026314032 /nfs/dbraw/zinc/31/40/32/1026314032.db2.gz VWAHTWVBMCGYEE-SNVBAGLBSA-N -1 1 337.828 4.174 20 0 EIADMM CC[C@@]1(C(=O)[O-])CCCN(Cc2cc(Cl)ccc2OC(F)F)C1 ZINC000391050321 1026314647 /nfs/dbraw/zinc/31/46/47/1026314647.db2.gz XDMUKXHGJNVGKA-MRXNPFEDSA-N -1 1 347.789 4.018 20 0 EIADMM CSc1ccc(C(=O)[N-]c2nc(Sc3ccccc3)ns2)o1 ZINC000112296129 1026454292 /nfs/dbraw/zinc/45/42/92/1026454292.db2.gz MORIBBNYQCDHMD-UHFFFAOYSA-N -1 1 349.462 4.257 20 0 EIADMM O=C(Nc1cccc(F)c1[O-])c1ccc(Br)c(Cl)c1 ZINC000707971457 1026471351 /nfs/dbraw/zinc/47/13/51/1026471351.db2.gz NHAHBPBIOCSSEA-UHFFFAOYSA-N -1 1 344.567 4.200 20 0 EIADMM Cc1nc(CNCc2ccc(-c3ccccc3)s2)sc1C(=O)[O-] ZINC000426681136 1026481997 /nfs/dbraw/zinc/48/19/97/1026481997.db2.gz VHHBYBFGHZDXPW-UHFFFAOYSA-N -1 1 344.461 4.168 20 0 EIADMM Cc1cc(C)cc([C@H](NCc2cc3ccccc3s2)C(=O)[O-])c1 ZINC000426748286 1026531444 /nfs/dbraw/zinc/53/14/44/1026531444.db2.gz WDKWOLNYSYTSAZ-SFHVURJKSA-N -1 1 325.433 4.434 20 0 EIADMM COc1cc(C(=O)N[C@H]2CCCc3ccc(C)cc32)cc(Cl)c1[O-] ZINC000344697697 1026548523 /nfs/dbraw/zinc/54/85/23/1026548523.db2.gz XTHVPKAAODFBMW-INIZCTEOSA-N -1 1 345.826 4.170 20 0 EIADMM Cc1c(F)cccc1-c1ccc(CN[C@H](CC(C)(C)C)C(=O)[O-])o1 ZINC000426776917 1026553730 /nfs/dbraw/zinc/55/37/30/1026553730.db2.gz IVCUMHYDYVRQLZ-MRXNPFEDSA-N -1 1 333.403 4.373 20 0 EIADMM O=C([O-])[C@@H](NCc1c(Cl)oc2ccccc21)c1ccc(F)cc1 ZINC000426812831 1026575772 /nfs/dbraw/zinc/57/57/72/1026575772.db2.gz SESXWNCFASFOQO-HNNXBMFYSA-N -1 1 333.746 4.141 20 0 EIADMM Cc1cc(C)cc(C[C@@H](NCc2ccc(-c3ccccc3)o2)C(=O)[O-])c1 ZINC000426825351 1026583855 /nfs/dbraw/zinc/58/38/55/1026583855.db2.gz QCPRRUFLJUELRE-HXUWFJFHSA-N -1 1 349.430 4.349 20 0 EIADMM CC(C)CCOc1ccc(CN[C@H](C(=O)[O-])c2ccccc2F)cc1 ZINC000426837247 1026585366 /nfs/dbraw/zinc/58/53/66/1026585366.db2.gz XURAUTRJFKOQQL-IBGZPJMESA-N -1 1 345.414 4.166 20 0 EIADMM Cc1cc2cc(NC(=O)c3ccc(C(F)(F)F)c([O-])c3)ccc2[nH]1 ZINC000684870546 1026632555 /nfs/dbraw/zinc/63/25/55/1026632555.db2.gz HQEYFAMKZYEOSM-UHFFFAOYSA-N -1 1 334.297 4.453 20 0 EIADMM O=C(c1ccc(C(F)(F)F)c([O-])c1)N(Cc1cccs1)C1CC1 ZINC000684870823 1026632690 /nfs/dbraw/zinc/63/26/90/1026632690.db2.gz RRRIDKXPZIESJB-UHFFFAOYSA-N -1 1 341.354 4.277 20 0 EIADMM O=C(NCc1ccc(Cl)s1)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684870740 1026634153 /nfs/dbraw/zinc/63/41/53/1026634153.db2.gz NCPKZGUJXWHACQ-UHFFFAOYSA-N -1 1 335.734 4.056 20 0 EIADMM O=C(Nc1ccccc1OC(F)F)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684871148 1026635642 /nfs/dbraw/zinc/63/56/42/1026635642.db2.gz WLIXDHJCVYXMFO-UHFFFAOYSA-N -1 1 347.239 4.265 20 0 EIADMM CN(C(=O)c1ccc(C(F)(F)F)c([O-])c1)[C@@H]1CCc2ccccc2C1 ZINC000684874870 1026648769 /nfs/dbraw/zinc/64/87/69/1026648769.db2.gz ZHQNJAVKJQRRFF-OAHLLOKOSA-N -1 1 349.352 4.041 20 0 EIADMM COC(=O)c1c[n-]c(SCc2ccc(-c3cccs3)cc2)n1 ZINC000432665165 1026696832 /nfs/dbraw/zinc/69/68/32/1026696832.db2.gz GYLICRGOASMGCU-UHFFFAOYSA-N -1 1 330.434 4.217 20 0 EIADMM COc1c(Br)cc(F)cc1Nc1ccc(F)c(F)c1[O-] ZINC001211715133 1026799156 /nfs/dbraw/zinc/79/91/56/1026799156.db2.gz HIOODMBCBQYGJA-UHFFFAOYSA-N -1 1 348.118 4.324 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2cc(C)c(F)cc2Cl)sc1C ZINC000507612741 1026854227 /nfs/dbraw/zinc/85/42/27/1026854227.db2.gz IBOFTWIUZDDDFH-UHFFFAOYSA-N -1 1 333.837 4.267 20 0 EIADMM CCc1nc(S[C@@H](C)Cc2ccc3ccccc3n2)[n-]c(=O)c1C ZINC000563438866 1026953390 /nfs/dbraw/zinc/95/33/90/1026953390.db2.gz JBCKDNZULDWXKL-LBPRGKRZSA-N -1 1 339.464 4.325 20 0 EIADMM O=C(c1ccccc1[O-])N1CCc2cc(-c3cccc(F)c3)ccc21 ZINC000440726171 1027028614 /nfs/dbraw/zinc/02/86/14/1027028614.db2.gz FMKQSBQLDMKVMJ-UHFFFAOYSA-N -1 1 333.362 4.401 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccccc2C(F)(F)F)c(C)c1 ZINC000014256066 1027153931 /nfs/dbraw/zinc/15/39/31/1027153931.db2.gz VAYISYOWPDCCFW-UHFFFAOYSA-N -1 1 329.343 4.123 20 0 EIADMM CCN(Cc1ccc(-c2ccc(C(F)(F)F)cc2)o1)[C@@H](C)C(=O)[O-] ZINC000262257547 1027236107 /nfs/dbraw/zinc/23/61/07/1027236107.db2.gz QKKUCXYTIQNZSX-NSHDSACASA-N -1 1 341.329 4.260 20 0 EIADMM C[C@H](C1CC1)n1cc([N-]c2nn3cc(C4CCCC4)nc3s2)cn1 ZINC000302554996 1027335914 /nfs/dbraw/zinc/33/59/14/1027335914.db2.gz ROCVZWGKFNKIHU-LLVKDONJSA-N -1 1 342.472 4.360 20 0 EIADMM CN(CC1(c2ccccc2)CC1)C(=O)c1ccc2ccccc2c1[O-] ZINC000444383075 1027477252 /nfs/dbraw/zinc/47/72/52/1027477252.db2.gz OVVHCZKUQSHCFO-UHFFFAOYSA-N -1 1 331.415 4.349 20 0 EIADMM COc1cc(C(=O)N2CCC[C@@]3(CC=CCC3)C2)cc(Cl)c1[O-] ZINC000153826650 1027981015 /nfs/dbraw/zinc/98/10/15/1027981015.db2.gz XISBMVGSQMGSEX-SFHVURJKSA-N -1 1 335.831 4.017 20 0 EIADMM Cc1cc(C)c(NC(=O)c2ccc([O-])cc2F)cc1Br ZINC000189219569 1028090660 /nfs/dbraw/zinc/09/06/60/1028090660.db2.gz PBTHQRAJOQVNBI-UHFFFAOYSA-N -1 1 338.176 4.163 20 0 EIADMM CC[C@@H](C)[C@H](C)[N-]S(=O)(=O)c1c(Cl)cccc1C(F)(F)F ZINC000523567143 1028218073 /nfs/dbraw/zinc/21/80/73/1028218073.db2.gz RWISACNKLDSGKL-BDAKNGLRSA-N -1 1 343.798 4.072 20 0 EIADMM CCOc1cc(-c2noc([C@@H](C)C(F)(F)F)n2)cc(Cl)c1[O-] ZINC000445412165 1028510946 /nfs/dbraw/zinc/51/09/46/1028510946.db2.gz MCAPEZCTQQSHDI-ZCFIWIBFSA-N -1 1 336.697 4.160 20 0 EIADMM C[C@H](Oc1cccc(F)c1)c1nc(-c2ccc([O-])cc2Cl)no1 ZINC000445446994 1028535103 /nfs/dbraw/zinc/53/51/03/1028535103.db2.gz NOAQWOGICOILHZ-VIFPVBQESA-N -1 1 334.734 4.375 20 0 EIADMM [O-]c1ccc(-c2noc([C@H]3Cc4cc(Cl)ccc4O3)n2)c(Cl)c1 ZINC000445448712 1028537482 /nfs/dbraw/zinc/53/74/82/1028537482.db2.gz SRBFCKRFOPPBSA-CQSZACIVSA-N -1 1 349.173 4.425 20 0 EIADMM CCOc1ccccc1OCc1nc(-c2ccc([O-])cc2Cl)no1 ZINC000445450870 1028540087 /nfs/dbraw/zinc/54/00/87/1028540087.db2.gz XRRSMRLDGWDAGO-UHFFFAOYSA-N -1 1 346.770 4.073 20 0 EIADMM [O-]c1ccc(-c2noc(Cc3c[nH]c4ccccc34)n2)c(Cl)c1 ZINC000445449921 1028541668 /nfs/dbraw/zinc/54/16/68/1028541668.db2.gz WQSOOXPOUNPVSO-UHFFFAOYSA-N -1 1 325.755 4.168 20 0 EIADMM COc1cc(/C=C\c2nc(-c3ccc([O-])cc3Cl)no2)ccc1F ZINC000445443761 1028570763 /nfs/dbraw/zinc/57/07/63/1028570763.db2.gz DJGCLNRCMHJMSU-CLTKARDFSA-N -1 1 346.745 4.414 20 0 EIADMM Cc1noc(C)c1[C@H](C)Cc1nc(-c2ccc([O-])cc2Cl)no1 ZINC000445445565 1028575480 /nfs/dbraw/zinc/57/54/80/1028575480.db2.gz JMDOHMPTIQQTEQ-MRVPVSSYSA-N -1 1 333.775 4.047 20 0 EIADMM Cc1nn(C)c2sc(-c3nc(-c4ccc([O-])cc4Cl)no3)cc12 ZINC000445447790 1028579856 /nfs/dbraw/zinc/57/98/56/1028579856.db2.gz QBEAXNAUGICOTB-UHFFFAOYSA-N -1 1 346.799 4.019 20 0 EIADMM COC(=O)Nc1cccc(NC(=O)c2ccc(C(C)C)cc2[O-])c1C ZINC000281388228 1028580850 /nfs/dbraw/zinc/58/08/50/1028580850.db2.gz GRJOXWPMXOXTFD-UHFFFAOYSA-N -1 1 342.395 4.255 20 0 EIADMM [O-]c1ccc(-c2noc(/C=C\c3nc4ccccc4o3)n2)c(Cl)c1 ZINC000445447404 1028582521 /nfs/dbraw/zinc/58/25/21/1028582521.db2.gz OVDLMOSPYPZTBT-FPLPWBNLSA-N -1 1 339.738 4.407 20 0 EIADMM COc1ccc(SCc2nc(-c3ccc([O-])cc3Cl)no2)cc1 ZINC000445447381 1028583741 /nfs/dbraw/zinc/58/37/41/1028583741.db2.gz OOCXJTDQRJUAFS-UHFFFAOYSA-N -1 1 348.811 4.397 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cccc(-c4cscn4)c3)n2)cc1F ZINC000445471422 1028602359 /nfs/dbraw/zinc/60/23/59/1028602359.db2.gz GWPQLZXAGZYPKA-UHFFFAOYSA-N -1 1 339.351 4.372 20 0 EIADMM [O-]c1ccc(-c2noc([C@H]3CCOc4ccc(Cl)cc43)n2)c(F)c1 ZINC000445454974 1028610461 /nfs/dbraw/zinc/61/04/61/1028610461.db2.gz BQWHVWHCOWHOCC-NSHDSACASA-N -1 1 346.745 4.149 20 0 EIADMM CC(C)OCc1ccc(-c2nc(-c3ccc([O-])cc3F)no2)cc1 ZINC000445457439 1028612665 /nfs/dbraw/zinc/61/26/65/1028612665.db2.gz SCJFMGYKFASZHR-UHFFFAOYSA-N -1 1 328.343 4.173 20 0 EIADMM CCC(CC)n1nc(-c2nc(-c3ccc([O-])cc3F)no2)cc1C ZINC000445460821 1028615644 /nfs/dbraw/zinc/61/56/44/1028615644.db2.gz SXXNBPJVLSEKHB-UHFFFAOYSA-N -1 1 330.363 4.114 20 0 EIADMM [O-]c1ccc(-c2noc(/C=C/c3nc4ccccc4s3)n2)cc1F ZINC000445477832 1028620720 /nfs/dbraw/zinc/62/07/20/1028620720.db2.gz DUQUYACKEKXRGA-BQYQJAHWSA-N -1 1 339.351 4.361 20 0 EIADMM [O-]c1ccc(-c2noc([C@H]3CCOc4ccc(Cl)cc43)n2)cc1F ZINC000445478581 1028624414 /nfs/dbraw/zinc/62/44/14/1028624414.db2.gz DBOSNFOGOXHUSI-NSHDSACASA-N -1 1 346.745 4.149 20 0 EIADMM C[C@H](Oc1ccccc1Cl)c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445478436 1028624773 /nfs/dbraw/zinc/62/47/73/1028624773.db2.gz HADJJNDFMLGZKR-VIFPVBQESA-N -1 1 334.734 4.375 20 0 EIADMM [O-]c1ccc(-c2noc(-c3ccc(Oc4cccnc4)cc3)n2)cc1F ZINC000445480359 1028627303 /nfs/dbraw/zinc/62/73/03/1028627303.db2.gz JRRKYTWDVKRNLW-UHFFFAOYSA-N -1 1 349.321 4.436 20 0 EIADMM [O-]c1ccc(-c2noc(CSc3nc4ccccc4o3)n2)cc1F ZINC000445479016 1028627751 /nfs/dbraw/zinc/62/77/51/1028627751.db2.gz IPRKMJCRSYAPFJ-UHFFFAOYSA-N -1 1 343.339 4.015 20 0 EIADMM CCOc1ccc(-c2nc(-c3ccc([O-])c(F)c3)no2)cc1OCC ZINC000445486313 1028636531 /nfs/dbraw/zinc/63/65/31/1028636531.db2.gz LBVITCPBUKAZSV-UHFFFAOYSA-N -1 1 344.342 4.046 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cnc(-c4ccccc4)s3)n2)cc1F ZINC000445486234 1028637068 /nfs/dbraw/zinc/63/70/68/1028637068.db2.gz KCZSYWUPQLCKBJ-UHFFFAOYSA-N -1 1 339.351 4.372 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cc(C(F)(F)F)ccc3F)n2)cc1F ZINC000445475030 1028645389 /nfs/dbraw/zinc/64/53/89/1028645389.db2.gz SIRGCIORGSIVFV-UHFFFAOYSA-N -1 1 342.223 4.406 20 0 EIADMM CCOc1ccc(S(=O)(=O)[N-]c2ccccc2C)c2ccccc12 ZINC000511240553 1028783454 /nfs/dbraw/zinc/78/34/54/1028783454.db2.gz LJXDTRBEASDJRK-UHFFFAOYSA-N -1 1 341.432 4.348 20 0 EIADMM Cc1nnc(SCC(=O)c2ccc([O-])cc2)n1[C@H]1CCC[C@@H](C)C1 ZINC000536090894 1028972991 /nfs/dbraw/zinc/97/29/91/1028972991.db2.gz RDDDOGPSJSEWEO-DOMZBBRYSA-N -1 1 345.468 4.018 20 0 EIADMM c1csc([C@@H]([N-]c2noc(-c3ccccc3)n2)c2ccccc2)n1 ZINC000157407424 1029062165 /nfs/dbraw/zinc/06/21/65/1029062165.db2.gz OBFQGRADMUVQLZ-HNNXBMFYSA-N -1 1 334.404 4.395 20 0 EIADMM CCc1cc2c(CN(CC)c3ccccc3C)cc(=O)oc2cc1[O-] ZINC001168053760 1029166938 /nfs/dbraw/zinc/16/69/38/1029166938.db2.gz XTAUNTUATJRQFJ-UHFFFAOYSA-N -1 1 337.419 4.396 20 0 EIADMM Cc1ccc2ccccc2c1C[N@@H+](C)Cc1nc(=O)c2sccc2[n-]1 ZINC000467476172 1029296180 /nfs/dbraw/zinc/29/61/80/1029296180.db2.gz GNXQHPJCLJYHJB-UHFFFAOYSA-N -1 1 349.459 4.491 20 0 EIADMM COc1cc(CN(C)[C@H](C)c2cc(C(=O)[O-])c(C)o2)ccc1SC ZINC000583999580 1029482556 /nfs/dbraw/zinc/48/25/56/1029482556.db2.gz PMHBQIUUSFDFTR-LLVKDONJSA-N -1 1 349.452 4.210 20 0 EIADMM [O-]c1ccc(Cc2nc([C@H]3CCOC4(CCCC4)C3)no2)cc1Cl ZINC000897180123 1029510270 /nfs/dbraw/zinc/51/02/70/1029510270.db2.gz PMOYFQYXUIMLGD-ZDUSSCGKSA-N -1 1 348.830 4.226 20 0 EIADMM Cc1nc(-c2ccc(NC[C@@H]3CCCC[C@H]3C)nc2)[n-]c(=O)c1C ZINC000301349189 1029714096 /nfs/dbraw/zinc/71/40/96/1029714096.db2.gz IFNAZKZENICOCK-DOMZBBRYSA-N -1 1 326.444 4.099 20 0 EIADMM Cc1nc(-c2ccc(N[C@@H]3CC[C@@H](C)C[C@H]3C)nc2)[n-]c(=O)c1C ZINC000301412075 1029727689 /nfs/dbraw/zinc/72/76/89/1029727689.db2.gz YSOBLBIEDZJTKU-XHBSWPGZSA-N -1 1 326.444 4.098 20 0 EIADMM Cc1nc(-c2ccc(N[C@@H]3CCC[C@H](C)[C@H]3C)nc2)[n-]c(=O)c1C ZINC000301570808 1029762793 /nfs/dbraw/zinc/76/27/93/1029762793.db2.gz WUYNWRBRKWTDSS-HWWQOWPSSA-N -1 1 326.444 4.098 20 0 EIADMM CCC1(CNc2ccc(-c3nc(C)c(C)c(=O)[n-]3)cn2)CCCC1 ZINC000301693760 1029791576 /nfs/dbraw/zinc/79/15/76/1029791576.db2.gz ZQQLMZKVOLDXOE-UHFFFAOYSA-N -1 1 326.444 4.243 20 0 EIADMM C[C@@H]1C[C@H](c2cccnc2)N(C(=O)c2cc3ccccc3cc2[O-])C1 ZINC000182851479 1029993058 /nfs/dbraw/zinc/99/30/58/1029993058.db2.gz MQBJJVGBRCJJAH-AUUYWEPGSA-N -1 1 332.403 4.164 20 0 EIADMM CC(C)C(=O)c1ccc([C@H](C)C(=O)Nc2cccc(F)c2[O-])cc1 ZINC000530005596 1030049051 /nfs/dbraw/zinc/04/90/51/1030049051.db2.gz MSMHNPLNTSDBOH-LBPRGKRZSA-N -1 1 329.371 4.112 20 0 EIADMM CC[C@H](c1ccccc1)S(=O)(=O)c1ncc(-c2ccc(F)cc2)[n-]1 ZINC000447492192 1030102506 /nfs/dbraw/zinc/10/25/06/1030102506.db2.gz YHZRUJJZEWZYFV-QGZVFWFLSA-N -1 1 344.411 4.141 20 0 EIADMM CC[C@H](c1ccccc1)S(=O)(=O)c1nc(-c2ccc(F)cc2)c[n-]1 ZINC000447492192 1030102524 /nfs/dbraw/zinc/10/25/24/1030102524.db2.gz YHZRUJJZEWZYFV-QGZVFWFLSA-N -1 1 344.411 4.141 20 0 EIADMM Cc1nc(-c2cccc([N-]S(=O)(=O)c3ccccc3C)c2)cs1 ZINC000321149604 1030106183 /nfs/dbraw/zinc/10/61/83/1030106183.db2.gz ZEUBCTNXPJLTDU-UHFFFAOYSA-N -1 1 344.461 4.228 20 0 EIADMM CCc1ccc(S(=O)(=O)[N-]c2ccccc2C(C)(F)F)cc1 ZINC000451080964 1030227947 /nfs/dbraw/zinc/22/79/47/1030227947.db2.gz DAJOFDZGOAZNIG-UHFFFAOYSA-N -1 1 325.380 4.162 20 0 EIADMM CCOc1cc(C(=O)N(C)[C@@H](CC)c2ccncc2)cc(Cl)c1[O-] ZINC000186824481 1030309663 /nfs/dbraw/zinc/30/96/63/1030309663.db2.gz IXHFWGFYPWUVSO-HNNXBMFYSA-N -1 1 348.830 4.063 20 0 EIADMM COc1cc(C(=O)N2CC[C@H](C)[C@H]3CCCC[C@@H]32)cc(Cl)c1[O-] ZINC000526949751 1030342563 /nfs/dbraw/zinc/34/25/63/1030342563.db2.gz KVWHIHJUBHCEFC-LNSITVRQSA-N -1 1 337.847 4.095 20 0 EIADMM Cc1nc(-c2ccc(N3CCCC4(CCCC4)C3)nc2)[n-]c(=O)c1C ZINC000527325605 1030631960 /nfs/dbraw/zinc/63/19/60/1030631960.db2.gz KBCXGZLGFHMCAJ-UHFFFAOYSA-N -1 1 338.455 4.022 20 0 EIADMM O=S(=O)([N-]c1cccc(OC(F)F)c1)c1ccc2ccccc2c1 ZINC000614813523 1030714598 /nfs/dbraw/zinc/71/45/98/1030714598.db2.gz VUYPWIFUKHGDAE-UHFFFAOYSA-N -1 1 349.358 4.242 20 0 EIADMM CCC(=O)c1ccc(Cl)c([N-]S(=O)(=O)c2ccc(C)s2)c1 ZINC000475838653 1030914287 /nfs/dbraw/zinc/91/42/87/1030914287.db2.gz YAEITQZALJJLNL-UHFFFAOYSA-N -1 1 343.857 4.103 20 0 EIADMM O=C([O-])c1ccccc1C1CC[NH+](Cc2cccc([O-])c2Cl)CC1 ZINC000666585769 1031043739 /nfs/dbraw/zinc/04/37/39/1031043739.db2.gz FZCJRFKBYFQAFP-UHFFFAOYSA-N -1 1 345.826 4.123 20 0 EIADMM O=C([O-])c1ccccc1C1CCN(Cc2cccc(O)c2Cl)CC1 ZINC000666585769 1031043761 /nfs/dbraw/zinc/04/37/61/1031043761.db2.gz FZCJRFKBYFQAFP-UHFFFAOYSA-N -1 1 345.826 4.123 20 0 EIADMM Cc1cc(F)cc(S(=O)(=O)[N-]c2ccc(OC(C)C)cc2C)c1 ZINC000531345300 1031121203 /nfs/dbraw/zinc/12/12/03/1031121203.db2.gz PCPFJGPIUVRJKZ-UHFFFAOYSA-N -1 1 337.416 4.031 20 0 EIADMM O=C(Nc1ccc(F)cc1[O-])[C@H]1C[C@H]1c1cccc(C(F)(F)F)c1 ZINC000532622138 1031433799 /nfs/dbraw/zinc/43/37/99/1031433799.db2.gz DUQMRRARMBEPMG-STQMWFEESA-N -1 1 339.288 4.292 20 0 EIADMM Cc1cc(C)cc(-c2nnc([N-]C(=O)c3conc3C(C)C)s2)c1 ZINC000528579482 1031642086 /nfs/dbraw/zinc/64/20/86/1031642086.db2.gz HECSDPFTVWVMFA-UHFFFAOYSA-N -1 1 342.424 4.186 20 0 EIADMM CCOc1ccc([N-]S(=O)(=O)c2ccc(Cl)cc2)cc1Cl ZINC000614841168 1032016878 /nfs/dbraw/zinc/01/68/78/1032016878.db2.gz ZHRQTLLIJPFZET-UHFFFAOYSA-N -1 1 346.235 4.193 20 0 EIADMM CCc1nc(SCc2ccccc2Br)[n-]c(=O)c1C ZINC000563442030 1033460806 /nfs/dbraw/zinc/46/08/06/1033460806.db2.gz VQIWPQMVGHHQGH-UHFFFAOYSA-N -1 1 339.258 4.108 20 0 EIADMM Cc1ccc(F)c(S(=O)(=O)[N-]c2c(C)c(F)ccc2Cl)c1 ZINC000433131851 1033899827 /nfs/dbraw/zinc/89/98/27/1033899827.db2.gz DSPFFAVDIMWXRV-UHFFFAOYSA-N -1 1 331.771 4.036 20 0 EIADMM CC1(C)CC[C@H]1[N-]S(=O)(=O)c1sc2ccccc2c1Cl ZINC001211799786 1033953805 /nfs/dbraw/zinc/95/38/05/1033953805.db2.gz SZWVURHVSPDPBN-LLVKDONJSA-N -1 1 329.874 4.022 20 0 EIADMM O=C([O-])[C@@H]1C[C@@H](C2CCCCC2)CN1Cc1sccc1Cl ZINC000576293137 1034387702 /nfs/dbraw/zinc/38/77/02/1034387702.db2.gz JETJPEWYOBWRTL-OCCSQVGLSA-N -1 1 327.877 4.257 20 0 EIADMM Cc1ccc(F)cc1-c1nnc([N-]C(=O)c2sccc2F)s1 ZINC000509900332 1034471889 /nfs/dbraw/zinc/47/18/89/1034471889.db2.gz NTZQBZCZJGOFMF-UHFFFAOYSA-N -1 1 337.376 4.106 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc(C)c(OC(F)F)c2)cc1C ZINC000513370607 1034899589 /nfs/dbraw/zinc/89/95/89/1034899589.db2.gz IBFXXOKFWQXRCC-UHFFFAOYSA-N -1 1 341.379 4.014 20 0 EIADMM Cc1nc(-c2nc(=O)c3c(-c4ccc(F)cc4)csc3[n-]2)co1 ZINC000345189882 1035148645 /nfs/dbraw/zinc/14/86/45/1035148645.db2.gz OGTIHZKWBYVBBO-UHFFFAOYSA-N -1 1 327.340 4.166 20 0 EIADMM CCCCCOc1ccc(S(=O)(=O)[N-]c2c(C)ccnc2C)cc1 ZINC000414449611 1035495848 /nfs/dbraw/zinc/49/58/48/1035495848.db2.gz CORZNLKWPFNGOD-UHFFFAOYSA-N -1 1 348.468 4.068 20 0 EIADMM Cc1cc(C)c([N-]S(=O)(=O)c2ccc(C(C)(C)C)cc2)c(C)n1 ZINC000414461493 1035724223 /nfs/dbraw/zinc/72/42/23/1035724223.db2.gz RXVAVKDHAZARHP-UHFFFAOYSA-N -1 1 332.469 4.105 20 0 EIADMM Cc1nnc(C(=O)[N-]c2cccc(Cl)c2SC(C)C)s1 ZINC000669113228 1035762849 /nfs/dbraw/zinc/76/28/49/1035762849.db2.gz KQQGTNBRUFQTCG-UHFFFAOYSA-N -1 1 327.862 4.253 20 0 EIADMM CC(C)Oc1ccc(NC(=O)c2c(F)ccc([O-])c2F)cc1Cl ZINC000570887013 1035824495 /nfs/dbraw/zinc/82/44/95/1035824495.db2.gz RUXHPSKIPUSOCM-UHFFFAOYSA-N -1 1 341.741 4.363 20 0 EIADMM Cc1c(=O)[n-]c(SC/C(Cl)=C/Cl)nc1-c1ccccc1 ZINC000163947684 1035881136 /nfs/dbraw/zinc/88/11/36/1035881136.db2.gz VGAIPEHGMUVYQF-XFFZJAGNSA-N -1 1 327.236 4.156 20 0 EIADMM Cc1cnc(C(=O)N2CCCCC[C@H]2/C=C/c2ccccc2)c([O-])c1 ZINC000460127391 1036092838 /nfs/dbraw/zinc/09/28/38/1036092838.db2.gz MCQQORBQOAHKGY-DXRVJIQQSA-N -1 1 336.435 4.194 20 0 EIADMM O=C(c1ccc([N-]S(=O)(=O)c2ccc(Cl)cc2)cc1)C1CCC1 ZINC000486084821 1036470135 /nfs/dbraw/zinc/47/01/35/1036470135.db2.gz XQBCUWZAQRUOKO-UHFFFAOYSA-N -1 1 349.839 4.124 20 0 EIADMM CSCC1CCC(NC(=O)c2ccc(C(F)(F)F)cc2[O-])CC1 ZINC000598792608 1036780195 /nfs/dbraw/zinc/78/01/95/1036780195.db2.gz SIDYUNSSPBFSEX-UHFFFAOYSA-N -1 1 347.402 4.063 20 0 EIADMM Cc1nc(-c2cccc([N-]S(=O)(=O)c3ccccc3C)c2)oc1C ZINC000589434531 1036799273 /nfs/dbraw/zinc/79/92/73/1036799273.db2.gz RXVOGBQTHCOBKQ-UHFFFAOYSA-N -1 1 342.420 4.068 20 0 EIADMM Cc1ccccc1S(=O)(=O)[N-]c1cccc(OC2CCCC2)c1 ZINC000589429667 1036800446 /nfs/dbraw/zinc/80/04/46/1036800446.db2.gz LDAISEARMUANAA-UHFFFAOYSA-N -1 1 331.437 4.117 20 0 EIADMM COc1cccc([O-])c1C(=O)Nc1cccc(NC2CCCC2)c1 ZINC001168393940 1036872896 /nfs/dbraw/zinc/87/28/96/1036872896.db2.gz OFLZYFLXZKIJHL-UHFFFAOYSA-N -1 1 326.396 4.008 20 0 EIADMM CC(C)(C)c1ccc(C(=O)Nc2cccc([O-])c2Br)nc1 ZINC000908706379 1036916913 /nfs/dbraw/zinc/91/69/13/1036916913.db2.gz AJUULCNFDPQSQR-UHFFFAOYSA-N -1 1 349.228 4.100 20 0 EIADMM CC(C)CC1(C(=O)Nc2cccc([O-])c2Br)CCC1 ZINC000908710163 1036920844 /nfs/dbraw/zinc/92/08/44/1036920844.db2.gz YKVRRCGLRXQOQL-UHFFFAOYSA-N -1 1 326.234 4.310 20 0 EIADMM CCN(Cc1ccc(Cl)s1)C(=O)c1c([O-])cccc1Cl ZINC000057306227 1037015448 /nfs/dbraw/zinc/01/54/48/1037015448.db2.gz AKKUZNBYIVBLJB-UHFFFAOYSA-N -1 1 330.236 4.423 20 0 EIADMM CSCC1CCC(NC(=O)c2ccc(C(F)(F)F)c([O-])c2)CC1 ZINC000590776394 1037160039 /nfs/dbraw/zinc/16/00/39/1037160039.db2.gz SLINNLVXUZWCMI-UHFFFAOYSA-N -1 1 347.402 4.063 20 0 EIADMM CCc1nc(SCc2sccc2Br)[n-]c(=O)c1C ZINC000573104262 1037349379 /nfs/dbraw/zinc/34/93/79/1037349379.db2.gz LTYHRSBOIBHEQD-UHFFFAOYSA-N -1 1 345.287 4.169 20 0 EIADMM CCc1ccccc1S(=O)(=O)[N-]c1ccc(-c2ccc[nH]2)cc1 ZINC000488295492 1037491048 /nfs/dbraw/zinc/49/10/48/1037491048.db2.gz LQFFNJRXGGNGFQ-UHFFFAOYSA-N -1 1 326.421 4.045 20 0 EIADMM O=C(N[C@H](c1ccc(Cl)cc1)C1CCCC1)c1cncc([O-])c1 ZINC000605182556 1037690464 /nfs/dbraw/zinc/69/04/64/1037690464.db2.gz FHBQTONICWPWLD-KRWDZBQOSA-N -1 1 330.815 4.102 20 0 EIADMM Cc1ccc(-c2nc(C(=O)Nc3c([O-])cccc3F)cs2)cc1 ZINC000605436909 1037787539 /nfs/dbraw/zinc/78/75/39/1037787539.db2.gz NMUOFDFJNPHYMS-UHFFFAOYSA-N -1 1 328.368 4.216 20 0 EIADMM C[C@@H](Oc1cccc(C(C)(C)C)c1)C(=O)Nc1c([O-])cccc1F ZINC000605437930 1037788722 /nfs/dbraw/zinc/78/87/22/1037788722.db2.gz BSNTUHZRKVRLHW-GFCCVEGCSA-N -1 1 331.387 4.235 20 0 EIADMM CSc1ccc(CSc2nc(C(F)(F)F)cc(=O)[n-]2)cc1 ZINC000605446400 1037791416 /nfs/dbraw/zinc/79/14/16/1037791416.db2.gz AILFOWWLGBPMHR-UHFFFAOYSA-N -1 1 332.372 4.215 20 0 EIADMM CCc1cccc(CC)c1S(=O)(=O)[N-]c1cccc2[nH]ccc21 ZINC000605495270 1037823748 /nfs/dbraw/zinc/82/37/48/1037823748.db2.gz LLGILUPJGWTODP-UHFFFAOYSA-N -1 1 328.437 4.094 20 0 EIADMM COc1ccc([N-]S(=O)(=O)c2cccc(C(C)C)c2)cc1Cl ZINC000460459127 1038986159 /nfs/dbraw/zinc/98/61/59/1038986159.db2.gz LYPFOAUOWUTPKO-UHFFFAOYSA-N -1 1 339.844 4.273 20 0 EIADMM Cc1nc(-c2ccc(N3CCC[C@H](C(C)(C)C)C3)nc2)[n-]c(=O)c1C ZINC000481055812 1038997500 /nfs/dbraw/zinc/99/75/00/1038997500.db2.gz IICSRMIVMKKPLK-INIZCTEOSA-N -1 1 340.471 4.124 20 0 EIADMM O=C(Nc1cc(Cl)ccc1OC1CCCC1)c1cncc([O-])c1 ZINC000552158382 1039192074 /nfs/dbraw/zinc/19/20/74/1039192074.db2.gz PVSFFSSFOQISGB-UHFFFAOYSA-N -1 1 332.787 4.014 20 0 EIADMM CCCc1ccc(S(=O)(=O)[N-]c2cccc(-c3ncco3)c2)cc1 ZINC000513819204 1039296342 /nfs/dbraw/zinc/29/63/42/1039296342.db2.gz RUGQLJJEABSXDE-UHFFFAOYSA-N -1 1 342.420 4.095 20 0 EIADMM Cc1ccc([C@@H]2OCCC[C@H]2C(=O)Nc2ccc([O-])c(F)c2F)cc1 ZINC000456780951 1039599205 /nfs/dbraw/zinc/59/92/05/1039599205.db2.gz JHWDKAFXIWZHOC-ACJLOTCBSA-N -1 1 347.361 4.085 20 0 EIADMM CC[C@@H](C)Oc1cccc([N-]S(=O)(=O)c2ccc(F)c(C)c2)c1 ZINC000552810317 1039821150 /nfs/dbraw/zinc/82/11/50/1039821150.db2.gz WDATZLDPSRYEPR-CYBMUJFWSA-N -1 1 337.416 4.112 20 0 EIADMM COc1cc(C(=O)Nc2cc(Cl)ccc2C)cc(Cl)c1[O-] ZINC000476711639 1039842334 /nfs/dbraw/zinc/84/23/34/1039842334.db2.gz LHNWPHODOXHXNW-UHFFFAOYSA-N -1 1 326.179 4.268 20 0 EIADMM Cc1cc(NC(=O)c2c(F)ccc([O-])c2F)ccc1-c1ccncc1 ZINC000552879439 1039855500 /nfs/dbraw/zinc/85/55/00/1039855500.db2.gz QGHFDBIDVJKOND-UHFFFAOYSA-N -1 1 340.329 4.293 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cnc4ccsc4c3)n2)c(Cl)c1 ZINC000556002828 1039857155 /nfs/dbraw/zinc/85/71/55/1039857155.db2.gz OHVYAZYPKSVGJJ-UHFFFAOYSA-N -1 1 329.768 4.372 20 0 EIADMM CCc1cc(C)cc(CC)c1[N-]S(=O)(=O)c1cccc(C(C)=O)c1 ZINC000481870168 1039872510 /nfs/dbraw/zinc/87/25/10/1039872510.db2.gz PYKRHDKXDPOGQN-UHFFFAOYSA-N -1 1 345.464 4.123 20 0 EIADMM CCCCCOc1ccc(S(=O)(=O)[N-]c2cccc(OC)c2)cc1 ZINC000063146440 1039908776 /nfs/dbraw/zinc/90/87/76/1039908776.db2.gz GUBWIBPLBIKSDG-UHFFFAOYSA-N -1 1 349.452 4.065 20 0 EIADMM CCC(C)(C)c1ccc(S(=O)(=O)[N-]c2ncccc2Cl)cc1 ZINC000481939245 1039909107 /nfs/dbraw/zinc/90/91/07/1039909107.db2.gz ANDXBSRDKOPION-UHFFFAOYSA-N -1 1 338.860 4.223 20 0 EIADMM CSc1cccc([N-]S(=O)(=O)c2cc(F)cc(Cl)c2)c1 ZINC000535137907 1039996040 /nfs/dbraw/zinc/99/60/40/1039996040.db2.gz MUCSFBNNLIQMNG-UHFFFAOYSA-N -1 1 331.821 4.002 20 0 EIADMM Cc1ccc(C(=O)Nc2cc(C)cc(Br)c2[O-])c(F)c1 ZINC000482540236 1040327559 /nfs/dbraw/zinc/32/75/59/1040327559.db2.gz XCMLEGNXKYWFRM-UHFFFAOYSA-N -1 1 338.176 4.163 20 0 EIADMM Cc1cc(Br)c([O-])c(NC(=O)c2c(C)cccc2C)c1 ZINC000482607895 1040386722 /nfs/dbraw/zinc/38/67/22/1040386722.db2.gz UPSZWKWMYTYRTH-UHFFFAOYSA-N -1 1 334.213 4.332 20 0 EIADMM CC[C@H](CNC(=O)c1ccc(Br)c([O-])c1)c1ccccc1 ZINC000479532619 1040457858 /nfs/dbraw/zinc/45/78/58/1040457858.db2.gz XPBFODPOPSUEHG-GFCCVEGCSA-N -1 1 348.240 4.078 20 0 EIADMM CCCc1cc(=O)[n-]c(S[C@@H](C)c2noc(-c3ccccc3)n2)n1 ZINC000477428359 1040486506 /nfs/dbraw/zinc/48/65/06/1040486506.db2.gz OCHHEJNZXLNQOH-NSHDSACASA-N -1 1 342.424 4.038 20 0 EIADMM CCOc1ccc(S(=O)(=O)[N-]c2ccccc2C(F)F)cc1C ZINC000515233489 1040586382 /nfs/dbraw/zinc/58/63/82/1040586382.db2.gz NBPZFTVMWVDVQL-UHFFFAOYSA-N -1 1 341.379 4.132 20 0 EIADMM Cc1oc([C@@H](C)N(C)CCOc2ccccc2Cl)cc1C(=O)[O-] ZINC000519412900 1040601820 /nfs/dbraw/zinc/60/18/20/1040601820.db2.gz SGFVZZOZQQNIEW-LLVKDONJSA-N -1 1 337.803 4.011 20 0 EIADMM O=C([N-]c1c(F)cccc1F)c1c(F)cc(Br)cc1F ZINC000085219196 1040643592 /nfs/dbraw/zinc/64/35/92/1040643592.db2.gz YNVZSYJDNCSACI-UHFFFAOYSA-N -1 1 348.093 4.258 20 0 EIADMM COc1cc(C(=O)Nc2ccc(C)c3ncccc23)cc(Cl)c1[O-] ZINC000483137779 1040729438 /nfs/dbraw/zinc/72/94/38/1040729438.db2.gz VUFUWKXWGQSUTD-UHFFFAOYSA-N -1 1 342.782 4.163 20 0 EIADMM Cc1ccc(C)c(OCc2nc(-c3ccc([O-])cc3Cl)no2)c1 ZINC000445452233 1040780231 /nfs/dbraw/zinc/78/02/31/1040780231.db2.gz BCXNYVUCFNMWCA-UHFFFAOYSA-N -1 1 330.771 4.291 20 0 EIADMM Cc1cc2cc[nH]c2cc1[N-]S(=O)(=O)c1ccc(Cl)cc1C ZINC000436147964 1040907135 /nfs/dbraw/zinc/90/71/35/1040907135.db2.gz DUHWPNBQRNKAED-UHFFFAOYSA-N -1 1 334.828 4.239 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2cccc(C(C)(F)F)c2)cc1C ZINC000436185780 1040927777 /nfs/dbraw/zinc/92/77/77/1040927777.db2.gz FOFPPKGXKDIJPL-UHFFFAOYSA-N -1 1 325.380 4.216 20 0 EIADMM CC(=O)c1cc(F)c([N-]C(=O)c2ccc(Cl)cc2F)c(F)c1F ZINC000539955447 1040939513 /nfs/dbraw/zinc/93/95/13/1040939513.db2.gz ZWUJQZMEKXPREI-UHFFFAOYSA-N -1 1 345.679 4.351 20 0 EIADMM CCc1cc(=O)[n-]c(SCc2nc(-c3ccccc3)cs2)n1 ZINC000436192062 1040964405 /nfs/dbraw/zinc/96/44/05/1040964405.db2.gz AIENWSGENHRBHJ-UHFFFAOYSA-N -1 1 329.450 4.160 20 0 EIADMM CSCc1ccccc1[N-]S(=O)(=O)c1ccc(SC)cc1 ZINC000184029657 1040977467 /nfs/dbraw/zinc/97/74/67/1040977467.db2.gz RIPSTPHELKOZMX-UHFFFAOYSA-N -1 1 339.507 4.072 20 0 EIADMM COc1cccc(C2CCN(C(=O)c3cc(Cl)ccc3[O-])CC2)c1 ZINC000194699714 1041035185 /nfs/dbraw/zinc/03/51/85/1041035185.db2.gz BCKJMUVRGIBKAQ-UHFFFAOYSA-N -1 1 345.826 4.074 20 0 EIADMM Cc1nc(-c2ccc(NC3C[C@@H](C)C[C@H](C)C3)nc2)[n-]c(=O)c1C ZINC000462860567 1041040731 /nfs/dbraw/zinc/04/07/31/1041040731.db2.gz HOSHRBNDAQSWIV-RYUDHWBXSA-N -1 1 326.444 4.098 20 0 EIADMM CC(C)N(CCc1nccs1)C(=O)c1cc2ccccc2cc1[O-] ZINC000163295109 1041059165 /nfs/dbraw/zinc/05/91/65/1041059165.db2.gz TWWSWVJCMULFGD-UHFFFAOYSA-N -1 1 340.448 4.095 20 0 EIADMM Cc1c(C(=O)Nc2ccc([O-])c(Cl)c2)cnn1-c1ccc(C)cc1 ZINC000554432513 1041113061 /nfs/dbraw/zinc/11/30/61/1041113061.db2.gz AVCATGQCSCYODJ-UHFFFAOYSA-N -1 1 341.798 4.100 20 0 EIADMM Cc1cc(C)c(/C=C/CN[C@@H](C)c2nc(C(=O)[O-])cs2)c(C)c1 ZINC000904024368 1041269882 /nfs/dbraw/zinc/26/98/82/1041269882.db2.gz RAMJKNADYQOJOT-GJBLVYBDSA-N -1 1 330.453 4.131 20 0 EIADMM CC[C@@](C)(NC(=O)c1cc2ccccc2cc1[O-])c1nccs1 ZINC000436525274 1041310828 /nfs/dbraw/zinc/31/08/28/1041310828.db2.gz ALGHSUFFLAFALO-GOSISDBHSA-N -1 1 326.421 4.057 20 0 EIADMM CC[C@@](C)(NC(=O)c1ccc2ccccc2c1[O-])c1nccs1 ZINC000436531489 1041316256 /nfs/dbraw/zinc/31/62/56/1041316256.db2.gz SUFOHZAKTYILPI-GOSISDBHSA-N -1 1 326.421 4.057 20 0 EIADMM C[C@H](NC(=O)c1cc(Cl)ccc1[O-])c1ncc(-c2ccccc2)o1 ZINC000436534874 1041318061 /nfs/dbraw/zinc/31/80/61/1041318061.db2.gz YNCVOZODYACREN-NSHDSACASA-N -1 1 342.782 4.192 20 0 EIADMM Cc1ccc(CN(Cc2ccco2)C(=O)c2cc(F)ccc2[O-])s1 ZINC000436547009 1041323213 /nfs/dbraw/zinc/32/32/13/1041323213.db2.gz IMCXOUHWAPWALS-UHFFFAOYSA-N -1 1 345.395 4.337 20 0 EIADMM CCCCCN(C(=O)c1cc(Cl)c([O-])c(OCC)c1)C(C)C ZINC000436537733 1041331461 /nfs/dbraw/zinc/33/14/61/1041331461.db2.gz SYWPFEDQAGEHPD-UHFFFAOYSA-N -1 1 327.852 4.485 20 0 EIADMM O=C(c1ccccc1[O-])N(CC1CC1)c1cccc(C(F)(F)F)c1 ZINC000436540728 1041334009 /nfs/dbraw/zinc/33/40/09/1041334009.db2.gz ZXFQCCVPWVODIZ-UHFFFAOYSA-N -1 1 335.325 4.468 20 0 EIADMM C[C@@H]1CN(C(=O)c2cc(Cl)ccc2[O-])CC[C@H]1c1ccccc1 ZINC000436592116 1041351771 /nfs/dbraw/zinc/35/17/71/1041351771.db2.gz ZOYZSBRDFWMXCX-CZUORRHYSA-N -1 1 329.827 4.311 20 0 EIADMM COCc1nc2cc(NC(=O)c3cc4ccccc4cc3[O-])ccc2o1 ZINC000436582091 1041359994 /nfs/dbraw/zinc/35/99/94/1041359994.db2.gz CTFBAYUIDVAWBC-UHFFFAOYSA-N -1 1 348.358 4.085 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1CC[C@@H](c2ccc(F)cc2)C1 ZINC000436582621 1041360322 /nfs/dbraw/zinc/36/03/22/1041360322.db2.gz DXAODXLSIFGBCV-QGZVFWFLSA-N -1 1 335.378 4.314 20 0 EIADMM O=C(c1cc(F)ccc1[O-])N(CCc1cccc(F)c1)C1CCCC1 ZINC000436587985 1041364136 /nfs/dbraw/zinc/36/41/36/1041364136.db2.gz QTYCFLPZRRKJFC-UHFFFAOYSA-N -1 1 345.389 4.298 20 0 EIADMM CN(Cc1ccc2ccccc2c1)C(=O)c1ccc(Cl)cc1[O-] ZINC000436618538 1041365101 /nfs/dbraw/zinc/36/51/01/1041365101.db2.gz SAAJAWQMXQXNTE-UHFFFAOYSA-N -1 1 325.795 4.471 20 0 EIADMM Cc1cnc([C@H](NC(=O)c2cc3ccccc3cc2[O-])C2CC2)s1 ZINC000436588119 1041365468 /nfs/dbraw/zinc/36/54/68/1041365468.db2.gz HDQWNAXMDLOUEE-QGZVFWFLSA-N -1 1 338.432 4.191 20 0 EIADMM O=C(N[C@@H](CC(F)(F)F)c1ccc(F)cc1)c1cc(F)ccc1[O-] ZINC000436616929 1041375656 /nfs/dbraw/zinc/37/56/56/1041375656.db2.gz JAMBSEVUNFALRB-ZDUSSCGKSA-N -1 1 345.267 4.094 20 0 EIADMM CCOc1ccccc1CN(C)C(=O)c1ccc2ccccc2c1[O-] ZINC000436670063 1041409041 /nfs/dbraw/zinc/40/90/41/1041409041.db2.gz OSYJCCCNJIBMNJ-UHFFFAOYSA-N -1 1 335.403 4.216 20 0 EIADMM Cc1cccc(CO[N-]C(=O)[C@H](C)c2ccc(Cl)c(Cl)c2)n1 ZINC000898934449 1041416084 /nfs/dbraw/zinc/41/60/84/1041416084.db2.gz OJSHNWIXBHEBNI-LLVKDONJSA-N -1 1 339.222 4.048 20 0 EIADMM O=C(c1ccc([O-])cc1F)N1C[C@H](c2ccccc2)[C@H]2CCCC[C@@H]21 ZINC000436683244 1041421563 /nfs/dbraw/zinc/42/15/63/1041421563.db2.gz ZBBAGZGALKPBNZ-POAQFYNOSA-N -1 1 339.410 4.330 20 0 EIADMM CCOC(=O)c1ccc2c(c1)nc(-c1ccc([O-])c(Cl)c1)n2CC ZINC000436690152 1041423180 /nfs/dbraw/zinc/42/31/80/1041423180.db2.gz YHMKRTVREYCCED-UHFFFAOYSA-N -1 1 344.798 4.259 20 0 EIADMM CC(C)COc1ccccc1-c1noc(-c2ccc([O-])cc2F)n1 ZINC000436692903 1041425078 /nfs/dbraw/zinc/42/50/78/1041425078.db2.gz YULICBLRGRFZSF-UHFFFAOYSA-N -1 1 328.343 4.283 20 0 EIADMM [O-]c1ccc(-c2nc(COc3ccc4ccccc4c3)no2)c(F)c1 ZINC000436692359 1041425818 /nfs/dbraw/zinc/42/58/18/1041425818.db2.gz XBWSTUAEMMMZGP-UHFFFAOYSA-N -1 1 336.322 4.314 20 0 EIADMM O=C(Nc1ccc2nc(C(F)F)sc2c1)c1ccc([O-])cc1F ZINC000436700032 1041431707 /nfs/dbraw/zinc/43/17/07/1041431707.db2.gz TVHUVUZXIGBDBH-UHFFFAOYSA-N -1 1 338.310 4.331 20 0 EIADMM O=C(NCc1ccc(-c2ccccc2)cc1F)c1ccc([O-])cc1F ZINC000436708153 1041435820 /nfs/dbraw/zinc/43/58/20/1041435820.db2.gz WMQPKOLZHHFGHN-UHFFFAOYSA-N -1 1 339.341 4.267 20 0 EIADMM C[C@@H]1CC[C@]2(CCN(C(=O)c3ccc(C(F)(F)F)cc3[O-])C2)C1 ZINC000436725818 1041437028 /nfs/dbraw/zinc/43/70/28/1041437028.db2.gz VHDFAJXYLOXFSX-BZNIZROVSA-N -1 1 327.346 4.063 20 0 EIADMM Cc1ccsc1CN(C)C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436716232 1041441054 /nfs/dbraw/zinc/44/10/54/1041441054.db2.gz OUQWOSFUOBKOOU-UHFFFAOYSA-N -1 1 329.343 4.053 20 0 EIADMM CCN(Cc1ccc(Cl)s1)C(=O)c1ccc(Cl)cc1[O-] ZINC000436722628 1041444368 /nfs/dbraw/zinc/44/43/68/1041444368.db2.gz LEQIWKKRVZOCKT-UHFFFAOYSA-N -1 1 330.236 4.423 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N1CCC[C@H]1CCc1ccccc1 ZINC000436724534 1041444569 /nfs/dbraw/zinc/44/45/69/1041444569.db2.gz ZSPAENSDSYGNCH-INIZCTEOSA-N -1 1 329.827 4.283 20 0 EIADMM COCCCCN(Cc1ccccc1)C(=O)c1ccc(Cl)cc1[O-] ZINC000436721373 1041444628 /nfs/dbraw/zinc/44/46/28/1041444628.db2.gz JUBLGPIWUDPVMF-UHFFFAOYSA-N -1 1 347.842 4.115 20 0 EIADMM O=C(NCCc1cccc2cccnc21)c1ccc2ccccc2c1[O-] ZINC000436725180 1041444928 /nfs/dbraw/zinc/44/49/28/1041444928.db2.gz WDBCLJAQYRYFSQ-UHFFFAOYSA-N -1 1 342.398 4.066 20 0 EIADMM CCCOc1ccccc1NC(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC000436744886 1041452312 /nfs/dbraw/zinc/45/23/12/1041452312.db2.gz QOQMOZFFXFGXPC-UHFFFAOYSA-N -1 1 335.787 4.095 20 0 EIADMM C[C@@H]1C[C@H]1c1ccc(CN(C(=O)c2cc(F)ccc2[O-])C2CC2)o1 ZINC000436760134 1041457775 /nfs/dbraw/zinc/45/77/75/1041457775.db2.gz MOHUDANGMQTSGW-IAQYHMDHSA-N -1 1 329.371 4.053 20 0 EIADMM O=C(Nc1cccc(Cl)c1OCC(F)F)c1cc(F)ccc1[O-] ZINC000436746424 1041460167 /nfs/dbraw/zinc/46/01/67/1041460167.db2.gz GTMSHSHXLVQJOA-UHFFFAOYSA-N -1 1 345.704 4.081 20 0 EIADMM CN(C(=O)c1ccc(C(F)(F)F)cc1[O-])[C@@H]1CCc2ccccc2C1 ZINC000436749381 1041463689 /nfs/dbraw/zinc/46/36/89/1041463689.db2.gz ANOUBYKVXFQHPX-OAHLLOKOSA-N -1 1 349.352 4.041 20 0 EIADMM CN(Cc1ccccc1C(F)(F)F)C(=O)c1cc(Cl)ccc1[O-] ZINC000436756743 1041467159 /nfs/dbraw/zinc/46/71/59/1041467159.db2.gz FCSGNXQLNQPASX-UHFFFAOYSA-N -1 1 343.732 4.337 20 0 EIADMM CN(Cc1ccc(F)c(F)c1)C(=O)c1ccc2ccccc2c1[O-] ZINC000436754235 1041467353 /nfs/dbraw/zinc/46/73/53/1041467353.db2.gz HXVLBXCZKBBHOX-UHFFFAOYSA-N -1 1 327.330 4.096 20 0 EIADMM O=c1cc(C2CC2)nc(SCc2coc(-c3cccc(F)c3)n2)[n-]1 ZINC000195083440 1041473570 /nfs/dbraw/zinc/47/35/70/1041473570.db2.gz LEPSBADBVKNGNF-UHFFFAOYSA-N -1 1 343.383 4.146 20 0 EIADMM COc1ccc(CN(C)C(=O)c2cc3ccccc3cc2[O-])cc1C ZINC000436781251 1041479093 /nfs/dbraw/zinc/47/90/93/1041479093.db2.gz SNUPKLRYQGWBAG-UHFFFAOYSA-N -1 1 335.403 4.135 20 0 EIADMM Cc1cccc(-c2cnc(NC(=O)c3ccc([O-])cc3F)s2)c1 ZINC000436785807 1041481036 /nfs/dbraw/zinc/48/10/36/1041481036.db2.gz GOIBWBZRNSMEFY-UHFFFAOYSA-N -1 1 328.368 4.216 20 0 EIADMM O=C(c1ccc(C(F)(F)F)cc1[O-])N1CCCc2cc(F)ccc21 ZINC000436788956 1041481804 /nfs/dbraw/zinc/48/18/04/1041481804.db2.gz AHUXCGZCRKMFTO-UHFFFAOYSA-N -1 1 339.288 4.143 20 0 EIADMM CCCCN(CC(F)(F)F)C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436790951 1041483932 /nfs/dbraw/zinc/48/39/32/1041483932.db2.gz HZLHBFVYYWDWSC-UHFFFAOYSA-N -1 1 343.267 4.216 20 0 EIADMM COc1ccc(C(=O)Nc2ccccc2COc2ccccc2)c([O-])c1 ZINC000436816949 1041487329 /nfs/dbraw/zinc/48/73/29/1041487329.db2.gz VAPFKTKMBVTZFB-UHFFFAOYSA-N -1 1 349.386 4.232 20 0 EIADMM CO[C@H]1CCOc2c(NC(=O)c3cc4ccccc4cc3[O-])cccc21 ZINC000436812294 1041494105 /nfs/dbraw/zinc/49/41/05/1041494105.db2.gz LMZXIPCQIKZBNW-IBGZPJMESA-N -1 1 349.386 4.268 20 0 EIADMM CC(C)(CNC(=O)c1ccc([O-])cc1F)c1cccc(Cl)c1F ZINC000436825219 1041502966 /nfs/dbraw/zinc/50/29/66/1041502966.db2.gz KIGRDMQNJSAQEP-UHFFFAOYSA-N -1 1 339.769 4.031 20 0 EIADMM Cc1ccc([C@H]2CCN(C(=O)c3cc(Cl)ccc3[O-])C2)c(C)c1 ZINC000436851154 1041518545 /nfs/dbraw/zinc/51/85/45/1041518545.db2.gz KAZZELZBAOPYHK-AWEZNQCLSA-N -1 1 329.827 4.292 20 0 EIADMM C[C@H](Cn1ccc2ccccc21)c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000436870815 1041530548 /nfs/dbraw/zinc/53/05/48/1041530548.db2.gz GCCOTOUYPYMKSB-GFCCVEGCSA-N -1 1 337.354 4.340 20 0 EIADMM C[C@@]1(c2ccccc2)CCCN(C(=O)c2cc(F)ccc2[O-])CC1 ZINC000436858575 1041534866 /nfs/dbraw/zinc/53/48/66/1041534866.db2.gz OUDJLINEDWNLSA-HXUWFJFHSA-N -1 1 327.399 4.115 20 0 EIADMM CC1(C)CN(C(=O)c2cc3ccccc3cc2[O-])[C@@H]1c1ccncc1 ZINC000436878033 1041536285 /nfs/dbraw/zinc/53/62/85/1041536285.db2.gz BGNCUSOKRMQLSK-LJQANCHMSA-N -1 1 332.403 4.164 20 0 EIADMM COc1ccc2occ(-c3nc(-c4ccc([O-])cc4F)no3)c2c1 ZINC000436879028 1041537957 /nfs/dbraw/zinc/53/79/57/1041537957.db2.gz MCEGEDMBBSPWHC-UHFFFAOYSA-N -1 1 326.283 4.003 20 0 EIADMM C[C@H](Cc1cncc2ccccc21)c1nc(-c2ccc([O-])cc2F)no1 ZINC000436880497 1041539765 /nfs/dbraw/zinc/53/97/65/1041539765.db2.gz RHSNSUUJDWWUKX-GFCCVEGCSA-N -1 1 349.365 4.476 20 0 EIADMM Cn1ncc2ccc(-c3noc(-c4ccc5ccccc5c4[O-])n3)cc21 ZINC000436933475 1041565652 /nfs/dbraw/zinc/56/56/52/1041565652.db2.gz UEWHBMNOEKVMJH-UHFFFAOYSA-N -1 1 342.358 4.149 20 0 EIADMM COc1cccc(C2=CCN(C(=O)c3cc4ccccc4cc3[O-])C2)c1 ZINC000436959999 1041576690 /nfs/dbraw/zinc/57/66/90/1041576690.db2.gz FZHJUNTYUDFLMS-UHFFFAOYSA-N -1 1 345.398 4.093 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N1CC2(CCC2)[C@H]1c1ccccc1 ZINC000436977588 1041579646 /nfs/dbraw/zinc/57/96/46/1041579646.db2.gz FUULXOWWTHGSBD-QGZVFWFLSA-N -1 1 327.811 4.413 20 0 EIADMM O=C(N[C@H](CC1CCCC1)c1ccccc1)C(=O)c1ccc([O-])cc1 ZINC000436968514 1041582623 /nfs/dbraw/zinc/58/26/23/1041582623.db2.gz VTODSRKPUANQQV-LJQANCHMSA-N -1 1 337.419 4.013 20 0 EIADMM CCCOc1ccc(-c2noc(-c3cc(F)ccc3[O-])n2)cc1OC ZINC000436994806 1041585108 /nfs/dbraw/zinc/58/51/08/1041585108.db2.gz ASVUIZWUEYPPIK-UHFFFAOYSA-N -1 1 344.342 4.046 20 0 EIADMM O=C(N[C@H](CC(F)(F)F)c1ccc(F)cc1)c1c([O-])cccc1F ZINC000436986391 1041588047 /nfs/dbraw/zinc/58/80/47/1041588047.db2.gz FUJYOPRHSUCMNX-GFCCVEGCSA-N -1 1 345.267 4.094 20 0 EIADMM CCn1c2ccccc2nc1[C@@H]1CCCN1Cc1ccccc1C(=O)[O-] ZINC000517241332 1041920324 /nfs/dbraw/zinc/92/03/24/1041920324.db2.gz UJFQSJGKDPCBHO-IBGZPJMESA-N -1 1 349.434 4.092 20 0 EIADMM COc1cc(C(=O)N2CCC(C)(C)c3ccccc32)cc(Cl)c1[O-] ZINC000425938605 1042005951 /nfs/dbraw/zinc/00/59/51/1042005951.db2.gz AMYNFUDGBYBONF-UHFFFAOYSA-N -1 1 345.826 4.382 20 0 EIADMM Cc1c(F)cccc1S(=O)(=O)[N-]c1ccc(C(=O)C(C)(C)C)cc1 ZINC000425958587 1042085231 /nfs/dbraw/zinc/08/52/31/1042085231.db2.gz OFRUVYCCVVCIOZ-UHFFFAOYSA-N -1 1 349.427 4.164 20 0 EIADMM CCc1nc(SCc2cc(-c3cccs3)on2)[n-]c(=O)c1C ZINC000517759071 1042168843 /nfs/dbraw/zinc/16/88/43/1042168843.db2.gz HTLNWUWNGKHAPN-UHFFFAOYSA-N -1 1 333.438 4.062 20 0 EIADMM CCOCc1ccc([N-]S(=O)(=O)c2ccc(C(C)(C)C)cc2)cc1 ZINC000438716132 1042320146 /nfs/dbraw/zinc/32/01/46/1042320146.db2.gz HHEASFORYMNLKQ-UHFFFAOYSA-N -1 1 347.480 4.321 20 0 EIADMM CCOCc1ccc([N-]S(=O)(=O)c2ccccc2C(C)(C)C)cc1 ZINC000438734412 1042324452 /nfs/dbraw/zinc/32/44/52/1042324452.db2.gz YBGQEQAVMZQKSL-UHFFFAOYSA-N -1 1 347.480 4.321 20 0 EIADMM CCCCC[C@H]1CCCN1C(=O)c1ccc(Br)c([O-])c1 ZINC000491823459 1042502451 /nfs/dbraw/zinc/50/24/51/1042502451.db2.gz BGVFCKBFEZWEDW-ZDUSSCGKSA-N -1 1 340.261 4.340 20 0 EIADMM CC(C)COc1ccc([N-]S(=O)(=O)c2ccsc2)cc1Cl ZINC000506722430 1042808767 /nfs/dbraw/zinc/80/87/67/1042808767.db2.gz UUCMRQPGNHUBDW-UHFFFAOYSA-N -1 1 345.873 4.237 20 0 EIADMM C[C@H]1CCC[C@@H]1[N-]S(=O)(=O)c1c(Cl)cc(Cl)cc1Cl ZINC000520555855 1042887291 /nfs/dbraw/zinc/88/72/91/1042887291.db2.gz UZAFVZGJEGJVHI-CPCISQLKSA-N -1 1 342.675 4.114 20 0 EIADMM C[C@H](c1ccc(Cl)cc1Cl)N1CCC2(C[C@H]2C(=O)[O-])CC1 ZINC000405350634 1042950043 /nfs/dbraw/zinc/95/00/43/1042950043.db2.gz CJCHPAMUIDAGJL-MFKMUULPSA-N -1 1 328.239 4.241 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc3oc(C(C)C)nc3c2)cc1C ZINC000032097625 1043021761 /nfs/dbraw/zinc/02/17/61/1043021761.db2.gz RAZBEYSGVWLXNQ-UHFFFAOYSA-N -1 1 344.436 4.369 20 0 EIADMM Cc1ccc(Oc2ccc(-c3nc4cccnc4c(=O)[n-]3)cc2)cc1 ZINC000491606870 1043060476 /nfs/dbraw/zinc/06/04/76/1043060476.db2.gz JLNXEDQJNFNRKP-UHFFFAOYSA-N -1 1 329.359 4.086 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2cc(C(F)(F)F)ccc2F)s1 ZINC000076195178 1043071077 /nfs/dbraw/zinc/07/10/77/1043071077.db2.gz XMHPINWMVSRBGU-UHFFFAOYSA-N -1 1 339.335 4.015 20 0 EIADMM COc1cccc(CSc2nc(-c3ccccc3)c(C)c(=O)[n-]2)c1 ZINC000185048988 1043151967 /nfs/dbraw/zinc/15/19/67/1043151967.db2.gz WWLBXUWJWHDLJR-UHFFFAOYSA-N -1 1 338.432 4.046 20 0 EIADMM O=S(=O)(/C=C/c1ccccc1Cl)[N-]c1cccc2cccnc21 ZINC000727352777 1043203654 /nfs/dbraw/zinc/20/36/54/1043203654.db2.gz KNLBCKRMOIIAIX-ZRDIBKRKSA-N -1 1 344.823 4.301 20 0 EIADMM O=S(=O)([N-]c1ccsc1Cl)c1csc2ccccc21 ZINC000507969398 1043211167 /nfs/dbraw/zinc/21/11/67/1043211167.db2.gz LSFSCXSDNBHKFY-UHFFFAOYSA-N -1 1 329.855 4.417 20 0 EIADMM Cc1ccc(CSc2nc(-c3ccccc3)c(C)c(=O)[n-]2)c(C)n1 ZINC000186699412 1043304264 /nfs/dbraw/zinc/30/42/64/1043304264.db2.gz WPHUMOHLZSRYBA-UHFFFAOYSA-N -1 1 337.448 4.049 20 0 EIADMM [O-]c1cccnc1-c1nc(-c2cccc(C(F)(F)F)c2Cl)no1 ZINC001212480703 1043437878 /nfs/dbraw/zinc/43/78/78/1043437878.db2.gz DBMOSGAPDGVBQY-UHFFFAOYSA-N -1 1 341.676 4.176 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)Nc1ccccc1OC(F)F ZINC000190921055 1043748365 /nfs/dbraw/zinc/74/83/65/1043748365.db2.gz OSGBSCIBBOAHQH-UHFFFAOYSA-N -1 1 328.702 4.291 20 0 EIADMM O=C(Nc1cccc(OC(F)F)c1)Nc1ccc([O-])c(Cl)c1 ZINC000190934734 1043751674 /nfs/dbraw/zinc/75/16/74/1043751674.db2.gz LQRXAVWRMCLRML-UHFFFAOYSA-N -1 1 328.702 4.291 20 0 EIADMM COc1cc(C(=O)NCc2cccc3ccccc32)cc(Cl)c1[O-] ZINC000442861309 1043864431 /nfs/dbraw/zinc/86/44/31/1043864431.db2.gz UBXJGVOJZKOPRV-UHFFFAOYSA-N -1 1 341.794 4.137 20 0 EIADMM CCOc1ccc(NC(=O)Nc2ccc([O-])c(Cl)c2)cc1OC ZINC000192176300 1043889927 /nfs/dbraw/zinc/88/99/27/1043889927.db2.gz QSSWVMKRJFJJCZ-UHFFFAOYSA-N -1 1 336.775 4.097 20 0 EIADMM CC[C@H](C)[C@@H]1CCCCN1C(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC000442961387 1043919793 /nfs/dbraw/zinc/91/97/93/1043919793.db2.gz FETPIZPUACJIPB-FZMZJTMJSA-N -1 1 325.836 4.095 20 0 EIADMM COc1cc(-c2nc(-c3ccc(C)c(F)c3)no2)cc(Cl)c1[O-] ZINC000443085632 1043998067 /nfs/dbraw/zinc/99/80/67/1043998067.db2.gz CJLVQPGABSTWHU-UHFFFAOYSA-N -1 1 334.734 4.219 20 0 EIADMM COc1cc(C(=O)N[C@@H](C)c2c(C)cccc2C)cc(Cl)c1[O-] ZINC000443112972 1044031008 /nfs/dbraw/zinc/03/10/08/1044031008.db2.gz HPCCAFQFNRVMSL-LBPRGKRZSA-N -1 1 333.815 4.162 20 0 EIADMM O=C(Nc1ccc(Oc2ccccc2Cl)cc1)c1cncc([O-])c1 ZINC000521913182 1044070922 /nfs/dbraw/zinc/07/09/22/1044070922.db2.gz IXTXPORAPWIIIV-UHFFFAOYSA-N -1 1 340.766 4.485 20 0 EIADMM CCc1ccc(CC)c(NC(=O)c2cc(Cl)c([O-])c(OC)c2)c1 ZINC000443323478 1044192903 /nfs/dbraw/zinc/19/29/03/1044192903.db2.gz RTEVCHZGELGYRO-UHFFFAOYSA-N -1 1 333.815 4.431 20 0 EIADMM O=C(c1cc(F)ccc1[O-])N(Cc1ccco1)Cc1cccs1 ZINC000093944958 1044443389 /nfs/dbraw/zinc/44/33/89/1044443389.db2.gz VQAJDYNLCGYDRZ-UHFFFAOYSA-N -1 1 331.368 4.028 20 0 EIADMM Cc1nc(SCc2cc(-c3ccccc3)on2)[n-]c(=O)c1C1CC1 ZINC000631025068 1044493181 /nfs/dbraw/zinc/49/31/81/1044493181.db2.gz OIZLDYLUADJCNJ-UHFFFAOYSA-N -1 1 339.420 4.315 20 0 EIADMM CCCN(CCc1ccccn1)C(=O)c1cc2ccccc2cc1[O-] ZINC000094069199 1044503671 /nfs/dbraw/zinc/50/36/71/1044503671.db2.gz WARRALUUCAQDQA-UHFFFAOYSA-N -1 1 334.419 4.035 20 0 EIADMM Cc1cc(Sc2ccccc2)ccc1NC(=O)c1cncc([O-])c1 ZINC000550558290 1044634982 /nfs/dbraw/zinc/63/49/82/1044634982.db2.gz GAKINRIZSPQCFX-UHFFFAOYSA-N -1 1 336.416 4.499 20 0 EIADMM CN(C(=O)C1CC1)c1ccc(NCc2cccc([O-])c2Cl)cc1 ZINC000922567735 1044814756 /nfs/dbraw/zinc/81/47/56/1044814756.db2.gz SWBROCFEKBYJEO-UHFFFAOYSA-N -1 1 330.815 4.031 20 0 EIADMM O=C([N-]c1nnc(C2CCCCC2)s1)c1cncc(F)c1Cl ZINC000895600009 1044820025 /nfs/dbraw/zinc/82/00/25/1044820025.db2.gz PLOILRVQWSSMGB-UHFFFAOYSA-N -1 1 340.811 4.026 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2cc(C)c(O)c(C)c2C)c(Cl)c1 ZINC000187058346 1044895230 /nfs/dbraw/zinc/89/52/30/1044895230.db2.gz BXYZKKHQWHBOQS-UHFFFAOYSA-N -1 1 339.844 4.080 20 0 EIADMM O=C([O-])C[C@H](NCc1nc(-c2ccccc2)cs1)c1cccs1 ZINC000321182439 1045174779 /nfs/dbraw/zinc/17/47/79/1045174779.db2.gz ZQSSNLBJDWJQSV-ZDUSSCGKSA-N -1 1 344.461 4.177 20 0 EIADMM O=C(N[C@H]1C[C@@H]1c1c(F)cccc1Cl)c1c([O-])cccc1Cl ZINC000740928967 1045243064 /nfs/dbraw/zinc/24/30/64/1045243064.db2.gz VPJIMAZRADCMCA-UFBFGSQYSA-N -1 1 340.181 4.124 20 0 EIADMM [O-]c1ccc(-c2nc(-c3ccccc3Br)no2)c(F)c1 ZINC000236575039 1045359141 /nfs/dbraw/zinc/35/91/41/1045359141.db2.gz PAKRRSCDNPRZST-UHFFFAOYSA-N -1 1 335.132 4.011 20 0 EIADMM O=C(N[C@H](c1ccc(F)cc1)C(F)(F)F)c1c([O-])cccc1Cl ZINC000791683539 1045801902 /nfs/dbraw/zinc/80/19/02/1045801902.db2.gz QJSOKZIMARBRJP-CYBMUJFWSA-N -1 1 347.695 4.218 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@H](c1ccncc1)C1CCCC1 ZINC000901162312 1045809257 /nfs/dbraw/zinc/80/92/57/1045809257.db2.gz IESOHDRJELDZJO-KRWDZBQOSA-N -1 1 330.815 4.353 20 0 EIADMM CC(C)c1cccc([N-]S(=O)(=O)c2ccc(F)c3ncccc23)c1 ZINC000032588525 1045827027 /nfs/dbraw/zinc/82/70/27/1045827027.db2.gz QCKCEQDAJASKID-UHFFFAOYSA-N -1 1 344.411 4.298 20 0 EIADMM O=S(=O)(/C=C\c1cccc(Cl)c1)[N-]c1cccc2cccnc21 ZINC000768860808 1045857307 /nfs/dbraw/zinc/85/73/07/1045857307.db2.gz DOOAEDLUNLRJPH-LUAWRHEFSA-N -1 1 344.823 4.301 20 0 EIADMM CCC(CC)(C(=O)NCCc1c(F)cc([O-])cc1F)c1ccccc1 ZINC001156713739 1045897824 /nfs/dbraw/zinc/89/78/24/1045897824.db2.gz BPQSJZJDMGUJSR-UHFFFAOYSA-N -1 1 347.405 4.087 20 0 EIADMM C[C@@H](SCCC[N-]C(=O)C(F)(F)F)c1ccc(Cl)cc1 ZINC000769351084 1045934603 /nfs/dbraw/zinc/93/46/03/1045934603.db2.gz BUFTZIVQRNLRBJ-SECBINFHSA-N -1 1 325.783 4.203 20 0 EIADMM CCN(C(=O)c1c([O-])cccc1Cl)[C@@H](C)c1cccc(OC)c1 ZINC000769692001 1046047412 /nfs/dbraw/zinc/04/74/12/1046047412.db2.gz LNPBUDTYFRVXIU-LBPRGKRZSA-N -1 1 333.815 4.278 20 0 EIADMM Cc1csc(C2(NC(=O)c3c([O-])cccc3Cl)CCCC2)n1 ZINC000769831583 1046087878 /nfs/dbraw/zinc/08/78/78/1046087878.db2.gz KRWBWFUNCPQLMG-UHFFFAOYSA-N -1 1 336.844 4.010 20 0 EIADMM CN(C)c1cccc([C@@H]2CCCN2C(=O)c2c([O-])cccc2Cl)c1 ZINC000769873693 1046101668 /nfs/dbraw/zinc/10/16/68/1046101668.db2.gz VIUHBILHHCBDCW-INIZCTEOSA-N -1 1 344.842 4.089 20 0 EIADMM O=c1cc(C(F)(F)F)nc(SCc2ccc3ccccc3n2)[n-]1 ZINC000127004964 1046201089 /nfs/dbraw/zinc/20/10/89/1046201089.db2.gz JOVQSUUHGPLYHX-UHFFFAOYSA-N -1 1 337.326 4.042 20 0 EIADMM C[C@@H]1CN(Cc2cccc([O-])c2Cl)C[C@H](c2ccc(F)cc2)O1 ZINC000508720155 1046392277 /nfs/dbraw/zinc/39/22/77/1046392277.db2.gz PRVHEAOBEXRREM-SJKOYZFVSA-N -1 1 335.806 4.147 20 0 EIADMM Cc1csc2nc(-c3ccc(C(F)(F)F)c(F)c3)[n-]c(=O)c12 ZINC000127908973 1046735289 /nfs/dbraw/zinc/73/52/89/1046735289.db2.gz YZRHVOMLLZCWIR-UHFFFAOYSA-N -1 1 328.290 4.118 20 0 EIADMM O=C(c1ccc([O-])cc1)C1CCN(Cc2cc(Cl)cs2)CC1 ZINC000787083053 1046902996 /nfs/dbraw/zinc/90/29/96/1046902996.db2.gz SZYRWRZBHFLRHQ-UHFFFAOYSA-N -1 1 335.856 4.202 20 0 EIADMM COc1cc(C(=O)Nc2cccc(C(F)F)c2)cc(Cl)c1[O-] ZINC000460195242 1047154665 /nfs/dbraw/zinc/15/46/65/1047154665.db2.gz RLVIUBGZWQZPLN-UHFFFAOYSA-N -1 1 327.714 4.244 20 0 EIADMM Cc1cnc(C(=O)N(C)[C@H](C)c2ccc(Cl)cc2Cl)c([O-])c1 ZINC000460293964 1047291078 /nfs/dbraw/zinc/29/10/78/1047291078.db2.gz QVQDJCOMNYMRJR-SNVBAGLBSA-N -1 1 339.222 4.236 20 0 EIADMM CCCCC[C@H](NC(=O)C(=O)c1ccc([O-])cc1)c1ccccc1 ZINC000806777250 1047358992 /nfs/dbraw/zinc/35/89/92/1047358992.db2.gz ZPQFXAWARZBKLA-SFHVURJKSA-N -1 1 325.408 4.013 20 0 EIADMM Cc1ccccc1[N-]S(=O)(=O)c1cc(C(F)(F)F)ccc1C ZINC000476278176 1047444043 /nfs/dbraw/zinc/44/40/43/1047444043.db2.gz QVNFXZFETDGVKB-UHFFFAOYSA-N -1 1 329.343 4.123 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2ccccc2SC(F)F)ccc1F ZINC000729836185 1047447342 /nfs/dbraw/zinc/44/73/42/1047447342.db2.gz JBYUSPUXJQXGAT-UHFFFAOYSA-N -1 1 347.383 4.250 20 0 EIADMM Cc1nc(-c2ccsc2)ccc1C(=O)Nc1nc(Cl)ccc1[O-] ZINC000789930247 1047486988 /nfs/dbraw/zinc/48/69/88/1047486988.db2.gz OZAGWXPQSKHSSP-UHFFFAOYSA-N -1 1 345.811 4.125 20 0 EIADMM O=C(c1c([O-])cccc1Cl)N1CCCn2c(cc3ccccc32)C1 ZINC000807888063 1047530338 /nfs/dbraw/zinc/53/03/38/1047530338.db2.gz CGUYEFQKDRVIQO-UHFFFAOYSA-N -1 1 340.810 4.046 20 0 EIADMM O=C(Nc1cc(F)cc(F)c1[O-])c1ccnc(Oc2ccccc2)c1 ZINC001142542978 1047603528 /nfs/dbraw/zinc/60/35/28/1047603528.db2.gz XYGBWXCWAMJFMP-UHFFFAOYSA-N -1 1 342.301 4.110 20 0 EIADMM CC(C)(C)c1ccccc1S(=O)(=O)[N-]c1ccc2[nH]ccc2c1 ZINC000460426789 1047797475 /nfs/dbraw/zinc/79/74/75/1047797475.db2.gz LGNNXDIQQXGEPJ-UHFFFAOYSA-N -1 1 328.437 4.266 20 0 EIADMM CCCc1nc(C)c(C(=O)[N-]c2nc(-c3ccc(C)s3)ns2)o1 ZINC000550671076 1047810847 /nfs/dbraw/zinc/81/08/47/1047810847.db2.gz QFLABCBBEOOIDC-UHFFFAOYSA-N -1 1 348.453 4.076 20 0 EIADMM CCc1ccc([C@H]2C[C@H](C)CCN2C(=O)c2ccc([O-])c(F)c2)o1 ZINC001137026361 1048077489 /nfs/dbraw/zinc/07/74/89/1048077489.db2.gz ICMKVUCMIOJDGD-MLGOLLRUSA-N -1 1 331.387 4.300 20 0 EIADMM Cc1ccsc1-c1nsc([N-]C(=O)c2c(F)cccc2F)n1 ZINC000131718856 1048121165 /nfs/dbraw/zinc/12/11/65/1048121165.db2.gz MPVCNWGNYXLQLU-UHFFFAOYSA-N -1 1 337.376 4.106 20 0 EIADMM Cc1ccccc1S(=O)(=O)[N-]c1cccc(CCC(F)(F)F)c1 ZINC000131921700 1048169329 /nfs/dbraw/zinc/16/93/29/1048169329.db2.gz NDZAFBCYUWUBMO-UHFFFAOYSA-N -1 1 343.370 4.291 20 0 EIADMM O=S(=O)([N-]c1cccc(CCC(F)(F)F)c1)c1cccc(F)c1 ZINC000131937636 1048172037 /nfs/dbraw/zinc/17/20/37/1048172037.db2.gz YEWAFVMJGSCXNU-UHFFFAOYSA-N -1 1 347.333 4.121 20 0 EIADMM O=C(N[C@H]1CCO[C@H](c2ccccc2)C1)c1cc2ccccc2cc1[O-] ZINC000132017675 1048182277 /nfs/dbraw/zinc/18/22/77/1048182277.db2.gz GBELBFYNXFRNKL-RXVVDRJESA-N -1 1 347.414 4.196 20 0 EIADMM Cc1ccc(F)c(C(=O)[N-]c2nnc(-c3ccccc3)s2)c1F ZINC000499138000 1048336979 /nfs/dbraw/zinc/33/69/79/1048336979.db2.gz WQYFYJZEJPRPKN-UHFFFAOYSA-N -1 1 331.347 4.044 20 0 EIADMM CC(C)c1ccc(S(=O)(=O)[N-]c2ccc3scnc3c2)cc1 ZINC000499230811 1048446903 /nfs/dbraw/zinc/44/69/03/1048446903.db2.gz TWTGFCRVWBBATC-UHFFFAOYSA-N -1 1 332.450 4.221 20 0 EIADMM O=c1cc(C(F)F)nc(SCCSc2ccccc2F)[n-]1 ZINC000809987264 1048588772 /nfs/dbraw/zinc/58/87/72/1048588772.db2.gz UDXNQYUCPDFQIV-UHFFFAOYSA-N -1 1 332.372 4.143 20 0 EIADMM CCC(C)(C)CCNC(=O)c1cc(-c2ccc(C=O)o2)ccc1[O-] ZINC001170800022 1048594953 /nfs/dbraw/zinc/59/49/53/1048594953.db2.gz VKVZFRYMDIHVER-UHFFFAOYSA-N -1 1 329.396 4.021 20 0 EIADMM C[C@@H]1OC2(CCN(Cc3c(F)cc([O-])cc3F)CC2)c2ccccc21 ZINC001144567102 1048732504 /nfs/dbraw/zinc/73/25/04/1048732504.db2.gz CYNVXFLZQZIGKF-ZDUSSCGKSA-N -1 1 345.389 4.253 20 0 EIADMM CN(Cc1ccccc1C(F)(F)F)Cc1cc(F)c([O-])cc1F ZINC001144658259 1048793597 /nfs/dbraw/zinc/79/35/97/1048793597.db2.gz USBLVGQEOPLTLB-UHFFFAOYSA-N -1 1 331.284 4.321 20 0 EIADMM O=C([O-])c1ccsc1CN1CCC[C@@H]1c1ccc(Cl)s1 ZINC001144678405 1048800371 /nfs/dbraw/zinc/80/03/71/1048800371.db2.gz ZAJCAOKFWRFTGK-SNVBAGLBSA-N -1 1 327.858 4.498 20 0 EIADMM O=C(Oc1ccc2nccnc2c1)c1cc2cc(Cl)sc2[n-]1 ZINC000810644198 1048839220 /nfs/dbraw/zinc/83/92/20/1048839220.db2.gz UVVVSLNDKFSPEA-UHFFFAOYSA-N -1 1 329.768 4.045 20 0 EIADMM CCOc1cccc2cc([C@@H](C)NC(=O)c3ccc([O-])cc3F)oc21 ZINC001135662390 1048852983 /nfs/dbraw/zinc/85/29/83/1048852983.db2.gz RPBYSSKXXXKDJA-LLVKDONJSA-N -1 1 343.354 4.167 20 0 EIADMM O=C([N-][C@H](c1ccccc1)C(F)F)C(F)(F)c1ccccc1F ZINC000817223503 1048909931 /nfs/dbraw/zinc/90/99/31/1048909931.db2.gz UTUUOGUPOYCUKI-CYBMUJFWSA-N -1 1 329.268 4.040 20 0 EIADMM Cc1noc(C)c1C[N-]C(=O)C(F)(F)c1cc(Cl)ccc1Cl ZINC000817428901 1048973268 /nfs/dbraw/zinc/97/32/68/1048973268.db2.gz ANIZJMUXNBOZQM-UHFFFAOYSA-N -1 1 349.164 4.006 20 0 EIADMM O=C(c1c([O-])cnc2c(F)cccc21)N1CCC[C@@H]1c1ccccc1 ZINC001135937769 1048996815 /nfs/dbraw/zinc/99/68/15/1048996815.db2.gz ZQZPPXMDHKRGIJ-MRXNPFEDSA-N -1 1 336.366 4.057 20 0 EIADMM C[C@@H](NC(=O)c1ccc(Cl)cc1[O-])c1ccccc1OC(F)F ZINC001135939581 1049000665 /nfs/dbraw/zinc/00/06/65/1049000665.db2.gz HNBCEHQXYQONCX-SECBINFHSA-N -1 1 341.741 4.138 20 0 EIADMM O=C(Nc1ccccc1N1CCc2ccccc21)c1ccc([O-])c(F)c1 ZINC001136082069 1049080732 /nfs/dbraw/zinc/08/07/32/1049080732.db2.gz ZYOHAIWEPUJALR-UHFFFAOYSA-N -1 1 348.377 4.478 20 0 EIADMM O=C(Cc1ccc([O-])c(Cl)c1)N(Cc1ccccc1F)CC1CC1 ZINC001147873346 1049231393 /nfs/dbraw/zinc/23/13/93/1049231393.db2.gz UGBPGQBDSDMOAR-UHFFFAOYSA-N -1 1 347.817 4.166 20 0 EIADMM Cc1cc(C)c(CNC(=O)c2ccc(C(F)(F)F)c([O-])c2)c(C)c1 ZINC001136181174 1049244070 /nfs/dbraw/zinc/24/40/70/1049244070.db2.gz DLSQHARUKKCXNO-UHFFFAOYSA-N -1 1 337.341 4.266 20 0 EIADMM Cc1ccc([C@@H](C)N(C)C(=O)c2ncc3ccccc3c2[O-])c(C)c1 ZINC001136186478 1049248268 /nfs/dbraw/zinc/24/82/68/1049248268.db2.gz NLGQKDUEJOYVNQ-OAHLLOKOSA-N -1 1 334.419 4.390 20 0 EIADMM CC[C@H](C)c1ccc(S(=O)(=O)[N-]c2ccc3[nH]ccc3c2)cc1 ZINC000078677292 1049268023 /nfs/dbraw/zinc/26/80/23/1049268023.db2.gz QQWOJFJCDAVWIM-ZDUSSCGKSA-N -1 1 328.437 4.482 20 0 EIADMM O=C([N-]c1ccc(-c2ccccc2)cc1F)c1nnc(-c2ccco2)o1 ZINC001136195266 1049273107 /nfs/dbraw/zinc/27/31/07/1049273107.db2.gz MHLBPEPXWPISIU-UHFFFAOYSA-N -1 1 349.321 4.388 20 0 EIADMM O=Cc1cc(C(=O)Nc2cc(Cl)c([O-])c3ccccc23)cs1 ZINC001148251813 1049289070 /nfs/dbraw/zinc/28/90/70/1049289070.db2.gz CALSIEJDTIDZGV-UHFFFAOYSA-N -1 1 331.780 4.325 20 0 EIADMM CCc1ncsc1C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC001148253975 1049289333 /nfs/dbraw/zinc/28/93/33/1049289333.db2.gz YQPCOCKSGULHRP-UHFFFAOYSA-N -1 1 332.812 4.470 20 0 EIADMM CCCCOc1ccc(CCNC(=O)c2ccc(Cl)cc2[O-])cc1 ZINC001136268563 1049377933 /nfs/dbraw/zinc/37/79/33/1049377933.db2.gz TXHHEUOMAOTLOJ-UHFFFAOYSA-N -1 1 347.842 4.197 20 0 EIADMM O=C(Nc1nsc2ncccc12)c1cccc(-c2ccccc2)c1[O-] ZINC001148861660 1049391583 /nfs/dbraw/zinc/39/15/83/1049391583.db2.gz UCXLYYSPYJOWMJ-UHFFFAOYSA-N -1 1 347.399 4.316 20 0 EIADMM COCc1ccc(CNC(=O)c2cccc(-c3ccccc3)c2[O-])cc1 ZINC001148871779 1049392837 /nfs/dbraw/zinc/39/28/37/1049392837.db2.gz DLSQDUWEILJCEW-UHFFFAOYSA-N -1 1 347.414 4.136 20 0 EIADMM O=C(N[C@H]1COCc2ccccc21)c1cccc(-c2ccccc2)c1[O-] ZINC001148872507 1049392910 /nfs/dbraw/zinc/39/29/10/1049392910.db2.gz JTQXDAXEWNSIRP-FQEVSTJZSA-N -1 1 345.398 4.061 20 0 EIADMM Cc1cc(Cl)cnc1[N-]S(=O)(=O)/C=C/c1ccccc1Cl ZINC000812331017 1049429100 /nfs/dbraw/zinc/42/91/00/1049429100.db2.gz FEBRUBQTJFOARR-VOTSOKGWSA-N -1 1 343.235 4.109 20 0 EIADMM Cc1cc(Cl)cnc1[N-]S(=O)(=O)/C=C/c1ccc(Cl)cc1 ZINC000812338808 1049444914 /nfs/dbraw/zinc/44/49/14/1049444914.db2.gz QTKGRAPEXLYBHO-VOTSOKGWSA-N -1 1 343.235 4.109 20 0 EIADMM Cc1ccccc1C[C@@H](C)C(=O)Nc1cccc([O-])c1Br ZINC001158832901 1049475598 /nfs/dbraw/zinc/47/55/98/1049475598.db2.gz VLTQTAMKOUSWAN-GFCCVEGCSA-N -1 1 348.240 4.280 20 0 EIADMM O=C(c1ccc2ccc(O)cc2c1[O-])N1CCC[C@@H]1C1CCCC1 ZINC001136347001 1049520390 /nfs/dbraw/zinc/52/03/90/1049520390.db2.gz HEPRRGIFFCEYBK-GOSISDBHSA-N -1 1 325.408 4.046 20 0 EIADMM CC(C)c1nsc([N-]C(=O)c2csc(-c3cccs3)n2)n1 ZINC001133406563 1049553271 /nfs/dbraw/zinc/55/32/71/1049553271.db2.gz VYPFLEPLFJQQCT-UHFFFAOYSA-N -1 1 336.467 4.099 20 0 EIADMM COc1cccc([O-])c1C(=O)Nc1cccc(OCCC(C)C)c1 ZINC001136416566 1049604062 /nfs/dbraw/zinc/60/40/62/1049604062.db2.gz WVXQBKUAWNACKH-UHFFFAOYSA-N -1 1 329.396 4.078 20 0 EIADMM CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1CNC(=O)Cc1ccc([O-])c(Cl)c1 ZINC001136488290 1049675625 /nfs/dbraw/zinc/67/56/25/1049675625.db2.gz KEKCURNHOTXDGB-BMFZPTHFSA-N -1 1 337.891 4.413 20 0 EIADMM COC(=O)Cc1ccc(Nc2cc(Cl)c(C)c(Cl)c2[O-])cc1 ZINC001212622283 1049752486 /nfs/dbraw/zinc/75/24/86/1049752486.db2.gz YLYQWQQVCGSKTC-UHFFFAOYSA-N -1 1 340.206 4.467 20 0 EIADMM C[C@@H](CC(=O)Nc1cccc(F)c1[O-])C(=O)c1ccc(Cl)cc1 ZINC001171632538 1049764024 /nfs/dbraw/zinc/76/40/24/1049764024.db2.gz FMXKTATUOQLNFR-JTQLQIEISA-N -1 1 335.762 4.032 20 0 EIADMM O=C(Nc1cccc(F)c1[O-])c1ccc(Nc2nccs2)cc1F ZINC001171637149 1049778767 /nfs/dbraw/zinc/77/87/67/1049778767.db2.gz LEUXOXRISKQRLU-UHFFFAOYSA-N -1 1 347.346 4.123 20 0 EIADMM CC[C@@H](C)CON=c1ccc(Br)c(C(F)(F)F)[n-]1 ZINC000813623587 1049801662 /nfs/dbraw/zinc/80/16/62/1049801662.db2.gz ZAIPWLLDLFLBCA-SSDOTTSWSA-N -1 1 327.144 4.253 20 0 EIADMM O=C(c1ccc(C(F)(F)F)c([O-])c1)N1Cc2cccc(Cl)c2C1 ZINC000813655883 1049806202 /nfs/dbraw/zinc/80/62/02/1049806202.db2.gz MTFKIDBDDOHAPK-UHFFFAOYSA-N -1 1 341.716 4.220 20 0 EIADMM O=C(Cc1ccc([O-])c(Cl)c1)N[C@@H](c1ccc(F)cc1)C1CCC1 ZINC001136690690 1049831356 /nfs/dbraw/zinc/83/13/56/1049831356.db2.gz RJXUUKSDGJXCNR-LJQANCHMSA-N -1 1 347.817 4.385 20 0 EIADMM CC(C)Oc1c(F)cc(F)c(Nc2ccnc(Cl)c2[O-])c1F ZINC001212644193 1049861800 /nfs/dbraw/zinc/86/18/00/1049861800.db2.gz OWAIPZIIUQSBNZ-UHFFFAOYSA-N -1 1 332.709 4.389 20 0 EIADMM CC(C)Oc1cc(F)ccc1Nc1cc2ccc([O-])cc2oc1=O ZINC001212292572 1049967879 /nfs/dbraw/zinc/96/78/79/1049967879.db2.gz VIKOXBVBCJLEKC-UHFFFAOYSA-N -1 1 329.327 4.169 20 0 EIADMM O=C(N=c1cc(-c2cccs2)[n-][nH]1)c1cc(Cl)sc1Cl ZINC000617365440 1049982638 /nfs/dbraw/zinc/98/26/38/1049982638.db2.gz ORPPASBXLMFIMA-UHFFFAOYSA-N -1 1 344.248 4.181 20 0 EIADMM Cc1c(F)cccc1S(=O)(=O)[N-]c1ccc(F)cc1C(C)C ZINC001185836211 1050168620 /nfs/dbraw/zinc/16/86/20/1050168620.db2.gz IQQRNRDWBGALNM-UHFFFAOYSA-N -1 1 325.380 4.197 20 0 EIADMM Cc1cc(F)ccc1[C@@H](C)NC(=O)c1c([O-])cnc2c(F)cccc21 ZINC001177316043 1050190406 /nfs/dbraw/zinc/19/04/06/1050190406.db2.gz TYEUTXOBUIMWHF-LLVKDONJSA-N -1 1 342.345 4.018 20 0 EIADMM COc1cnc(Br)c(Nc2c(F)ccc([O-])c2Cl)c1 ZINC001250228605 1050241101 /nfs/dbraw/zinc/24/11/01/1050241101.db2.gz GFZMPUKGDXUCNJ-UHFFFAOYSA-N -1 1 347.571 4.094 20 0 EIADMM O=C(Nc1cccc(C(F)(F)F)c1[O-])[C@@H]1C[C@@H]1c1cccs1 ZINC001177543979 1050249304 /nfs/dbraw/zinc/24/93/04/1050249304.db2.gz FBDSSFDKXALMNI-DTWKUNHWSA-N -1 1 327.327 4.215 20 0 EIADMM CCCCOc1c(NC(=O)c2ccc([O-])c(F)c2)ccc(F)c1F ZINC001186225987 1050264015 /nfs/dbraw/zinc/26/40/15/1050264015.db2.gz IIDAGBFEPFLWOI-UHFFFAOYSA-N -1 1 339.313 4.241 20 0 EIADMM Cc1cc(Oc2ccccc2)ncc1NC(=O)c1ccc([O-])cc1F ZINC001186318585 1050285769 /nfs/dbraw/zinc/28/57/69/1050285769.db2.gz LJIIXDJPWBOYAU-UHFFFAOYSA-N -1 1 338.338 4.279 20 0 EIADMM O=C(Nc1cccc(OC(F)(F)C(F)F)c1)c1ccc([O-])cc1F ZINC001186311572 1050294034 /nfs/dbraw/zinc/29/40/34/1050294034.db2.gz YDTBDWMKHAAUTE-UHFFFAOYSA-N -1 1 347.239 4.020 20 0 EIADMM [O-]c1cnccc1-c1nc(-c2ccc(Oc3ccccc3)cc2)no1 ZINC001212721347 1050430165 /nfs/dbraw/zinc/43/01/65/1050430165.db2.gz LMNBTBWWTHNKFC-UHFFFAOYSA-N -1 1 331.331 4.297 20 0 EIADMM O=C(Nc1cccc(Br)c1)Nc1cc(F)c(F)cc1[O-] ZINC001187463697 1050546925 /nfs/dbraw/zinc/54/69/25/1050546925.db2.gz ARMYUJHSESFUMA-UHFFFAOYSA-N -1 1 343.127 4.077 20 0 EIADMM Fc1cc(F)cc(-c2nsc([N-]c3cnn(C4CCC4)c3)n2)c1 ZINC001187740023 1050614942 /nfs/dbraw/zinc/61/49/42/1050614942.db2.gz UNNHPTKKHRMOKZ-UHFFFAOYSA-N -1 1 333.367 4.148 20 0 EIADMM CCCC[C@H](CCC)[N-]S(=O)(=O)c1cc(Cl)cnc1Cl ZINC001187751125 1050619210 /nfs/dbraw/zinc/61/92/10/1050619210.db2.gz FXXARMRZPFNRJZ-NSHDSACASA-N -1 1 339.288 4.026 20 0 EIADMM O=S(=O)([N-]c1cccc2ccc(-c3ccccc3)nc21)C1CCC1 ZINC001188138490 1050709200 /nfs/dbraw/zinc/70/92/00/1050709200.db2.gz CAWQEVXRQJRRFE-UHFFFAOYSA-N -1 1 338.432 4.196 20 0 EIADMM O=C(Nc1cc(F)c([O-])cc1Cl)c1cc(C2CCCCC2)[nH]n1 ZINC001179660583 1050739939 /nfs/dbraw/zinc/73/99/39/1050739939.db2.gz XUACJGVABMWXQG-UHFFFAOYSA-N -1 1 337.782 4.208 20 0 EIADMM O=C(c1ccc(Nc2cc(F)c([O-])cc2F)cc1)N1CCCCC1 ZINC001174071240 1050743700 /nfs/dbraw/zinc/74/37/00/1050743700.db2.gz FLSKBNKULHRQNZ-UHFFFAOYSA-N -1 1 332.350 4.040 20 0 EIADMM CN(C)C(=O)c1cccc(Nc2c(Cl)ccc([O-])c2Cl)c1 ZINC001174087483 1050763324 /nfs/dbraw/zinc/76/33/24/1050763324.db2.gz VUFXVKNDWVHZDZ-UHFFFAOYSA-N -1 1 325.195 4.144 20 0 EIADMM CC(C)(C)c1nnc([N-]c2ccc(C(=O)Nc3ccccc3)cc2)o1 ZINC001174160306 1050801107 /nfs/dbraw/zinc/80/11/07/1050801107.db2.gz VABPOMWKMRXRRN-UHFFFAOYSA-N -1 1 336.395 4.363 20 0 EIADMM O=C(Nc1ccccc1)c1cccc(Nc2ccnc(Cl)c2[O-])c1 ZINC001174206640 1050842356 /nfs/dbraw/zinc/84/23/56/1050842356.db2.gz DHJLXYBVUHLNOP-UHFFFAOYSA-N -1 1 339.782 4.437 20 0 EIADMM O=C(Nc1cccc(Cl)c1Cl)Nc1cc(Cl)ncc1[O-] ZINC001189202400 1050926075 /nfs/dbraw/zinc/92/60/75/1050926075.db2.gz QQAREOIZQTZMSH-UHFFFAOYSA-N -1 1 332.574 4.391 20 0 EIADMM CCS(=O)(=O)c1ccc(Nc2cc(Cl)cc(Cl)c2[O-])cc1 ZINC001174462881 1051006606 /nfs/dbraw/zinc/00/66/06/1051006606.db2.gz CKLDNZKZHQDMSU-UHFFFAOYSA-N -1 1 346.235 4.236 20 0 EIADMM Cc1ccccc1O[C@@H](C)C(=O)Nc1cccc(C(F)(F)F)c1[O-] ZINC001180520989 1051015213 /nfs/dbraw/zinc/01/52/13/1051015213.db2.gz BXZOLAFAAZXJMC-NSHDSACASA-N -1 1 339.313 4.125 20 0 EIADMM Cc1cccc(-c2nc3ccc(Oc4ccccc4)cc3c(=O)[n-]2)n1 ZINC000620127144 1051030018 /nfs/dbraw/zinc/03/00/18/1051030018.db2.gz WWMPIMFEGIBYAK-UHFFFAOYSA-N -1 1 329.359 4.498 20 0 EIADMM O=C(Nc1cccc(F)c1[O-])NC1c2ccccc2-c2ccccc21 ZINC001190039092 1051105048 /nfs/dbraw/zinc/10/50/48/1051105048.db2.gz ZASOJCNGZKENGW-UHFFFAOYSA-N -1 1 334.350 4.423 20 0 EIADMM O=C(Nc1ccc(OC(F)(F)F)cc1)Nc1c(F)cc([O-])cc1F ZINC001190743988 1051268676 /nfs/dbraw/zinc/26/86/76/1051268676.db2.gz NGCGCWLNVGEKFM-UHFFFAOYSA-N -1 1 348.227 4.213 20 0 EIADMM O=c1cc(CN2C3CCCC2CCC3)c2cc(Cl)c([O-])cc2o1 ZINC001191021617 1051328371 /nfs/dbraw/zinc/32/83/71/1051328371.db2.gz IELBLRNCEWUWGK-UHFFFAOYSA-N -1 1 333.815 4.059 20 0 EIADMM COc1cc(C(=O)Nc2c(C)ccc3cccnc32)cc(Cl)c1[O-] ZINC001191148253 1051364207 /nfs/dbraw/zinc/36/42/07/1051364207.db2.gz ZBHDNJDNEFWXIZ-UHFFFAOYSA-N -1 1 342.782 4.163 20 0 EIADMM Cc1[nH]nc(NC(=O)c2ccc3ccccc3c2[O-])c1-c1ccccc1 ZINC001181968786 1051371982 /nfs/dbraw/zinc/37/19/82/1051371982.db2.gz NUSRJYZDGKSQQF-UHFFFAOYSA-N -1 1 343.386 4.496 20 0 EIADMM COc1ccc(-c2nnsc2[N-]c2c(F)ccc(OC)c2F)cc1 ZINC001175118232 1051390294 /nfs/dbraw/zinc/39/02/94/1051390294.db2.gz WMJIVMNGYITWFE-UHFFFAOYSA-N -1 1 349.362 4.244 20 0 EIADMM O=C(Nc1cccc(C(F)(F)F)c1[O-])[C@H]1C[C@@H]1c1ccccc1F ZINC001182284748 1051467067 /nfs/dbraw/zinc/46/70/67/1051467067.db2.gz FPGZJVHVBQBMMO-MNOVXSKESA-N -1 1 339.288 4.292 20 0 EIADMM CC(=O)c1sc(C(C)(C)C)cc1[N-]S(=O)(=O)CC1CCCC1 ZINC001191488618 1051467552 /nfs/dbraw/zinc/46/75/52/1051467552.db2.gz FSIVYJCFFHDJDY-UHFFFAOYSA-N -1 1 343.514 4.180 20 0 EIADMM O=S(=O)([N-][C@@H](C1CCC1)C1CCCC1)c1sccc1Cl ZINC001191720668 1051519603 /nfs/dbraw/zinc/51/96/03/1051519603.db2.gz QCRTWGQJQBKBNE-CYBMUJFWSA-N -1 1 333.906 4.039 20 0 EIADMM Cc1cc(NC(=O)Nc2ccc(-n3ccc(=O)[n-]3)cc2)ccc1Cl ZINC001191771318 1051531007 /nfs/dbraw/zinc/53/10/07/1051531007.db2.gz WKUNIZPRYGJUDP-UHFFFAOYSA-N -1 1 342.786 4.184 20 0 EIADMM COc1ncc([N-]c2nc3cccc(Br)c3s2)s1 ZINC001175387409 1051567292 /nfs/dbraw/zinc/56/72/92/1051567292.db2.gz UHROSGBDRHQPAW-UHFFFAOYSA-N -1 1 342.243 4.268 20 0 EIADMM C[C@@H](NC(=O)c1cc2ccccc2cc1[O-])c1cc2cnccc2o1 ZINC001175437548 1051592709 /nfs/dbraw/zinc/59/27/09/1051592709.db2.gz LLRUUAYKNPCLTF-GFCCVEGCSA-N -1 1 332.359 4.178 20 0 EIADMM Cc1ccc(-c2nsc([N-]C(=O)c3coc(C(C)(C)C)n3)n2)s1 ZINC001182568305 1051639006 /nfs/dbraw/zinc/63/90/06/1051639006.db2.gz HSHRANRPZJUKJS-UHFFFAOYSA-N -1 1 348.453 4.113 20 0 EIADMM [O-]c1c(Br)ccc(Cl)c1Nc1cccc(CO)c1 ZINC001175516063 1051643907 /nfs/dbraw/zinc/64/39/07/1051643907.db2.gz KWVWOYQINOJSIZ-UHFFFAOYSA-N -1 1 328.593 4.044 20 0 EIADMM CC(C)c1ccccc1Nc1ccc(C(=O)Nc2ccncc2[O-])cc1 ZINC001182627139 1051651499 /nfs/dbraw/zinc/65/14/99/1051651499.db2.gz NSBONDPOJXVCLP-UHFFFAOYSA-N -1 1 347.418 4.328 20 0 EIADMM CC(=O)c1cccc(NC(=O)c2ccc(C(C)(C)C)cc2[O-])c1C ZINC001192335759 1051693548 /nfs/dbraw/zinc/69/35/48/1051693548.db2.gz NRDSOERDVUMGBC-UHFFFAOYSA-N -1 1 325.408 4.453 20 0 EIADMM O=C(NC1CC1)c1ccc(Nc2c(Cl)ccc([O-])c2Cl)cc1 ZINC001175608718 1051697803 /nfs/dbraw/zinc/69/78/03/1051697803.db2.gz MQHBANYSKDSYEL-UHFFFAOYSA-N -1 1 337.206 4.335 20 0 EIADMM CC[C@@H]([N-]C(=O)C(F)(F)c1ccc(F)cc1)c1ccc(F)c(F)c1 ZINC001182890707 1051735974 /nfs/dbraw/zinc/73/59/74/1051735974.db2.gz RWGMTIXLLFFOEO-OAHLLOKOSA-N -1 1 343.295 4.463 20 0 EIADMM O=C(Nc1cc(-c2cccc(F)c2)ccn1)c1c(F)ccc([O-])c1F ZINC001192524943 1051760934 /nfs/dbraw/zinc/76/09/34/1051760934.db2.gz QOZXQPXCQZEQJV-UHFFFAOYSA-N -1 1 344.292 4.124 20 0 EIADMM COCCOc1ccc(Nc2c(Cl)ccc([O-])c2Cl)cc1 ZINC001175788306 1051787542 /nfs/dbraw/zinc/78/75/42/1051787542.db2.gz SNLQNCPVOCXBRR-UHFFFAOYSA-N -1 1 328.195 4.468 20 0 EIADMM CCCc1ccc(CN[C@@H](CC(=O)[O-])c2ccc(F)cc2F)s1 ZINC000621247323 1051791786 /nfs/dbraw/zinc/79/17/86/1051791786.db2.gz OTGKPWCKXRMDRN-INIZCTEOSA-N -1 1 339.407 4.284 20 0 EIADMM O=C([O-])c1cncc(Nc2ccc3c(c2)CN(Cc2ccccc2)C3)c1 ZINC001175841779 1051801236 /nfs/dbraw/zinc/80/12/36/1051801236.db2.gz WTPUAKVRCYBGSG-UHFFFAOYSA-N -1 1 345.402 4.039 20 0 EIADMM [O-]c1c(Cl)nccc1Nc1cccnc1OCc1ccccc1 ZINC001175876449 1051808558 /nfs/dbraw/zinc/80/85/58/1051808558.db2.gz YLRIONMXZNTWNW-UHFFFAOYSA-N -1 1 327.771 4.158 20 0 EIADMM CCc1ccc(C(C)(C)C(=O)Nc2ccc(-n3ccc(=O)[n-]3)cc2)cc1 ZINC001183511322 1051861254 /nfs/dbraw/zinc/86/12/54/1051861254.db2.gz ZLPKCBLMUGTDBR-UHFFFAOYSA-N -1 1 349.434 4.057 20 0 EIADMM [O-]c1c(Cl)cc(Br)cc1Nc1cccc2c1OCC2 ZINC001176076999 1051888597 /nfs/dbraw/zinc/88/85/97/1051888597.db2.gz GDYAATPANOEOLE-UHFFFAOYSA-N -1 1 340.604 4.487 20 0 EIADMM O=C(OCc1csc(-c2ccc(F)cc2)n1)c1ccc([O-])cc1F ZINC000773564525 1051983798 /nfs/dbraw/zinc/98/37/98/1051983798.db2.gz FTDZPZXAFSVIGY-UHFFFAOYSA-N -1 1 347.342 4.151 20 0 EIADMM CC(C)c1cccc(C(C)C)c1[N-]S(=O)(=O)c1ccccc1N ZINC001193923804 1052028352 /nfs/dbraw/zinc/02/83/52/1052028352.db2.gz FTSUIQRUAAHJKF-UHFFFAOYSA-N -1 1 332.469 4.316 20 0 EIADMM O=C(OCc1csc(-c2cccs2)n1)c1ccc([O-])cc1F ZINC000773574669 1052037018 /nfs/dbraw/zinc/03/70/18/1052037018.db2.gz UABLZDZCYWCQAP-UHFFFAOYSA-N -1 1 335.381 4.073 20 0 EIADMM Cc1c2ccccc2sc1C(=O)COC(=O)c1ccc([O-])cc1F ZINC000773569777 1052038571 /nfs/dbraw/zinc/03/85/71/1052038571.db2.gz WKSCKYKESWQVES-UHFFFAOYSA-N -1 1 344.363 4.094 20 0 EIADMM CCC1(C(=O)Nc2cc(=O)n(-c3ccccc3)[n-]2)CCC(F)(F)CC1 ZINC001184642560 1052068738 /nfs/dbraw/zinc/06/87/38/1052068738.db2.gz MCOIULSSVGYBBA-UHFFFAOYSA-N -1 1 349.381 4.122 20 0 EIADMM Cc1c(Cl)cccc1NC(=O)Nc1cc2ccc([O-])cc2oc1=O ZINC001184657100 1052074663 /nfs/dbraw/zinc/07/46/63/1052074663.db2.gz OOSXOYGPFYIEDZ-UHFFFAOYSA-N -1 1 344.754 4.104 20 0 EIADMM CC(C)CCc1nnc([N-]C(=O)c2c(F)ccc(F)c2Cl)s1 ZINC000622134467 1052127634 /nfs/dbraw/zinc/12/76/34/1052127634.db2.gz FKBIINSCNQDUFE-UHFFFAOYSA-N -1 1 345.802 4.311 20 0 EIADMM CCOC(=O)c1ccc(Nc2c(F)cc(F)c([O-])c2F)c(C)c1 ZINC001176669819 1052157012 /nfs/dbraw/zinc/15/70/12/1052157012.db2.gz LDGBYVUYXOTNQW-UHFFFAOYSA-N -1 1 325.286 4.038 20 0 EIADMM Cc1cnn(-c2ccc(C)cc2)c1Nc1c(F)cc(F)c([O-])c1F ZINC001176669286 1052157760 /nfs/dbraw/zinc/15/77/60/1052157760.db2.gz GIMPOSNQMWTQOH-UHFFFAOYSA-N -1 1 333.313 4.356 20 0 EIADMM [O-]c1c(F)cc(F)c(Nc2ccc(F)c(Br)c2)c1F ZINC001176669088 1052157807 /nfs/dbraw/zinc/15/78/07/1052157807.db2.gz DDOQFNBEHQKLQC-UHFFFAOYSA-N -1 1 336.082 4.455 20 0 EIADMM COc1cccc(-n2ncc(C)c2Nc2c(F)cc(F)c([O-])c2F)c1 ZINC001176664270 1052157982 /nfs/dbraw/zinc/15/79/82/1052157982.db2.gz RRZFPVFADICLOQ-UHFFFAOYSA-N -1 1 349.312 4.056 20 0 EIADMM COc1cc(Nc2c(F)cc(F)c([O-])c2F)ccc1N1CCCC1 ZINC001176674750 1052162082 /nfs/dbraw/zinc/16/20/82/1052162082.db2.gz VDXNADTWTBRYPN-UHFFFAOYSA-N -1 1 338.329 4.162 20 0 EIADMM [O-]c1c(F)cc(F)c(Nc2ccnn2-c2ccc(Cl)cc2)c1F ZINC001176663383 1052172565 /nfs/dbraw/zinc/17/25/65/1052172565.db2.gz HVMOWTXRUZDJJK-UHFFFAOYSA-N -1 1 339.704 4.392 20 0 EIADMM Cc1cccc(C)c1S(=O)(=O)[N-]c1nc(C)c(Cl)cc1Cl ZINC001194606239 1052177733 /nfs/dbraw/zinc/17/77/33/1052177733.db2.gz YWPQMRZBYIVADS-UHFFFAOYSA-N -1 1 345.251 4.114 20 0 EIADMM Cc1cc([N-]S(=O)(=O)c2c(C)cccc2C)cc2scnc21 ZINC001194643639 1052185459 /nfs/dbraw/zinc/18/54/59/1052185459.db2.gz KPLVYXJBFYVAJB-UHFFFAOYSA-N -1 1 332.450 4.022 20 0 EIADMM O=S(=O)([N-]c1ccc(Cc2ccccc2)cc1)c1ccsc1 ZINC001185383181 1052225752 /nfs/dbraw/zinc/22/57/52/1052225752.db2.gz XHCYKZLEXRVUDN-UHFFFAOYSA-N -1 1 329.446 4.140 20 0 EIADMM CCN(CCOc1ccccc1C)C(=O)c1cc2ccccc2cc1[O-] ZINC000622726959 1052396632 /nfs/dbraw/zinc/39/66/32/1052396632.db2.gz XFGJJPAQKHFSSD-UHFFFAOYSA-N -1 1 349.430 4.395 20 0 EIADMM O=C([N-]c1nc(-c2cccs2)ns1)c1cc2cc(F)ccc2o1 ZINC000182158534 1052917404 /nfs/dbraw/zinc/91/74/04/1052917404.db2.gz BBGXNKCHIRRHNZ-UHFFFAOYSA-N -1 1 345.380 4.404 20 0 EIADMM COc1cc(Cl)cc([N-]S(=O)(=O)c2cccc(C(C)C)c2)c1 ZINC001195156835 1053309148 /nfs/dbraw/zinc/30/91/48/1053309148.db2.gz UGMOWTVFOUTYIF-UHFFFAOYSA-N -1 1 339.844 4.273 20 0 EIADMM O=C(Nc1cc(F)c(F)cc1[O-])Oc1ccccc1C(F)(F)F ZINC001195201443 1053328490 /nfs/dbraw/zinc/32/84/90/1053328490.db2.gz XGQNMHKMOLFYQW-UHFFFAOYSA-N -1 1 333.212 4.300 20 0 EIADMM CCCCCc1nnc([N-]C(=O)c2conc2C2CCCC2)s1 ZINC000864969759 1053395558 /nfs/dbraw/zinc/39/55/58/1053395558.db2.gz VSISSEIKOPMWKF-UHFFFAOYSA-N -1 1 334.445 4.169 20 0 EIADMM CCOC(=O)NC(=S)[N-]c1ccc(Sc2ccccc2)cc1 ZINC001195485103 1053419667 /nfs/dbraw/zinc/41/96/67/1053419667.db2.gz XPWZBFODLGTHTE-UHFFFAOYSA-N -1 1 332.450 4.281 20 0 EIADMM CC[C@@H](C)CO[N-]C(=O)Cc1sc(C)nc1-c1ccc(C)cc1 ZINC000794863346 1053583429 /nfs/dbraw/zinc/58/34/29/1053583429.db2.gz HWLZYAAZCYXDOW-GFCCVEGCSA-N -1 1 332.469 4.063 20 0 EIADMM COc1ccccc1NC(=S)Nc1cccc(C(F)(F)F)c1[O-] ZINC001196261770 1053620990 /nfs/dbraw/zinc/62/09/90/1053620990.db2.gz YHHKWEKEMSBWQH-UHFFFAOYSA-N -1 1 342.342 4.229 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2c(F)cccc2C(C)C)c(F)c1 ZINC001196390265 1053655122 /nfs/dbraw/zinc/65/51/22/1053655122.db2.gz HIHJAJDGMLRNHZ-UHFFFAOYSA-N -1 1 325.380 4.197 20 0 EIADMM CC(=O)c1ccc(NC(=S)Nc2ccc(C)c([O-])c2Cl)cc1 ZINC001196556495 1053698734 /nfs/dbraw/zinc/69/87/34/1053698734.db2.gz PAWLRFBVEZHYFH-UHFFFAOYSA-N -1 1 334.828 4.366 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2cc(Cl)sc2Cl)c(F)c1 ZINC000020627289 1053722053 /nfs/dbraw/zinc/72/20/53/1053722053.db2.gz CELIOYQQFQZWIP-UHFFFAOYSA-N -1 1 340.228 4.303 20 0 EIADMM O=S(=O)([N-]c1cccc(Cl)c1Cl)c1cc(F)ccc1F ZINC000020627229 1053722942 /nfs/dbraw/zinc/72/29/42/1053722942.db2.gz CUVUFXOIWLXWNV-UHFFFAOYSA-N -1 1 338.162 4.072 20 0 EIADMM CCSc1nnc([N-]C(=O)c2cc(Cl)sc2Cl)s1 ZINC000022396979 1053757511 /nfs/dbraw/zinc/75/75/11/1053757511.db2.gz NNXTZMNPUYZZGG-UHFFFAOYSA-N -1 1 340.282 4.271 20 0 EIADMM Cc1ccccc1S(=O)(=O)[N-]c1ccc(SC(F)F)cc1 ZINC000112333264 1053827271 /nfs/dbraw/zinc/82/72/71/1053827271.db2.gz YGRRRDGIGGUFAF-UHFFFAOYSA-N -1 1 329.393 4.111 20 0 EIADMM O=C(Nc1ccc([O-])c(F)c1F)[C@@H](Cc1cccnc1)C1CCCC1 ZINC000868787685 1053934991 /nfs/dbraw/zinc/93/49/91/1053934991.db2.gz HXGXFETZFAUADF-AWEZNQCLSA-N -1 1 346.377 4.053 20 0 EIADMM CC1(C)CN(C(=O)c2ccc(C(F)(F)F)cc2[O-])CC(C)(C)C1 ZINC001153707732 1053995693 /nfs/dbraw/zinc/99/56/93/1053995693.db2.gz AHWNSADSMPGTKO-UHFFFAOYSA-N -1 1 329.362 4.309 20 0 EIADMM CSc1ccc([N-]S(=O)(=O)c2cc(Cl)ccc2C)cc1 ZINC000031667690 1054075041 /nfs/dbraw/zinc/07/50/41/1054075041.db2.gz JTWQOHWXZYTPHX-UHFFFAOYSA-N -1 1 327.858 4.171 20 0 EIADMM Cc1cccc(C)c1NC(=S)Nc1ccc(-n2ccc(=O)[n-]2)cc1 ZINC001198371381 1054130336 /nfs/dbraw/zinc/13/03/36/1054130336.db2.gz HLROZOUGBLRHEW-UHFFFAOYSA-N -1 1 338.436 4.004 20 0 EIADMM Cc1c(=O)[n-]n(-c2ccccc2)c1NC(=S)Nc1ccccc1C ZINC001198457345 1054150561 /nfs/dbraw/zinc/15/05/61/1054150561.db2.gz CAMBGELKNGMYBO-UHFFFAOYSA-N -1 1 338.436 4.004 20 0 EIADMM CC(C)OCc1cccc([N-]S(=O)(=O)c2ccc3occc3c2)c1 ZINC001198858890 1054282618 /nfs/dbraw/zinc/28/26/18/1054282618.db2.gz KOHAPVHIFMLMAT-UHFFFAOYSA-N -1 1 345.420 4.159 20 0 EIADMM Cc1ccc(-c2nsc([N-]C(=O)c3nc(C4CC4)oc3C)n2)s1 ZINC000671699498 1054440169 /nfs/dbraw/zinc/44/01/69/1054440169.db2.gz OJCURULGAHFSIC-UHFFFAOYSA-N -1 1 346.437 4.001 20 0 EIADMM O=C(C=C1CCCC1)Nc1c([O-])cc(Br)cc1Cl ZINC000843885696 1054512520 /nfs/dbraw/zinc/51/25/20/1054512520.db2.gz IYPOEHHNWAETLS-UHFFFAOYSA-N -1 1 330.609 4.247 20 0 EIADMM O=C1[N-]C(=O)C(=Cc2cccc(OCCCc3ccccc3)c2)S1 ZINC000874928873 1054742601 /nfs/dbraw/zinc/74/26/01/1054742601.db2.gz XAGAVNNQUONXCK-LGMDPLHJSA-N -1 1 339.416 4.022 20 0 EIADMM O=C(NCc1cccc(OC(F)F)c1)c1cc2ccccc2cc1[O-] ZINC000064961964 1054892759 /nfs/dbraw/zinc/89/27/59/1054892759.db2.gz MGUZAVNCIOXQTA-UHFFFAOYSA-N -1 1 343.329 4.077 20 0 EIADMM O=C(Nc1cccc([O-])c1Br)Nc1c(F)cccc1F ZINC001202044928 1054995631 /nfs/dbraw/zinc/99/56/31/1054995631.db2.gz YJEHIOHMPIZGLI-UHFFFAOYSA-N -1 1 343.127 4.077 20 0 EIADMM O=C(Nc1ccccc1C(F)(F)F)Nc1cc(Cl)ncc1[O-] ZINC001202154053 1055055586 /nfs/dbraw/zinc/05/55/86/1055055586.db2.gz BQLAXDCLJFWASF-UHFFFAOYSA-N -1 1 331.681 4.103 20 0 EIADMM CCC1=NO[C@@H](c2nc(=O)c3c(C[C@@H](C)CC)c(C)sc3[n-]2)C1 ZINC000126617029 1055092353 /nfs/dbraw/zinc/09/23/53/1055092353.db2.gz VNMLZFUBNHKQOD-TVQRCGJNSA-N -1 1 333.457 4.109 20 0 EIADMM O=C(Nc1cccc(C(F)(F)F)c1)Nc1cc([O-])c(F)cc1F ZINC001202298118 1055130790 /nfs/dbraw/zinc/13/07/90/1055130790.db2.gz NCQWTTXGHTWGDM-UHFFFAOYSA-N -1 1 332.228 4.333 20 0 EIADMM Cc1cccc([C@H]2CCCN2Cc2nnc(-c3ccccc3O)o2)c1 ZINC000877986553 1055169936 /nfs/dbraw/zinc/16/99/36/1055169936.db2.gz QCVQFNRUDPJKMY-QGZVFWFLSA-N -1 1 335.407 4.088 20 0 EIADMM CN(C(=O)c1ccccc1[O-])c1ccc(NC(=O)OC(C)(C)C)cc1 ZINC000863468487 1055206215 /nfs/dbraw/zinc/20/62/15/1055206215.db2.gz NREIGLHSIJQTOK-UHFFFAOYSA-N -1 1 342.395 4.016 20 0 EIADMM O=C(CCC(=O)c1ccc(Cl)cc1)Nc1ccc([O-])c(Cl)c1 ZINC000111668722 1055225442 /nfs/dbraw/zinc/22/54/42/1055225442.db2.gz QYGCTDLJIFNXGE-UHFFFAOYSA-N -1 1 338.190 4.301 20 0 EIADMM CCCn1cc(N[C@H](C)c2cc(Br)cc(F)c2[O-])cn1 ZINC000186339963 1055371382 /nfs/dbraw/zinc/37/13/82/1055371382.db2.gz AGGFYGNNFREBKA-SECBINFHSA-N -1 1 342.212 4.073 20 0 EIADMM C[C@H](c1cc(Cl)ccc1Cl)N1CCC2(C[C@H]2C(=O)[O-])CC1 ZINC000405363108 1056386342 /nfs/dbraw/zinc/38/63/42/1056386342.db2.gz RDHKOLISWRBMNM-MFKMUULPSA-N -1 1 328.239 4.241 20 0 EIADMM CC[C@@H](C)CC[N-]S(=O)(=O)c1c(Cl)cc(Cl)cc1Cl ZINC001212436065 1056482725 /nfs/dbraw/zinc/48/27/25/1056482725.db2.gz WQJLNOJTWUGQMY-MRVPVSSYSA-N -1 1 344.691 4.361 20 0 EIADMM O=C(c1ccc(C(F)(F)F)c([O-])c1)N1CCc2cc(Cl)ccc21 ZINC000672161896 1056732746 /nfs/dbraw/zinc/73/27/46/1056732746.db2.gz WYYVWUFLSKNOLM-UHFFFAOYSA-N -1 1 341.716 4.267 20 0 EIADMM Cc1ccc(C)c(C(=O)CCC(=O)Nc2ccc([O-])c(Cl)c2)c1 ZINC000111665902 1056811869 /nfs/dbraw/zinc/81/18/69/1056811869.db2.gz WQBNFVRJDRNQEJ-UHFFFAOYSA-N -1 1 331.799 4.264 20 0 EIADMM O=C(CCCOc1ccc(F)cc1F)Nc1ccc([O-])c(Cl)c1 ZINC000111666109 1056812804 /nfs/dbraw/zinc/81/28/04/1056812804.db2.gz HDMZHJJPZNSLKV-UHFFFAOYSA-N -1 1 341.741 4.122 20 0 EIADMM CCOc1ccc(Cl)c([N-]c2nnc(Br)s2)c1 ZINC001212574779 1058709085 /nfs/dbraw/zinc/70/90/85/1058709085.db2.gz WQTBRVPXIJUCLE-UHFFFAOYSA-N -1 1 334.626 4.096 20 0 EIADMM CCCCCC[C@H](C)C(=O)N1CCC(C(=O)c2ccc([O-])cc2)CC1 ZINC000743296354 1058916195 /nfs/dbraw/zinc/91/61/95/1058916195.db2.gz XBINTCNAIFYRHJ-INIZCTEOSA-N -1 1 345.483 4.420 20 0 EIADMM CC(=O)c1ccc([O-])c(CCOC(=O)c2oc3ccccc3c2C)c1 ZINC000744452138 1059526587 /nfs/dbraw/zinc/52/65/87/1059526587.db2.gz KWDWSKPBPDNGIE-UHFFFAOYSA-N -1 1 338.359 4.049 20 0 EIADMM CC(=O)c1ccc([O-])c(CCOC(=O)c2cc3cc(C)ccc3o2)c1 ZINC000744843566 1059644716 /nfs/dbraw/zinc/64/47/16/1059644716.db2.gz MEJNWAFFUSGZHJ-UHFFFAOYSA-N -1 1 338.359 4.049 20 0 EIADMM O=C([N-]OCC(F)(F)F)C1(Cc2cccc(Cl)c2)CCCC1 ZINC000766784301 1060900761 /nfs/dbraw/zinc/90/07/61/1060900761.db2.gz KVPHRTJTUNTODS-UHFFFAOYSA-N -1 1 335.753 4.053 20 0 EIADMM C[C@@H]1[C@@H](C(=O)Nc2c([O-])cc(Br)cc2Cl)[C@H]1C1CC1 ZINC000529368740 1032331352 /nfs/dbraw/zinc/33/13/52/1032331352.db2.gz ZZUYLOCPBRPRLV-ZYDDLXRUSA-N -1 1 344.636 4.039 20 0 EIADMM O=C(CC[C@@H]1CCCCO1)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000529539014 1032428933 /nfs/dbraw/zinc/42/89/33/1032428933.db2.gz NGUUADXGFDHCHP-LBPRGKRZSA-N -1 1 333.815 4.487 20 0 EIADMM C[C@H](C(=O)Nc1cc(Cl)c([O-])c2ccccc12)C1CCOCC1 ZINC000529540293 1032429334 /nfs/dbraw/zinc/42/93/34/1032429334.db2.gz XLAPPGXLTLJRBH-NSHDSACASA-N -1 1 333.815 4.200 20 0 EIADMM C[C@@H]1CC(=O)CC[C@@H]1C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000529539434 1032444190 /nfs/dbraw/zinc/44/41/90/1032444190.db2.gz SFHBYBDVDWIKAR-PWSUYJOCSA-N -1 1 331.799 4.143 20 0 EIADMM C[C@H]1CC[C@H](CCC(=O)Nc2cc(Cl)c([O-])c3ccccc23)O1 ZINC000529538528 1032444550 /nfs/dbraw/zinc/44/45/50/1032444550.db2.gz CSAGCNDPAQOOLC-NWDGAFQWSA-N -1 1 333.815 4.485 20 0 EIADMM O=C([O-])[C@H]1C[C@H](C2CCCCC2)CN1Cc1nc2ccccc2s1 ZINC000579735560 1018844816 /nfs/dbraw/zinc/84/48/16/1018844816.db2.gz FWZHKNUCTNYABS-GOEBONIOSA-N -1 1 344.480 4.152 20 0 EIADMM C[C@@H](c1ccccc1)N(Cc1ccccc1)C(=O)c1cncc([O-])c1 ZINC000339833199 1019905117 /nfs/dbraw/zinc/90/51/17/1019905117.db2.gz BHQBYXPIJBMKSD-INIZCTEOSA-N -1 1 332.403 4.191 20 0 EIADMM C[C@H](c1ccccc1Cl)N(C)CCOc1ccccc1C(=O)[O-] ZINC000237422586 1020800918 /nfs/dbraw/zinc/80/09/18/1020800918.db2.gz WABJLZCSBNLFEK-CYBMUJFWSA-N -1 1 333.815 4.110 20 0 EIADMM CCOc1cncc(Nc2cc(Br)cc(Cl)c2[O-])c1 ZINC001210669215 1021544979 /nfs/dbraw/zinc/54/49/79/1021544979.db2.gz UITGEPWQJVWTGC-UHFFFAOYSA-N -1 1 343.608 4.345 20 0 EIADMM CC[C@H](Cc1ccccc1)NC(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC001143500555 1022015168 /nfs/dbraw/zinc/01/51/68/1022015168.db2.gz VIAHBOUCOVGKOF-CQSZACIVSA-N -1 1 337.341 4.162 20 0 EIADMM CN(Cc1cc(Cl)cc(Cl)c1)C(=O)c1c(F)ccc([O-])c1F ZINC000580498498 1022108586 /nfs/dbraw/zinc/10/85/86/1022108586.db2.gz SICZDCKYOWTYHX-UHFFFAOYSA-N -1 1 346.160 4.249 20 0 EIADMM O=C(Nc1cc([O-])c(F)cc1F)C1(Cc2ccccc2Cl)CC1 ZINC001625894102 1022188793 /nfs/dbraw/zinc/18/87/93/1022188793.db2.gz RZTJCLRAKQLKBS-UHFFFAOYSA-N -1 1 337.753 4.285 20 0 EIADMM CCS[C@@H]1CC[C@H](N(C)C(=O)c2ccc3ccccc3c2[O-])C1 ZINC000175391887 1022348700 /nfs/dbraw/zinc/34/87/00/1022348700.db2.gz LRLHXMRXPDLBFY-LSDHHAIUSA-N -1 1 329.465 4.292 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1CCS[C@H]2CCCC[C@@H]21 ZINC000175404400 1022355094 /nfs/dbraw/zinc/35/50/94/1022355094.db2.gz SULBZELOPPAWMO-IRXDYDNUSA-N -1 1 327.449 4.046 20 0 EIADMM O=c1cc(C2CC2)nc(SCc2ncc(-c3cccc(F)c3)o2)[n-]1 ZINC000188131884 1022457120 /nfs/dbraw/zinc/45/71/20/1022457120.db2.gz HRWFFYJQWZAWSK-UHFFFAOYSA-N -1 1 343.383 4.146 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N(CC1CCC1)CC(F)(F)F ZINC000175940421 1022528326 /nfs/dbraw/zinc/52/83/26/1022528326.db2.gz ZFHNWJXOQFISAO-UHFFFAOYSA-N -1 1 337.341 4.350 20 0 EIADMM O=C(Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)c1ccccc1C(F)(F)F ZINC000339117306 1022593937 /nfs/dbraw/zinc/59/39/37/1022593937.db2.gz DKFXQVQALMUKAJ-UHFFFAOYSA-N -1 1 347.296 4.053 20 0 EIADMM O=C(Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)c1cccc(C(F)(F)F)c1 ZINC000339121229 1022604257 /nfs/dbraw/zinc/60/42/57/1022604257.db2.gz VRTGWHMSSPGUCK-UHFFFAOYSA-N -1 1 347.296 4.053 20 0 EIADMM c1ccc(-c2noc([N-]Cc3nc4ccccc4n3C3CC3)n2)cc1 ZINC000685913794 1022626273 /nfs/dbraw/zinc/62/62/73/1022626273.db2.gz NENIUFKGBMJRQK-UHFFFAOYSA-N -1 1 331.379 4.033 20 0 EIADMM Cc1cc(NC(=O)c2c(C)nc(C(C)(C)C)[n-]c2=O)ccc1C1CC1 ZINC000548144568 1022676321 /nfs/dbraw/zinc/67/63/21/1022676321.db2.gz XSWHMXABUZHLMP-UHFFFAOYSA-N -1 1 339.439 4.226 20 0 EIADMM Cn1ncc(C(=O)Nc2cc(Cl)c([O-])c3ccccc23)c1C1CC1 ZINC001167439828 1022738880 /nfs/dbraw/zinc/73/88/80/1022738880.db2.gz ISERMOXCKLUHPR-UHFFFAOYSA-N -1 1 341.798 4.062 20 0 EIADMM CCC(C)(C)c1ccc(S(=O)(=O)[N-]c2cccc(OC)c2)cc1 ZINC000467077526 1022953700 /nfs/dbraw/zinc/95/37/00/1022953700.db2.gz CAXXINAZPQJFAF-UHFFFAOYSA-N -1 1 333.453 4.184 20 0 EIADMM CC(C)(C)n1cc(-c2nc3sc4c(c3c(=O)[n-]2)CCCCC4)cn1 ZINC000408003311 1023201566 /nfs/dbraw/zinc/20/15/66/1023201566.db2.gz DYQRTQIMISZGHV-UHFFFAOYSA-N -1 1 342.468 4.284 20 0 EIADMM CCc1cccc2cc(CN[C@@H](CCc3ccccc3)C(=O)[O-])oc21 ZINC000656565754 1023225430 /nfs/dbraw/zinc/22/54/30/1023225430.db2.gz SQXFTDLWTVRXJA-IBGZPJMESA-N -1 1 337.419 4.171 20 0 EIADMM CCc1nc(CNCc2cccc(C3CCCC3)c2)ccc1C(=O)[O-] ZINC000656565880 1023225637 /nfs/dbraw/zinc/22/56/37/1023225637.db2.gz WXOUBVQKBRYJAO-UHFFFAOYSA-N -1 1 338.451 4.290 20 0 EIADMM COc1ccc([C@@H]2CCCN2Cc2ccc(C(=O)[O-])c(F)c2)cc1F ZINC000659789450 1023271401 /nfs/dbraw/zinc/27/14/01/1023271401.db2.gz HZMPUHQXPRWNQR-KRWDZBQOSA-N -1 1 347.361 4.009 20 0 EIADMM CCC(CC)CCCN(C)Cc1nc2cc(C(=O)[O-])ccc2n1CC ZINC000659801576 1023284974 /nfs/dbraw/zinc/28/49/74/1023284974.db2.gz ISDGWKAHGPYODJ-UHFFFAOYSA-N -1 1 345.487 4.403 20 0 EIADMM CC(C)(C)c1ccc(-c2ccc(CN[C@H](C(=O)[O-])C3CC3)o2)cc1 ZINC000417610519 1023372775 /nfs/dbraw/zinc/37/27/75/1023372775.db2.gz TYBPBQOJNUPNNP-SFHVURJKSA-N -1 1 327.424 4.197 20 0 EIADMM O=C([O-])[C@@H]1C[C@H](NCc2cc(Cl)sc2Cl)c2ccccc21 ZINC000417633915 1023383189 /nfs/dbraw/zinc/38/31/89/1023383189.db2.gz VAWWUSXCSOHMGX-NEPJUHHUSA-N -1 1 342.247 4.458 20 0 EIADMM COC[C@@H]([N-]c1nnc(-c2cccc(Cl)c2)o1)c1ccc(C)o1 ZINC000892782081 1023393504 /nfs/dbraw/zinc/39/35/04/1023393504.db2.gz JUONAMVFPURBCM-CYBMUJFWSA-N -1 1 333.775 4.091 20 0 EIADMM CC(C)(C)c1ccc(CNCc2ccc(C(=O)[O-])c(C3CC3)n2)s1 ZINC000417708252 1023411435 /nfs/dbraw/zinc/41/14/35/1023411435.db2.gz ROGCEFNAAGCKIE-UHFFFAOYSA-N -1 1 344.480 4.306 20 0 EIADMM O=C(c1ncc2ccccc2c1[O-])N1CCC(c2ccsc2)CC1 ZINC000613652687 1023411858 /nfs/dbraw/zinc/41/18/58/1023411858.db2.gz JRJXOSDBWJZYQK-UHFFFAOYSA-N -1 1 338.432 4.022 20 0 EIADMM O=C(Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)c1cc2ccccc2s1 ZINC000613667491 1023479694 /nfs/dbraw/zinc/47/96/94/1023479694.db2.gz WVWJNQDHQWJZEG-UHFFFAOYSA-N -1 1 335.388 4.249 20 0 EIADMM CC[C@@H](C)Oc1cccc([N-]S(=O)(=O)c2ccc(F)cc2C)c1 ZINC000511733076 1023843016 /nfs/dbraw/zinc/84/30/16/1023843016.db2.gz CCZMMFFYHCNJJE-CYBMUJFWSA-N -1 1 337.416 4.112 20 0 EIADMM CCCSC[C@H](NCc1ccc(-c2ccc(C)cc2)s1)C(=O)[O-] ZINC000426773582 1023846943 /nfs/dbraw/zinc/84/69/43/1023846943.db2.gz PSUAVWGOWVVITA-INIZCTEOSA-N -1 1 349.521 4.410 20 0 EIADMM O=S(=O)([N-]c1ccccc1F)c1csc2ccc(Cl)cc21 ZINC000432184661 1023942786 /nfs/dbraw/zinc/94/27/86/1023942786.db2.gz HEWKBBZYJNEZGH-UHFFFAOYSA-N -1 1 341.816 4.495 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc(Cl)cc2C)cc1Cl ZINC000048652601 1024670673 /nfs/dbraw/zinc/67/06/73/1024670673.db2.gz FNMQTSGVWXDVAF-UHFFFAOYSA-N -1 1 330.236 4.411 20 0 EIADMM Cc1cc(C)c(S(=O)(=O)[N-]c2cc(Cl)ccc2Cl)s1 ZINC000431147661 1024704595 /nfs/dbraw/zinc/70/45/95/1024704595.db2.gz UVZAGFNTAAHXNP-UHFFFAOYSA-N -1 1 336.265 4.473 20 0 EIADMM CCCOc1ccc([N-]S(=O)(=O)c2ccccc2)cc1OCCC ZINC000016095988 1024716517 /nfs/dbraw/zinc/71/65/17/1024716517.db2.gz GTSPHMOOVDPQOB-UHFFFAOYSA-N -1 1 349.452 4.065 20 0 EIADMM CN(CCC(C)(C)C)Cc1csc(-c2cccc(C(=O)[O-])c2)n1 ZINC000652416992 1024823352 /nfs/dbraw/zinc/82/33/52/1024823352.db2.gz PPKDMDUWGAKVHZ-UHFFFAOYSA-N -1 1 332.469 4.376 20 0 EIADMM COc1ccc(CO)cc1Nc1cc(Cl)c(C)c(Cl)c1[O-] ZINC001211528988 1024846842 /nfs/dbraw/zinc/84/68/42/1024846842.db2.gz AJDMFRLCDUWVCY-UHFFFAOYSA-N -1 1 328.195 4.252 20 0 EIADMM O=C(Nc1ccc(CC(F)(F)F)cc1)c1c(F)ccc([O-])c1F ZINC000583467475 1024892541 /nfs/dbraw/zinc/89/25/41/1024892541.db2.gz CHOSTBBDMATGSQ-UHFFFAOYSA-N -1 1 331.240 4.028 20 0 EIADMM C[C@@H]1CCN(C(=O)c2ccc3ccccc3c2[O-])c2c(O)cccc21 ZINC000186256032 1025025902 /nfs/dbraw/zinc/02/59/02/1025025902.db2.gz JYAUNCMJUDJQRX-CYBMUJFWSA-N -1 1 333.387 4.405 20 0 EIADMM CCc1ccc(C(=O)CCC(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000067739015 1025235619 /nfs/dbraw/zinc/23/56/19/1025235619.db2.gz MIWAJUCBZCYGIL-UHFFFAOYSA-N -1 1 331.799 4.210 20 0 EIADMM CO[C@H](CSc1nc(-c2ccccc2)c(C)c(=O)[n-]1)C1CCC1 ZINC000657256970 1025419730 /nfs/dbraw/zinc/41/97/30/1025419730.db2.gz IHAXOGUQCQVJKB-OAHLLOKOSA-N -1 1 330.453 4.065 20 0 EIADMM CCC(C)(C)c1ccc(S(=O)(=O)[N-]c2ccc(C)c(O)c2)cc1 ZINC000467090960 1025420955 /nfs/dbraw/zinc/42/09/55/1025420955.db2.gz MNLGYSLWDWAZCC-UHFFFAOYSA-N -1 1 333.453 4.189 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1ccc(C2CCOCC2)cc1 ZINC000866869135 1025522044 /nfs/dbraw/zinc/52/20/44/1025522044.db2.gz RVBCFRQGYBGNHI-UHFFFAOYSA-N -1 1 331.799 4.192 20 0 EIADMM Cc1oc(CN(C)CCSc2ccc(C)c(C)c2)cc1C(=O)[O-] ZINC000519412543 1025813967 /nfs/dbraw/zinc/81/39/67/1025813967.db2.gz AMXQETACWYVQJN-UHFFFAOYSA-N -1 1 333.453 4.127 20 0 EIADMM Cc1cc(C)c(C)c(S(=O)(=O)[N-]c2ccc(Cl)nc2C)c1C ZINC000318479390 1026107983 /nfs/dbraw/zinc/10/79/83/1026107983.db2.gz GRIBQWRTNYOMKD-UHFFFAOYSA-N -1 1 338.860 4.078 20 0 EIADMM O=C(Nc1ccc(COC2CCCC2)cc1)c1c(F)ccc([O-])c1F ZINC000280776348 1026115311 /nfs/dbraw/zinc/11/53/11/1026115311.db2.gz CDVHLIDNMGASCA-UHFFFAOYSA-N -1 1 347.361 4.382 20 0 EIADMM Cc1ccc(-c2ncc(CN[C@H](CC(=O)[O-])c3ccsc3)s2)o1 ZINC000426672852 1026427903 /nfs/dbraw/zinc/42/79/03/1026427903.db2.gz UIQAVDLBTUXBIB-CYBMUJFWSA-N -1 1 348.449 4.079 20 0 EIADMM Cc1cccc([C@@H](NCc2cc3ccccc3s2)C(=O)[O-])c1C ZINC000426719340 1026501034 /nfs/dbraw/zinc/50/10/34/1026501034.db2.gz FVUJSPPYADGIOD-GOSISDBHSA-N -1 1 325.433 4.434 20 0 EIADMM O=C([O-])[C@H](NCc1cccc(Cl)c1F)c1ccc(Cl)c(F)c1 ZINC000426764497 1026530099 /nfs/dbraw/zinc/53/00/99/1026530099.db2.gz XCLODADBAYVZQQ-CQSZACIVSA-N -1 1 346.160 4.187 20 0 EIADMM O=C([O-])[C@@H](NCc1cc(Cl)cc(Cl)c1)c1ccccc1F ZINC000426774873 1026553873 /nfs/dbraw/zinc/55/38/73/1026553873.db2.gz QHQKVOMIWIRHET-AWEZNQCLSA-N -1 1 328.170 4.048 20 0 EIADMM O=C([O-])[C@H](NCc1ccc(-c2ccccc2)cc1F)c1ccccc1 ZINC000426767774 1026560817 /nfs/dbraw/zinc/56/08/17/1026560817.db2.gz QOJXPMHZRHLUCE-HXUWFJFHSA-N -1 1 335.378 4.408 20 0 EIADMM CCc1ccc([C@H](NCc2cc3ccccc3s2)C(=O)[O-])cc1 ZINC000426800812 1026569349 /nfs/dbraw/zinc/56/93/49/1026569349.db2.gz PCNKTWDOSQSCQX-SFHVURJKSA-N -1 1 325.433 4.379 20 0 EIADMM CCC(C)(C)c1ccc(S(=O)(=O)[N-]c2ccc3c(c2)COC3)cc1 ZINC000507019109 1026589445 /nfs/dbraw/zinc/58/94/45/1026589445.db2.gz DPQFKWOFZSZECA-UHFFFAOYSA-N -1 1 345.464 4.205 20 0 EIADMM O=c1nc([C@H]2COc3ccccc3O2)[n-]c2sc3ccccc3c21 ZINC000337773007 1026598441 /nfs/dbraw/zinc/59/84/41/1026598441.db2.gz WDILCPSDQAVSIC-CYBMUJFWSA-N -1 1 336.372 4.063 20 0 EIADMM CN(C(=O)c1ccc(C(F)(F)F)c([O-])c1)[C@@H]1CCc2ccccc21 ZINC000684870474 1026630907 /nfs/dbraw/zinc/63/09/07/1026630907.db2.gz DCDCXURLPPARHJ-OAHLLOKOSA-N -1 1 335.325 4.171 20 0 EIADMM O=C(N[C@@H](c1ccccc1)C1CC1)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684870730 1026633833 /nfs/dbraw/zinc/63/38/33/1026633833.db2.gz MNPKGHQOZXOQHY-INIZCTEOSA-N -1 1 335.325 4.292 20 0 EIADMM CN(C(=O)c1ccc(C(F)(F)F)c([O-])c1)[C@H]1CCc2ccccc2C1 ZINC000684874869 1026648670 /nfs/dbraw/zinc/64/86/70/1026648670.db2.gz ZHQNJAVKJQRRFF-HNNXBMFYSA-N -1 1 349.352 4.041 20 0 EIADMM [O-]c1c(-c2nc(Cc3c(F)cccc3F)no2)ccc2ccccc21 ZINC000436888723 1026653798 /nfs/dbraw/zinc/65/37/98/1026653798.db2.gz OFHDKMBNCHLRTJ-UHFFFAOYSA-N -1 1 338.313 4.464 20 0 EIADMM CN(CC1CCCC1)C(=O)c1ccc(NC(=O)OC(C)(C)C)cc1[O-] ZINC000097597209 1027226419 /nfs/dbraw/zinc/22/64/19/1027226419.db2.gz JVPCTBHRENUPBD-UHFFFAOYSA-N -1 1 348.443 4.001 20 0 EIADMM COc1cc(C(=O)N[C@H](C)c2cc(C)sc2C)cc(Cl)c1[O-] ZINC000153557559 1027603284 /nfs/dbraw/zinc/60/32/84/1027603284.db2.gz ORECAAMYMYEBCD-SECBINFHSA-N -1 1 339.844 4.224 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc3nc(C4CC4)sc3c2)cc1 ZINC000063879539 1027804030 /nfs/dbraw/zinc/80/40/30/1027804030.db2.gz MSIZJTINMJVEDM-UHFFFAOYSA-N -1 1 344.461 4.283 20 0 EIADMM CCOc1cc(C(=O)Nc2cc3[nH]ccc3cc2C)cc(Cl)c1[O-] ZINC000444450550 1027809241 /nfs/dbraw/zinc/80/92/41/1027809241.db2.gz PXSDVZGTSRKABM-UHFFFAOYSA-N -1 1 344.798 4.486 20 0 EIADMM CC(F)(F)c1cccc([N-]S(=O)(=O)c2cccc3ncccc32)c1 ZINC000188563080 1027981947 /nfs/dbraw/zinc/98/19/47/1027981947.db2.gz VRURQSUNEJGOPP-UHFFFAOYSA-N -1 1 348.374 4.147 20 0 EIADMM CC(=O)Nc1ccc([O-])c(C(=O)Nc2c(C)cccc2C(C)C)c1 ZINC000123057073 1027986078 /nfs/dbraw/zinc/98/60/78/1027986078.db2.gz DLEXQMUMQPQGKC-UHFFFAOYSA-N -1 1 326.396 4.035 20 0 EIADMM O=c1cc(C(F)F)nc(SCc2cccc(C(F)(F)F)c2)[n-]1 ZINC000520461723 1028065396 /nfs/dbraw/zinc/06/53/96/1028065396.db2.gz RBOZOSGZEIELHO-UHFFFAOYSA-N -1 1 336.285 4.431 20 0 EIADMM CCOc1cc(-c2noc([C@@H]3CC[C@@H](CC)O3)n2)cc(Cl)c1[O-] ZINC000278144461 1028295869 /nfs/dbraw/zinc/29/58/69/1028295869.db2.gz UAWPDDKZELZLPY-PWSUYJOCSA-N -1 1 338.791 4.124 20 0 EIADMM O=C(CCOc1cccc(Cl)c1Cl)Nc1c([O-])cccc1F ZINC000092551555 1028516322 /nfs/dbraw/zinc/51/63/22/1028516322.db2.gz WYQPFZWYJIUDMA-UHFFFAOYSA-N -1 1 344.169 4.246 20 0 EIADMM CCOc1cc(-c2noc(Cc3ccccc3C)n2)cc(Cl)c1[O-] ZINC000445407365 1028518588 /nfs/dbraw/zinc/51/85/88/1028518588.db2.gz NNKDVALELSPMJM-UHFFFAOYSA-N -1 1 344.798 4.394 20 0 EIADMM Cc1oc(CN2CCC([C@@H](F)c3ccccc3F)CC2)cc1C(=O)[O-] ZINC000583334073 1028524721 /nfs/dbraw/zinc/52/47/21/1028524721.db2.gz XKQAQROCGHHTIG-GOSISDBHSA-N -1 1 349.377 4.348 20 0 EIADMM Cc1cc(NC(=O)c2ccc([O-])cc2F)ccc1Oc1ccncc1 ZINC000192590791 1028535316 /nfs/dbraw/zinc/53/53/16/1028535316.db2.gz HBYQERBKVXZVMV-UHFFFAOYSA-N -1 1 338.338 4.279 20 0 EIADMM COc1cccc([C@@H]2C[C@H]2c2nc(-c3ccc([O-])cc3Cl)no2)c1 ZINC000445443176 1028568244 /nfs/dbraw/zinc/56/82/44/1028568244.db2.gz FQJGLGOVRTUIKY-LSDHHAIUSA-N -1 1 342.782 4.375 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cnc4ccc(F)cc4c3)n2)c(Cl)c1 ZINC000445443310 1028569900 /nfs/dbraw/zinc/56/99/00/1028569900.db2.gz BTWVAFQBMZYCOB-UHFFFAOYSA-N -1 1 341.729 4.450 20 0 EIADMM CCO[C@H](Cc1nc(-c2ccc([O-])cc2Cl)no1)C1=CCCC1 ZINC000445444858 1028573664 /nfs/dbraw/zinc/57/36/64/1028573664.db2.gz HHEWSUCHKSMTAR-OAHLLOKOSA-N -1 1 334.803 4.154 20 0 EIADMM [O-]c1ccc(-c2noc([C@@H]3C[C@@]34CCc3ccccc34)n2)c(Cl)c1 ZINC000445445796 1028575203 /nfs/dbraw/zinc/57/52/03/1028575203.db2.gz KIWYQCGHUHCOJI-HNAYVOBHSA-N -1 1 338.794 4.467 20 0 EIADMM COc1ccc([C@@H](C)Cc2nc(-c3ccc([O-])cc3Cl)no2)cc1 ZINC000445446577 1028579029 /nfs/dbraw/zinc/57/90/29/1028579029.db2.gz FBJMUXXALUNUHY-NSHDSACASA-N -1 1 344.798 4.450 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cc(C4CCCCC4)[nH]n3)n2)c(F)c1 ZINC000445453125 1028606323 /nfs/dbraw/zinc/60/63/23/1028606323.db2.gz ADPNGDILUBOJOH-UHFFFAOYSA-N -1 1 328.347 4.019 20 0 EIADMM [O-]c1ccc(-c2noc(CCSc3ccc(F)cc3)n2)c(F)c1 ZINC000445460867 1028615333 /nfs/dbraw/zinc/61/53/33/1028615333.db2.gz UCTPRDLBCHFTEE-UHFFFAOYSA-N -1 1 334.347 4.055 20 0 EIADMM CC[C@@H](Oc1ccccc1C)c1nc(-c2ccc([O-])cc2F)no1 ZINC000445459206 1028616353 /nfs/dbraw/zinc/61/63/53/1028616353.db2.gz YLWGKXPTWBUNLL-OAHLLOKOSA-N -1 1 328.343 4.420 20 0 EIADMM Cc1cc(-c2nc(-c3ccc([O-])cc3F)no2)nn1C1CCCCC1 ZINC000445461259 1028617666 /nfs/dbraw/zinc/61/76/66/1028617666.db2.gz WVWKSLQINYOKLO-UHFFFAOYSA-N -1 1 342.374 4.258 20 0 EIADMM [O-]c1ccc(-c2noc(/C=C\c3cccc4cccnc34)n2)c(F)c1 ZINC000445461125 1028619636 /nfs/dbraw/zinc/61/96/36/1028619636.db2.gz FOFRIDFWYFTRCH-TWGQIWQCSA-N -1 1 333.322 4.300 20 0 EIADMM [O-]c1c(-c2nc([C@H]3COc4ccccc4O3)no2)ccc2ccccc21 ZINC000445472148 1028620742 /nfs/dbraw/zinc/62/07/42/1028620742.db2.gz OBDUKUVBORRIRZ-QGZVFWFLSA-N -1 1 346.342 4.108 20 0 EIADMM Cc1c(-c2nc(-c3ccc([O-])c(F)c3)no2)sc2nccc(C)c12 ZINC000445477958 1028624742 /nfs/dbraw/zinc/62/47/42/1028624742.db2.gz FILNJOPIVNWHRF-UHFFFAOYSA-N -1 1 341.367 4.475 20 0 EIADMM CCOc1ccccc1/C=C/c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445480196 1028627076 /nfs/dbraw/zinc/62/70/76/1028627076.db2.gz LNAKUINASLCGAU-CSKARUKUSA-N -1 1 326.327 4.150 20 0 EIADMM COc1ccc(CCc2nc(-c3ccc([O-])c(F)c3)no2)cc1Cl ZINC000445481140 1028631033 /nfs/dbraw/zinc/63/10/33/1028631033.db2.gz KEVMFLYPIMQOPF-UHFFFAOYSA-N -1 1 348.761 4.029 20 0 EIADMM Cc1ccc(C)c(SCc2nc(-c3ccc([O-])c(F)c3)no2)c1 ZINC000445473009 1028644862 /nfs/dbraw/zinc/64/48/62/1028644862.db2.gz SQKKUFZZRHLMKC-UHFFFAOYSA-N -1 1 330.384 4.490 20 0 EIADMM [O-]c1ccc(Oc2ccccc2)cc1-c1nc([C@@H]2CCCOC2)no1 ZINC000445517146 1028674105 /nfs/dbraw/zinc/67/41/05/1028674105.db2.gz YDAKUCPMEOVYNP-CYBMUJFWSA-N -1 1 338.363 4.129 20 0 EIADMM CCOc1cc(C(=O)N[C@H]2C[C@@H]2C2CCCCC2)cc(Cl)c1[O-] ZINC000545146387 1028765614 /nfs/dbraw/zinc/76/56/14/1028765614.db2.gz CUQZYBOANLKPKJ-HIFRSBDPSA-N -1 1 337.847 4.143 20 0 EIADMM CSc1cccnc1-c1noc(-c2ccc3ccccc3c2[O-])n1 ZINC000445611707 1028800293 /nfs/dbraw/zinc/80/02/93/1028800293.db2.gz CQWQSUKCNDYURH-UHFFFAOYSA-N -1 1 335.388 4.379 20 0 EIADMM CSCc1ccc([N-]S(=O)(=O)c2ccc(Cl)cc2C)cc1 ZINC000524300591 1028855871 /nfs/dbraw/zinc/85/58/71/1028855871.db2.gz AQUUWXGNUFZCES-UHFFFAOYSA-N -1 1 341.885 4.312 20 0 EIADMM Cc1nnc(SCC(=O)c2ccc([O-])cc2)n1[C@H]1CCC[C@H](C)C1 ZINC000536090900 1028972941 /nfs/dbraw/zinc/97/29/41/1028972941.db2.gz RDDDOGPSJSEWEO-WFASDCNBSA-N -1 1 345.468 4.018 20 0 EIADMM CC(C)n1cc2cc([N-]S(=O)(=O)c3ccc(Cl)cc3)ccc2n1 ZINC000522959726 1029131586 /nfs/dbraw/zinc/13/15/86/1029131586.db2.gz KJZRADUJYDUHPD-UHFFFAOYSA-N -1 1 349.843 4.071 20 0 EIADMM CC[C@H](C)c1ccc(S(=O)(=O)[N-]c2ccccc2COC)cc1 ZINC000614808299 1029392179 /nfs/dbraw/zinc/39/21/79/1029392179.db2.gz UTBQFUUORVSXOT-AWEZNQCLSA-N -1 1 333.453 4.147 20 0 EIADMM Cc1nc(-c2ccc(N[C@H](C)CCc3ccccc3)nc2)[n-]c(=O)c1C ZINC000301162504 1029679041 /nfs/dbraw/zinc/67/90/41/1029679041.db2.gz GPQPSIZGERZDQA-CQSZACIVSA-N -1 1 348.450 4.294 20 0 EIADMM Cc1nc(-c2ccc(N[C@H](C)CCC(C)(C)C)nc2)[n-]c(=O)c1C ZINC000301390303 1029723182 /nfs/dbraw/zinc/72/31/82/1029723182.db2.gz GEEHDCNAYUEDHU-GFCCVEGCSA-N -1 1 328.460 4.488 20 0 EIADMM Cc1nc(-c2ccc(N3CCC[C@@H]3CC(C)(C)C)nc2)[n-]c(=O)c1C ZINC000301413418 1029728272 /nfs/dbraw/zinc/72/82/72/1029728272.db2.gz QBYSZVKHNIFLDK-MRXNPFEDSA-N -1 1 340.471 4.266 20 0 EIADMM Cc1ccc(C(=O)Nc2ccc([O-])c(Cl)c2)c(Br)c1 ZINC000162176044 1029767517 /nfs/dbraw/zinc/76/75/17/1029767517.db2.gz MDQIKRKWCBIJRX-UHFFFAOYSA-N -1 1 340.604 4.369 20 0 EIADMM Cc1nc(-c2ccc(N3CCC[C@H](CC(C)C)C3)nc2)[n-]c(=O)c1C ZINC000301651881 1029781771 /nfs/dbraw/zinc/78/17/71/1029781771.db2.gz SRZZFKCUHGVWED-MRXNPFEDSA-N -1 1 340.471 4.124 20 0 EIADMM CCOCc1ccc([N-]S(=O)(=O)c2cccc3ccccc32)cc1 ZINC000084461004 1029825823 /nfs/dbraw/zinc/82/58/23/1029825823.db2.gz KBJLUDNCQHCMDC-UHFFFAOYSA-N -1 1 341.432 4.177 20 0 EIADMM Cc1nc(-c2ccc(N[C@@H]3CC[C@H]4CCC[C@@H]4C3)nc2)[n-]c(=O)c1C ZINC000525706930 1029944007 /nfs/dbraw/zinc/94/40/07/1029944007.db2.gz LTRFLBKLPXPZGF-BFYDXBDKSA-N -1 1 338.455 4.242 20 0 EIADMM Cc1cccc([C@H]2CCCN2C(=O)c2ccc3ccccc3c2[O-])n1 ZINC000092759310 1029945174 /nfs/dbraw/zinc/94/51/74/1029945174.db2.gz XDHISMOBMBBJMS-LJQANCHMSA-N -1 1 332.403 4.226 20 0 EIADMM COc1cc(C(=O)N2C[C@@H](C(C)C)c3ccccc32)cc(Cl)c1[O-] ZINC000447319355 1030005852 /nfs/dbraw/zinc/00/58/52/1030005852.db2.gz XOTLSGUQOZVZDQ-AWEZNQCLSA-N -1 1 345.826 4.454 20 0 EIADMM COc1ccc(S(=O)(=O)[N-]c2cc(Cl)cc(Cl)c2)c(C)c1 ZINC000096659733 1030020412 /nfs/dbraw/zinc/02/04/12/1030020412.db2.gz OCEYLJBNQARKQW-UHFFFAOYSA-N -1 1 346.235 4.111 20 0 EIADMM O=S(=O)([N-]c1cc(F)c(F)c(F)c1)c1ccc2ccccc2c1 ZINC000107432410 1030031537 /nfs/dbraw/zinc/03/15/37/1030031537.db2.gz URHXPDAHVKIAAS-UHFFFAOYSA-N -1 1 337.322 4.058 20 0 EIADMM O=S(=O)([N-]c1ccc2ncccc2c1)c1ccc2ccccc2c1 ZINC000145212302 1030079887 /nfs/dbraw/zinc/07/98/87/1030079887.db2.gz KDVNDSRCTPVBQC-UHFFFAOYSA-N -1 1 334.400 4.189 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc(C(=O)C(C)(C)C)cc2)cc1 ZINC000148034764 1030103144 /nfs/dbraw/zinc/10/31/44/1030103144.db2.gz QXGWNUIABYOAOI-UHFFFAOYSA-N -1 1 331.437 4.025 20 0 EIADMM CC(C)c1cccnc1[N-]S(=O)(=O)Cc1ccc(C(F)F)cc1 ZINC000450990415 1030150669 /nfs/dbraw/zinc/15/06/69/1030150669.db2.gz ULEALDHSMHTWPN-UHFFFAOYSA-N -1 1 340.395 4.085 20 0 EIADMM CCOc1cc(-c2noc(-c3coc(C4CC4)n3)n2)cc(Cl)c1[O-] ZINC000685363829 1030238306 /nfs/dbraw/zinc/23/83/06/1030238306.db2.gz BFCSLPUSBVDKEN-UHFFFAOYSA-N -1 1 347.758 4.027 20 0 EIADMM Cc1sc(NC(=O)c2c(F)ccc([O-])c2F)nc1-c1ccccc1 ZINC000685418229 1030294228 /nfs/dbraw/zinc/29/42/28/1030294228.db2.gz CKJXWBUKMZHZRQ-UHFFFAOYSA-N -1 1 346.358 4.355 20 0 EIADMM O=C(N[C@@H]1CCC[C@@H](c2ccccc2)C1)c1c(F)ccc([O-])c1F ZINC000685482832 1030369039 /nfs/dbraw/zinc/36/90/39/1030369039.db2.gz SHZILTVQBVEPGD-ZIAGYGMSSA-N -1 1 331.362 4.127 20 0 EIADMM O=C([N-]c1nnc([C@H]2CCCO2)s1)c1cc2cc(Cl)ccc2o1 ZINC000054644649 1030397280 /nfs/dbraw/zinc/39/72/80/1030397280.db2.gz XVULZWLLOPEKED-LLVKDONJSA-N -1 1 349.799 4.042 20 0 EIADMM CC(C)c1ccc([N-]S(=O)(=O)c2ccc(F)c3ncccc23)cc1 ZINC000024578707 1030452776 /nfs/dbraw/zinc/45/27/76/1030452776.db2.gz XVUCSTNZWFWYDN-UHFFFAOYSA-N -1 1 344.411 4.298 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2ccc(Cl)c(Cl)c2)c(C)c1 ZINC000005234706 1030697035 /nfs/dbraw/zinc/69/70/35/1030697035.db2.gz LBKXJTFRQQPUPL-UHFFFAOYSA-N -1 1 330.236 4.411 20 0 EIADMM Cc1cc(Nc2ccc(F)c(Br)c2[O-])cc(C)c1O ZINC001211916951 1031071288 /nfs/dbraw/zinc/07/12/88/1031071288.db2.gz KIBJPBWLCKIJLF-UHFFFAOYSA-N -1 1 326.165 4.360 20 0 EIADMM CC[C@H]1CCC[N@@H+](Cc2ccc(C(=O)[O-])cc2Br)CC1 ZINC000226732183 1031104867 /nfs/dbraw/zinc/10/48/67/1031104867.db2.gz CDQKITOCCFFFRA-LBPRGKRZSA-N -1 1 340.261 4.159 20 0 EIADMM Cc1cc(F)cc(S(=O)(=O)[N-]c2ccc3oc(C(C)C)nc3c2)c1 ZINC000531345107 1031121623 /nfs/dbraw/zinc/12/16/23/1031121623.db2.gz UNYIUJDBEMQFMM-UHFFFAOYSA-N -1 1 348.399 4.200 20 0 EIADMM COc1ccc2c(c1)N(C(=O)c1cc(SC)ccc1[O-])CCCC2 ZINC000612283426 1031351612 /nfs/dbraw/zinc/35/16/12/1031351612.db2.gz FKBJZNLKDQMIIO-UHFFFAOYSA-N -1 1 343.448 4.106 20 0 EIADMM CC(C)CCOC1CCN(C(=O)c2ccc3ccccc3c2[O-])CC1 ZINC000193360589 1031646292 /nfs/dbraw/zinc/64/62/92/1031646292.db2.gz FUUSNHOJFHSBTP-UHFFFAOYSA-N -1 1 341.451 4.213 20 0 EIADMM O=S(=O)([N-]c1ccccc1NC1CCCCC1)c1ccccc1 ZINC000536558074 1031681406 /nfs/dbraw/zinc/68/14/06/1031681406.db2.gz SOJYBODJUBHDGR-UHFFFAOYSA-N -1 1 330.453 4.232 20 0 EIADMM O=C(Nc1ccc(F)cc1[O-])c1cccc(OCc2cccs2)c1 ZINC000532012172 1031975081 /nfs/dbraw/zinc/97/50/81/1031975081.db2.gz NOFWFVMOFWNWBI-UHFFFAOYSA-N -1 1 343.379 4.424 20 0 EIADMM O=C(CCc1ccccc1OC(F)(F)F)Nc1ccc(F)cc1[O-] ZINC000532012666 1031976008 /nfs/dbraw/zinc/97/60/08/1031976008.db2.gz IDLLUVRMXJGVJQ-UHFFFAOYSA-N -1 1 343.276 4.001 20 0 EIADMM CCc1ccc(S(=O)(=O)[N-]c2ccc(OC(C)C)cc2F)s1 ZINC000052025345 1034375853 /nfs/dbraw/zinc/37/58/53/1034375853.db2.gz VCNPWTPMGKWAEM-UHFFFAOYSA-N -1 1 343.445 4.038 20 0 EIADMM O=C(Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)c1cccc2ccsc21 ZINC000345257447 1035159405 /nfs/dbraw/zinc/15/94/05/1035159405.db2.gz FLHFOCAZAGDTRW-UHFFFAOYSA-N -1 1 335.388 4.249 20 0 EIADMM Cc1oc(-c2ccccc2)nc1C(=O)[N-]c1c(F)cc(F)cc1F ZINC000072505668 1035194805 /nfs/dbraw/zinc/19/48/05/1035194805.db2.gz OOUMDLONJWQNID-UHFFFAOYSA-N -1 1 332.281 4.320 20 0 EIADMM O=C([N-]c1nnc(-c2ccccc2Cl)s1)c1sccc1F ZINC000549946628 1035350220 /nfs/dbraw/zinc/35/02/20/1035350220.db2.gz MPRILIDMNTUORV-UHFFFAOYSA-N -1 1 339.804 4.311 20 0 EIADMM CCOc1cc(-c2noc([C@@H](C)CC(F)F)n2)cc(Cl)c1[O-] ZINC000420494732 1035643250 /nfs/dbraw/zinc/64/32/50/1035643250.db2.gz SIKMVEMZIOZHGE-ZETCQYMHSA-N -1 1 332.734 4.253 20 0 EIADMM COc1ccc(-c2nc(-c3ccsc3C(F)(F)F)no2)c([O-])c1 ZINC000904923512 1035672584 /nfs/dbraw/zinc/67/25/84/1035672584.db2.gz TZKAYMMITRLQAA-UHFFFAOYSA-N -1 1 342.298 4.198 20 0 EIADMM COc1cc(C(=O)Nc2ccc(Cl)cc2F)cc(Cl)c1[O-] ZINC000545886392 1035773749 /nfs/dbraw/zinc/77/37/49/1035773749.db2.gz DSQFMFBZGNFFQS-UHFFFAOYSA-N -1 1 330.142 4.099 20 0 EIADMM COc1cc([C@H](C)NCc2cc(C)c(C(=O)[O-])o2)cc2ccccc21 ZINC000905797640 1035894435 /nfs/dbraw/zinc/89/44/35/1035894435.db2.gz FYCNAWFZXYUVIJ-ZDUSSCGKSA-N -1 1 339.391 4.299 20 0 EIADMM CCc1ccccc1S(=O)(=O)[N-]c1ccc(C(=O)C2CCC2)cc1 ZINC000486075861 1036464156 /nfs/dbraw/zinc/46/41/56/1036464156.db2.gz CICFXRZYHXDEPN-UHFFFAOYSA-N -1 1 343.448 4.033 20 0 EIADMM CO[C@H](C)c1cccc([N-]S(=O)(=O)c2ccc3c(c2)CCCC3)c1 ZINC000588833512 1036545044 /nfs/dbraw/zinc/54/50/44/1036545044.db2.gz NTMDZYNIZNCHPY-CQSZACIVSA-N -1 1 345.464 4.074 20 0 EIADMM CC(C)(C)c1ccc(CC(=O)Nc2ccc(-c3cc(=O)[nH][n-]3)cc2)cc1 ZINC000486835423 1036870685 /nfs/dbraw/zinc/87/06/85/1036870685.db2.gz WJSJHIBRUNNXJM-UHFFFAOYSA-N -1 1 349.434 4.261 20 0 EIADMM O=C(Nc1cccc([O-])c1Br)C1(C2CCCCC2)CC1 ZINC000908716189 1036924030 /nfs/dbraw/zinc/92/40/30/1036924030.db2.gz BCAGNYWSNJNDBQ-UHFFFAOYSA-N -1 1 338.245 4.454 20 0 EIADMM CCc1ccc([C@H](C)C(=O)Nc2ccc(-c3cc(=O)[nH][n-]3)cc2)cc1 ZINC000590101347 1036973639 /nfs/dbraw/zinc/97/36/39/1036973639.db2.gz VOLDBZBRNYOUMQ-ZDUSSCGKSA-N -1 1 335.407 4.087 20 0 EIADMM O=C([O-])C[C@H](NCc1ccc(Cl)cc1Cl)c1cccs1 ZINC000037087935 1036995039 /nfs/dbraw/zinc/99/50/39/1036995039.db2.gz UYTJKOKAZZGUFV-LBPRGKRZSA-N -1 1 330.236 4.361 20 0 EIADMM O=S(=O)([N-]c1cc(F)ccc1Cl)c1cccc(Cl)c1F ZINC000590264832 1037037466 /nfs/dbraw/zinc/03/74/66/1037037466.db2.gz OWEDKAVUMMLINX-UHFFFAOYSA-N -1 1 338.162 4.072 20 0 EIADMM Cc1cc(Br)c([O-])c(NC(=O)c2cc[nH]c2C2CCC2)c1 ZINC000487239210 1037076022 /nfs/dbraw/zinc/07/60/22/1037076022.db2.gz MNKRXNJZDVJWMT-UHFFFAOYSA-N -1 1 349.228 4.311 20 0 EIADMM COc1cc(C2(C(=O)Nc3cc([O-])c(F)cc3F)CCC2)ccc1C ZINC000909978974 1037222862 /nfs/dbraw/zinc/22/28/62/1037222862.db2.gz LOTBZSVSDJSHGA-UHFFFAOYSA-N -1 1 347.361 4.048 20 0 EIADMM CC(C)(C)c1ncc(/C=C\C(=O)Nc2cc([O-])c(F)cc2F)s1 ZINC000909982939 1037234378 /nfs/dbraw/zinc/23/43/78/1037234378.db2.gz OCEGNNLWFVOHFM-PLNGDYQASA-N -1 1 338.379 4.076 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1CCCO[C@@H](c2ccccc2)C1 ZINC000591795347 1037585541 /nfs/dbraw/zinc/58/55/41/1037585541.db2.gz JPCXOGLZPZITAV-OAQYLSRUSA-N -1 1 347.414 4.149 20 0 EIADMM CCc1ccc(-c2nc(CN3C[C@@H](C(=O)[O-])CC[C@H]3C)cs2)cc1 ZINC000573723026 1037680408 /nfs/dbraw/zinc/68/04/08/1037680408.db2.gz QJIKUBAFWTYWKH-CJNGLKHVSA-N -1 1 344.480 4.058 20 0 EIADMM C[C@H](Oc1cccc(Cl)c1Cl)C(=O)Nc1c([O-])cccc1F ZINC000605440140 1037788691 /nfs/dbraw/zinc/78/86/91/1037788691.db2.gz LFVILYOBLJWJTJ-QMMMGPOBSA-N -1 1 344.169 4.244 20 0 EIADMM COc1ccc2cc([C@H](C)C(=O)Nc3c([O-])cccc3F)ccc2c1 ZINC000605439973 1037789120 /nfs/dbraw/zinc/78/91/20/1037789120.db2.gz ZFIDAEDNVQLSCA-LBPRGKRZSA-N -1 1 339.366 4.435 20 0 EIADMM O=C([O-])[C@H]1CCCN1Cc1ccc(-c2cccc(Cl)c2Cl)o1 ZINC000414688239 1037827231 /nfs/dbraw/zinc/82/72/31/1037827231.db2.gz XZSVJGUZTSSIPC-CYBMUJFWSA-N -1 1 340.206 4.302 20 0 EIADMM O=C([O-])CC1CCN(Cc2ccc(Oc3ccccc3)c(F)c2)CC1 ZINC000570403757 1037931375 /nfs/dbraw/zinc/93/13/75/1037931375.db2.gz ULODHGVXDNGGML-UHFFFAOYSA-N -1 1 343.398 4.305 20 0 EIADMM O=C(Nc1ccc(F)cc1[O-])[C@@H]1C[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000533971352 1038743880 /nfs/dbraw/zinc/74/38/80/1038743880.db2.gz VZKDSNYFQWRUSG-CHWSQXEVSA-N -1 1 339.288 4.292 20 0 EIADMM Cc1cc(C(=O)Nc2c([O-])cccc2F)cc(C)c1OC(F)F ZINC000608366149 1038802985 /nfs/dbraw/zinc/80/29/85/1038802985.db2.gz ODWKSLCKMPNEGL-UHFFFAOYSA-N -1 1 325.286 4.002 20 0 EIADMM O=C(Nc1c([O-])cccc1F)c1cc(Cl)ccc1Br ZINC000608365200 1038803525 /nfs/dbraw/zinc/80/35/25/1038803525.db2.gz BERQQBPMXJSXBF-UHFFFAOYSA-N -1 1 344.567 4.200 20 0 EIADMM Cc1ccc(-c2nc(CC(=O)Nc3c([O-])cccc3F)cs2)cc1 ZINC000608367076 1038804209 /nfs/dbraw/zinc/80/42/09/1038804209.db2.gz SRFFHWODTJZXTJ-UHFFFAOYSA-N -1 1 342.395 4.144 20 0 EIADMM O=C(Nc1c([O-])cccc1F)c1ccc(OCc2ccccc2)cc1 ZINC000608366962 1038804357 /nfs/dbraw/zinc/80/43/57/1038804357.db2.gz RCQRFVKCLMHTDY-UHFFFAOYSA-N -1 1 337.350 4.363 20 0 EIADMM CCc1onc(C)c1[N-]C(=O)c1cc(-c2ccc(Cl)cc2)on1 ZINC000119311202 1038884003 /nfs/dbraw/zinc/88/40/03/1038884003.db2.gz QOALWRJWRHOFRC-UHFFFAOYSA-N -1 1 331.759 4.106 20 0 EIADMM CC(C)(C)c1ccccc1S(=O)(=O)[N-]c1cc(F)cc(F)c1 ZINC000460459403 1038967283 /nfs/dbraw/zinc/96/72/83/1038967283.db2.gz MXEZHMJWVRAVRV-UHFFFAOYSA-N -1 1 325.380 4.063 20 0 EIADMM C[C@H](c1cccs1)N(C)C(=O)c1cc(Br)ccc1[O-] ZINC000120209207 1039073238 /nfs/dbraw/zinc/07/32/38/1039073238.db2.gz OHNDWXFWRONEIJ-SECBINFHSA-N -1 1 340.242 4.049 20 0 EIADMM CCSc1cccc([N-]S(=O)(=O)c2ccc(Cl)cc2)c1 ZINC000505311305 1039210954 /nfs/dbraw/zinc/21/09/54/1039210954.db2.gz KLFSRMDOZRESNV-UHFFFAOYSA-N -1 1 327.858 4.253 20 0 EIADMM O=C(Nc1c([O-])cc(Br)cc1Cl)c1ccc(F)cc1 ZINC000552196255 1039235322 /nfs/dbraw/zinc/23/53/22/1039235322.db2.gz RDEVIXNSSMWDBU-UHFFFAOYSA-N -1 1 344.567 4.200 20 0 EIADMM CCOc1cc(C(=O)Nc2scnc2C(C)C)cc(Cl)c1[O-] ZINC000456459038 1039358447 /nfs/dbraw/zinc/35/84/47/1039358447.db2.gz RBFTZJITZPIOPJ-UHFFFAOYSA-N -1 1 340.832 4.277 20 0 EIADMM Cc1cccc([C@@H]2CCCN2C(=O)c2cc3ccccc3cc2[O-])n1 ZINC000092759289 1039583759 /nfs/dbraw/zinc/58/37/59/1039583759.db2.gz BSOPFFARHXAJCZ-IBGZPJMESA-N -1 1 332.403 4.226 20 0 EIADMM Cc1cc(C)c(C)c(OCCC(=O)Nc2ccc([O-])c(F)c2F)c1 ZINC000456780250 1039600856 /nfs/dbraw/zinc/60/08/56/1039600856.db2.gz BLPWCXSBSLWVLL-UHFFFAOYSA-N -1 1 335.350 4.003 20 0 EIADMM CC(C)c1ccccc1OCCC(=O)Nc1ccc([O-])c(F)c1F ZINC000456787007 1039605242 /nfs/dbraw/zinc/60/52/42/1039605242.db2.gz PLKGXAARWDTGNW-UHFFFAOYSA-N -1 1 335.350 4.201 20 0 EIADMM CC(C)c1cccc(S(=O)(=O)[N-]c2ccc3ncccc3c2)c1 ZINC000534943726 1039865524 /nfs/dbraw/zinc/86/55/24/1039865524.db2.gz JGHYNUDVAVKEQC-UHFFFAOYSA-N -1 1 326.421 4.159 20 0 EIADMM Cc1ccc(C)c(S(=O)(=O)[N-]c2ccc3oc(C4CC4)nc3c2)c1 ZINC000032097214 1040209321 /nfs/dbraw/zinc/20/93/21/1040209321.db2.gz NQNNUQKKYGXLFB-UHFFFAOYSA-N -1 1 342.420 4.123 20 0 EIADMM COc1cccc([C@@H](C)Sc2nc(C(F)(F)F)cc(=O)[n-]2)c1 ZINC000435233648 1040209723 /nfs/dbraw/zinc/20/97/23/1040209723.db2.gz CCHAPIITPOOMGV-MRVPVSSYSA-N -1 1 330.331 4.063 20 0 EIADMM CC[C@@H](CC(F)F)C(=O)Nc1cc(C)cc(Br)c1[O-] ZINC000457696105 1040224907 /nfs/dbraw/zinc/22/49/07/1040224907.db2.gz RPGLIWHGVOBWDD-QMMMGPOBSA-N -1 1 336.176 4.083 20 0 EIADMM Cc1ccc([C@H](C)N(C)C(=O)c2ccc(Br)c([O-])c2)cc1 ZINC000482517280 1040314362 /nfs/dbraw/zinc/31/43/62/1040314362.db2.gz ARLBRQSZANWAPK-LBPRGKRZSA-N -1 1 348.240 4.296 20 0 EIADMM CCC[C@]1(C)CCCN(Cc2coc(-c3ccc(C(=O)[O-])cc3)n2)C1 ZINC000514945858 1040371094 /nfs/dbraw/zinc/37/10/94/1040371094.db2.gz YHLXTSFEEBVAST-HXUWFJFHSA-N -1 1 342.439 4.442 20 0 EIADMM CCc1oc(C(=O)Nc2cc(C)cc(Br)c2[O-])cc1C ZINC000482720660 1040454575 /nfs/dbraw/zinc/45/45/75/1040454575.db2.gz FRWDFIVIDLMDEQ-UHFFFAOYSA-N -1 1 338.201 4.179 20 0 EIADMM CO[C@@H](C)c1cccc([N-]S(=O)(=O)c2cccc3ccccc32)c1 ZINC000084460853 1040558878 /nfs/dbraw/zinc/55/88/78/1040558878.db2.gz PSBMTTJUNNWFNA-AWEZNQCLSA-N -1 1 341.432 4.348 20 0 EIADMM Cc1ccc(-c2nnc([C@H](C)Sc3nc(C)c(C)c(=O)[n-]3)o2)cc1 ZINC000539616387 1040612734 /nfs/dbraw/zinc/61/27/34/1040612734.db2.gz HYPBZVYOEDKWRQ-LBPRGKRZSA-N -1 1 342.424 4.011 20 0 EIADMM Cc1ccc(CS(=O)(=O)[N-]c2ccccc2C(F)(F)F)c(F)c1 ZINC000194595710 1040710785 /nfs/dbraw/zinc/71/07/85/1040710785.db2.gz DHBMKIODTBFNEK-UHFFFAOYSA-N -1 1 347.333 4.095 20 0 EIADMM CCOCCC1(c2nc(-c3ccc([O-])cc3Cl)no2)CCCC1 ZINC000445450996 1040771112 /nfs/dbraw/zinc/77/11/12/1040771112.db2.gz ZISUUYOUUIVYJV-UHFFFAOYSA-N -1 1 336.819 4.334 20 0 EIADMM [O-]c1ccc(-c2noc(CCCc3c[nH]c4ccccc34)n2)c(F)c1 ZINC000445452839 1040784580 /nfs/dbraw/zinc/78/45/80/1040784580.db2.gz FRAGIPWKEZEUOW-UHFFFAOYSA-N -1 1 337.354 4.238 20 0 EIADMM Cc1nc(-c2ccco2)ccc1-c1nc(-c2ccc([O-])cc2F)no1 ZINC000445458471 1040815455 /nfs/dbraw/zinc/81/54/55/1040815455.db2.gz XUOGHNCZGJLKMP-UHFFFAOYSA-N -1 1 337.310 4.212 20 0 EIADMM Cc1ccc(C)c(S(=O)(=O)[N-]c2cccc(C(C)(F)F)c2)c1 ZINC000436154082 1040909935 /nfs/dbraw/zinc/90/99/35/1040909935.db2.gz PZNYNQIQBMXENS-UHFFFAOYSA-N -1 1 325.380 4.216 20 0 EIADMM CCc1cc(=O)[n-]c(SCc2cc(Cl)cc3cccnc32)n1 ZINC000436260276 1041013936 /nfs/dbraw/zinc/01/39/36/1041013936.db2.gz LYZCAWKHCSGBBW-UHFFFAOYSA-N -1 1 331.828 4.239 20 0 EIADMM Cc1nc(-c2ccc(NC3C[C@H](C)C[C@@H](C)C3)nc2)[n-]c(=O)c1C ZINC000462860568 1041040149 /nfs/dbraw/zinc/04/01/49/1041040149.db2.gz HOSHRBNDAQSWIV-VXGBXAGGSA-N -1 1 326.444 4.098 20 0 EIADMM CCC(=O)c1cccc(S(=O)(=O)[N-]c2cccc(SC)c2C)c1 ZINC000538090158 1041041727 /nfs/dbraw/zinc/04/17/27/1041041727.db2.gz HKYCYFLMRPSGJK-UHFFFAOYSA-N -1 1 349.477 4.110 20 0 EIADMM CC[C@@H]1CCCC[C@@H]1Nc1ccc(-c2nc(C)c(C)c(=O)[n-]2)cn1 ZINC000462929697 1041109676 /nfs/dbraw/zinc/10/96/76/1041109676.db2.gz ODWQVUOLZTUWJT-ZBFHGGJFSA-N -1 1 326.444 4.242 20 0 EIADMM CSc1ccc(S(=O)(=O)[N-]c2ccc(-c3ccc[nH]3)cc2)cc1 ZINC000484146228 1041138529 /nfs/dbraw/zinc/13/85/29/1041138529.db2.gz ULPWIAYMNQJIFH-UHFFFAOYSA-N -1 1 344.461 4.204 20 0 EIADMM CC(C)c1ccc([C@H](CC(=O)[O-])NCc2ccc(Cl)cn2)cc1 ZINC000904002274 1041249024 /nfs/dbraw/zinc/24/90/24/1041249024.db2.gz RGKRZNOSLVCKBA-KRWDZBQOSA-N -1 1 332.831 4.164 20 0 EIADMM O=C(Nc1ccccc1COCc1ccccc1)c1ccc(O)cc1[O-] ZINC000436510435 1041296439 /nfs/dbraw/zinc/29/64/39/1041296439.db2.gz GXHFRCCXUCMCMM-UHFFFAOYSA-N -1 1 349.386 4.067 20 0 EIADMM CCCCN(C(=O)c1cc(Cl)c([O-])c(OCC)c1)[C@H](C)CC ZINC000436523470 1041307108 /nfs/dbraw/zinc/30/71/08/1041307108.db2.gz SWCMWQFWRWZYTH-GFCCVEGCSA-N -1 1 327.852 4.485 20 0 EIADMM O=C(Nc1cccc(OC(F)F)c1)c1cc2ccccc2cc1[O-] ZINC000436523674 1041307165 /nfs/dbraw/zinc/30/71/65/1041307165.db2.gz CCEHMHUUOQOCFH-UHFFFAOYSA-N -1 1 329.302 4.399 20 0 EIADMM O=C(Nc1ccc(Cl)cc1OC(F)F)c1cc(F)ccc1[O-] ZINC000436529413 1041313682 /nfs/dbraw/zinc/31/36/82/1041313682.db2.gz RKQFIRVRLJXDCM-UHFFFAOYSA-N -1 1 331.677 4.038 20 0 EIADMM CC(C)(C)c1nc2ccc(NC(=O)c3cc(F)c([O-])c(F)c3)cc2[nH]1 ZINC000436530059 1041315412 /nfs/dbraw/zinc/31/54/12/1041315412.db2.gz LXBFFNXBLLWOGB-UHFFFAOYSA-N -1 1 345.349 4.097 20 0 EIADMM CCOc1cc(-c2nc([C@H](OCC)C(C)C)no2)cc(Cl)c1[O-] ZINC000904121191 1041338862 /nfs/dbraw/zinc/33/88/62/1041338862.db2.gz JRLIKIREGZKTJT-CQSZACIVSA-N -1 1 340.807 4.228 20 0 EIADMM C[C@@H]1CN(C(=O)c2ccc3ccccc3c2[O-])[C@@H](c2ccccc2)CO1 ZINC000436577316 1041343934 /nfs/dbraw/zinc/34/39/34/1041343934.db2.gz TVRSFVFKGKEEOT-FOIQADDNSA-N -1 1 347.414 4.148 20 0 EIADMM O=C(NCCc1ccc2ccccc2n1)c1ccc2ccccc2c1[O-] ZINC000436561444 1041344533 /nfs/dbraw/zinc/34/45/33/1041344533.db2.gz CEWAJXFNGWQZHZ-UHFFFAOYSA-N -1 1 342.398 4.066 20 0 EIADMM CC1(C)CN(C(=O)c2ccccc2[O-])c2ccc(Br)cc21 ZINC000436569948 1041346722 /nfs/dbraw/zinc/34/67/22/1041346722.db2.gz KQKLVGYQQCWHTK-UHFFFAOYSA-N -1 1 346.224 4.093 20 0 EIADMM O=C([O-])C/C(=C\c1ccc(O)c(Cl)c1)c1nc2ccccc2o1 ZINC000436565220 1041346841 /nfs/dbraw/zinc/34/68/41/1041346841.db2.gz SSUCQRIDBUNMBO-YRNVUSSQSA-N -1 1 329.739 4.202 20 0 EIADMM O=C(Nc1cccc(COC2CCCCC2)c1)c1ccccc1[O-] ZINC000436570343 1041348797 /nfs/dbraw/zinc/34/87/97/1041348797.db2.gz PFKLYWVYQUKGIM-UHFFFAOYSA-N -1 1 325.408 4.494 20 0 EIADMM CCOc1ccc(OC)cc1NC(=O)c1ccc2ccccc2c1[O-] ZINC000436569081 1041349409 /nfs/dbraw/zinc/34/94/09/1041349409.db2.gz ZQJYVGFSRCSVAN-UHFFFAOYSA-N -1 1 337.375 4.205 20 0 EIADMM C[C@@H]1[C@H](Cc2ccccc2)CCN1C(=O)c1cc(Cl)ccc1[O-] ZINC000436574224 1041351609 /nfs/dbraw/zinc/35/16/09/1041351609.db2.gz JOBRQRJSQNRCPG-HIFRSBDPSA-N -1 1 329.827 4.139 20 0 EIADMM O=C(N[C@@H]1CCOC2(CCCCC2)C1)c1cc2ccccc2cc1[O-] ZINC000436598501 1041357350 /nfs/dbraw/zinc/35/73/50/1041357350.db2.gz ZNRANRICWWECIJ-QGZVFWFLSA-N -1 1 339.435 4.157 20 0 EIADMM Cc1cnc([C@@H](NC(=O)c2ccc3ccccc3c2[O-])C2CC2)s1 ZINC000436588629 1041363680 /nfs/dbraw/zinc/36/36/80/1041363680.db2.gz IIOAISAPAXSYNE-INIZCTEOSA-N -1 1 338.432 4.191 20 0 EIADMM Cc1cnc([C@@H](NC(=O)c2cc3ccccc3cc2[O-])C2CC2)s1 ZINC000436588118 1041366384 /nfs/dbraw/zinc/36/63/84/1041366384.db2.gz HDQWNAXMDLOUEE-KRWDZBQOSA-N -1 1 338.432 4.191 20 0 EIADMM CCC(=O)Nc1ccc(NC(=O)c2ccc(C(C)C)cc2[O-])cc1 ZINC000436652664 1041395467 /nfs/dbraw/zinc/39/54/67/1041395467.db2.gz PMMZBJPIBJYLMD-UHFFFAOYSA-N -1 1 326.396 4.116 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1CCn2c(cc3ccccc32)C1 ZINC000436655814 1041398341 /nfs/dbraw/zinc/39/83/41/1041398341.db2.gz OBBFUKQAIZFRHH-UHFFFAOYSA-N -1 1 342.398 4.156 20 0 EIADMM O=C(Nc1ccc([C@H]2CCOC2)cc1)c1ccc2ccccc2c1[O-] ZINC000436696492 1041429914 /nfs/dbraw/zinc/42/99/14/1041429914.db2.gz HKTZCLXTLSMLFD-INIZCTEOSA-N -1 1 333.387 4.302 20 0 EIADMM Cc1ccccc1[C@@H]1C[C@H](C)N(C(=O)c2ccc(Cl)cc2[O-])C1 ZINC000436716451 1041440581 /nfs/dbraw/zinc/44/05/81/1041440581.db2.gz BDIUQBQOLYZMSU-UONOGXRCSA-N -1 1 329.827 4.372 20 0 EIADMM C[C@H]1CN(C(=O)c2ccc(Cl)cc2[O-])CC[C@H]1c1ccccc1 ZINC000436718722 1041443039 /nfs/dbraw/zinc/44/30/39/1041443039.db2.gz LIDKMNXSXKEZCR-XJKSGUPXSA-N -1 1 329.827 4.311 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N1CCC[C@@H]1CCc1ccccc1 ZINC000436724535 1041444237 /nfs/dbraw/zinc/44/42/37/1041444237.db2.gz ZSPAENSDSYGNCH-MRXNPFEDSA-N -1 1 329.827 4.283 20 0 EIADMM CC(C)CCn1ncc(NC(=O)c2cc(F)ccc2[O-])c1C(C)C ZINC000436735266 1041446084 /nfs/dbraw/zinc/44/60/84/1041446084.db2.gz CDPNYMVTRQYVNN-UHFFFAOYSA-N -1 1 333.407 4.150 20 0 EIADMM CCN(CCc1cccs1)C(=O)c1cc2ccccc2cc1[O-] ZINC000436742160 1041450607 /nfs/dbraw/zinc/45/06/07/1041450607.db2.gz VDCCPQNBMZBTDE-UHFFFAOYSA-N -1 1 325.433 4.312 20 0 EIADMM CC(C)c1c(NC(=O)c2cc(F)ccc2[O-])cnn1-c1ccccc1 ZINC000436745955 1041452134 /nfs/dbraw/zinc/45/21/34/1041452134.db2.gz WKPOPXVTTIJTMV-UHFFFAOYSA-N -1 1 339.370 4.093 20 0 EIADMM C[C@H](NC(=O)c1c(F)ccc([O-])c1F)c1ccccc1C(F)(F)F ZINC000554861937 1041467950 /nfs/dbraw/zinc/46/79/50/1041467950.db2.gz UVRPQAYLIKNWDX-QMMMGPOBSA-N -1 1 345.267 4.180 20 0 EIADMM CC[C@@]1(C(=O)[O-])CCCN(Cc2c(Cl)cccc2OC(F)F)C1 ZINC000904400477 1041468776 /nfs/dbraw/zinc/46/87/76/1041468776.db2.gz HWPPYGBTRDHJKC-MRXNPFEDSA-N -1 1 347.789 4.018 20 0 EIADMM COc1cc(C)c(NC(=O)c2cc(Cl)c([O-])c(OC)c2)c(C)c1C ZINC000436780458 1041472781 /nfs/dbraw/zinc/47/27/81/1041472781.db2.gz ORIIORZOMVYIIL-UHFFFAOYSA-N -1 1 349.814 4.240 20 0 EIADMM CC[C@H](C)[C@H](C)N(C(=O)c1ccc(C(F)(F)F)cc1[O-])C1CC1 ZINC000436819075 1041486820 /nfs/dbraw/zinc/48/68/20/1041486820.db2.gz MOSVTGWQDDEACC-QWRGUYRKSA-N -1 1 329.362 4.450 20 0 EIADMM CN(Cc1cccc2[nH]ccc21)C(=O)c1ccc2ccccc2c1[O-] ZINC000436815263 1041493441 /nfs/dbraw/zinc/49/34/41/1041493441.db2.gz KMVZMSSTRXXRSO-UHFFFAOYSA-N -1 1 330.387 4.299 20 0 EIADMM CC(C)[C@H]1N(C(=O)c2ccc(C(F)(F)F)cc2[O-])CC12CCC2 ZINC000436829691 1041496216 /nfs/dbraw/zinc/49/62/16/1041496216.db2.gz STQBITXSIFHGEW-CQSZACIVSA-N -1 1 327.346 4.062 20 0 EIADMM CC1(C)CN(C(=O)c2ccc3ccccc3c2[O-])[C@H]1c1cccnc1 ZINC000436840078 1041508758 /nfs/dbraw/zinc/50/87/58/1041508758.db2.gz VPRPYHVFTSEKRK-IBGZPJMESA-N -1 1 332.403 4.164 20 0 EIADMM CC[C@H](c1cccc(OC)c1)N(C)C(=O)c1cc(Cl)ccc1[O-] ZINC000436846337 1041515879 /nfs/dbraw/zinc/51/58/79/1041515879.db2.gz MGCGQVPVBPJLID-MRXNPFEDSA-N -1 1 333.815 4.278 20 0 EIADMM O=C1CC[C@H](c2nc(-c3ccc([O-])cc3Cl)no2)c2ccccc21 ZINC000436871700 1041530244 /nfs/dbraw/zinc/53/02/44/1041530244.db2.gz KODBAZONSJLBJX-ZDUSSCGKSA-N -1 1 340.766 4.204 20 0 EIADMM Cc1ccc([C@H](NC(=O)c2ccc([O-])cc2F)c2ccccc2)cc1 ZINC000436880602 1041538651 /nfs/dbraw/zinc/53/86/51/1041538651.db2.gz OPZRLBAZYLHWIY-HXUWFJFHSA-N -1 1 335.378 4.359 20 0 EIADMM O=C(N[C@@H]1CC=C(c2ccc(F)cc2)CC1)c1ccc([O-])cc1F ZINC000436889135 1041543326 /nfs/dbraw/zinc/54/33/26/1041543326.db2.gz PMDBAGCSUFBPIC-OAHLLOKOSA-N -1 1 329.346 4.036 20 0 EIADMM CCc1ccc(-c2noc(-c3cc(Cl)c([O-])c(OC)c3)n2)cc1 ZINC000904575473 1041543860 /nfs/dbraw/zinc/54/38/60/1041543860.db2.gz IYYJAYWMJZZFLE-UHFFFAOYSA-N -1 1 330.771 4.334 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N1CCC[C@H]1/C=C/c1ccccc1 ZINC000436902157 1041554297 /nfs/dbraw/zinc/55/42/97/1041554297.db2.gz OTVWXSZRLZVTIZ-DZZUKKPASA-N -1 1 327.811 4.364 20 0 EIADMM CC[C@@H]1CN(C(=O)c2c(F)ccc([O-])c2F)CC[C@@H]1c1ccccc1 ZINC000540586804 1041556796 /nfs/dbraw/zinc/55/67/96/1041556796.db2.gz RKQWIZAJPDNIPB-HIFRSBDPSA-N -1 1 345.389 4.326 20 0 EIADMM O=C(c1ccc([O-])cc1F)N1CCC(c2cccc(Cl)c2)CC1 ZINC000436922528 1041559526 /nfs/dbraw/zinc/55/95/26/1041559526.db2.gz OBKXNUTYNRZEMV-UHFFFAOYSA-N -1 1 333.790 4.205 20 0 EIADMM C[C@]1(c2ccccc2)CCCN(C(=O)c2cc(Cl)ccc2[O-])C1 ZINC000436946406 1041568593 /nfs/dbraw/zinc/56/85/93/1041568593.db2.gz ASRNHNWFJSUIKR-IBGZPJMESA-N -1 1 329.827 4.240 20 0 EIADMM CCC[C@@H](C)[C@@H]1CCCN1C(=O)c1cc(Cl)c([O-])c(OCC)c1 ZINC000436963341 1041572353 /nfs/dbraw/zinc/57/23/53/1041572353.db2.gz CBFXQMVSRDUGHS-DOMZBBRYSA-N -1 1 339.863 4.485 20 0 EIADMM CN(Cc1cc(Cl)ccc1F)C(=O)c1ccc(Cl)cc1[O-] ZINC000437002841 1041588834 /nfs/dbraw/zinc/58/88/34/1041588834.db2.gz NJJQQTNJNUEEIQ-UHFFFAOYSA-N -1 1 328.170 4.110 20 0 EIADMM COc1ccc(Cl)c(NC(=O)c2ccc(C(F)(F)F)cc2[O-])c1 ZINC000540708718 1041607994 /nfs/dbraw/zinc/60/79/94/1041607994.db2.gz AZJSCSVXFOWFIL-UHFFFAOYSA-N -1 1 345.704 4.325 20 0 EIADMM CSc1ccc(S(=O)(=O)[N-]c2cccc(F)c2)cc1Cl ZINC000463516071 1041611246 /nfs/dbraw/zinc/61/12/46/1041611246.db2.gz HHNAKTSYOQBWFK-UHFFFAOYSA-N -1 1 331.821 4.002 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1CC[C@@](F)(c2ccccc2)C1 ZINC000669880927 1041680585 /nfs/dbraw/zinc/68/05/85/1041680585.db2.gz NMVMQNQMJCTDSZ-NRFANRHFSA-N -1 1 335.378 4.256 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1CC[C@](F)(c2ccccc2)C1 ZINC000669880928 1041681546 /nfs/dbraw/zinc/68/15/46/1041681546.db2.gz NMVMQNQMJCTDSZ-OAQYLSRUSA-N -1 1 335.378 4.256 20 0 EIADMM Cc1ccc(C(=O)[C@H](C)Sc2nc(C(F)F)cc(=O)[n-]2)cc1C ZINC000516688264 1041709932 /nfs/dbraw/zinc/70/99/32/1041709932.db2.gz YLLXSMINJPCFRP-JTQLQIEISA-N -1 1 338.379 4.100 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2ccc(C(=O)C(C)(C)C)cc2)ccc1F ZINC000426015976 1042185657 /nfs/dbraw/zinc/18/56/57/1042185657.db2.gz WBDQZDKBINWHIM-UHFFFAOYSA-N -1 1 349.427 4.164 20 0 EIADMM O=C(c1cccc(NCc2cccc([O-])c2Cl)c1)N1CCCCC1 ZINC000293309135 1042233951 /nfs/dbraw/zinc/23/39/51/1042233951.db2.gz QDQPQWOXGCEBNF-UHFFFAOYSA-N -1 1 344.842 4.284 20 0 EIADMM CCSc1cccc([N-]S(=O)(=O)c2cccc(F)c2C)c1 ZINC000438766767 1042339563 /nfs/dbraw/zinc/33/95/63/1042339563.db2.gz SUBOLBDAWZPHJB-UHFFFAOYSA-N -1 1 325.430 4.047 20 0 EIADMM Cc1cccc(S(=O)(=O)[N-]c2ccc(C(F)(F)F)c(C)c2)c1 ZINC000438778749 1042345443 /nfs/dbraw/zinc/34/54/43/1042345443.db2.gz RWLWINHYJFZGNS-UHFFFAOYSA-N -1 1 329.343 4.123 20 0 EIADMM CC[C@@H](C)c1ccc(S(=O)(=O)[N-]c2ccccc2N(C)C)cc1 ZINC000518332359 1042473640 /nfs/dbraw/zinc/47/36/40/1042473640.db2.gz USGFZIQLASDBCI-CQSZACIVSA-N -1 1 332.469 4.067 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc3oc(C(C)C)nc3c2)cc1 ZINC000032097590 1043021644 /nfs/dbraw/zinc/02/16/44/1043021644.db2.gz BHVMTUZVCXUULG-UHFFFAOYSA-N -1 1 330.409 4.060 20 0 EIADMM Cc1cc(Br)c([O-])c(NC(=O)c2ccccc2Cl)c1 ZINC000182919996 1043035303 /nfs/dbraw/zinc/03/53/03/1043035303.db2.gz KYCNBJVUYGDRBO-UHFFFAOYSA-N -1 1 340.604 4.369 20 0 EIADMM C[C@@H](CCC(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)c1ccccc1 ZINC000441809259 1043116003 /nfs/dbraw/zinc/11/60/03/1043116003.db2.gz QGGAZLNUNCGTSW-AWEZNQCLSA-N -1 1 335.407 4.305 20 0 EIADMM CCOc1cc(C(=O)NCc2ccc(Cl)cc2)cc(Cl)c1[O-] ZINC000215890795 1043159634 /nfs/dbraw/zinc/15/96/34/1043159634.db2.gz LRMXSZMQSOGLMO-UHFFFAOYSA-N -1 1 340.206 4.028 20 0 EIADMM O=S(=O)([N-]c1ccc2nc(C(F)F)sc2c1)c1ccccc1 ZINC000350514751 1043160242 /nfs/dbraw/zinc/16/02/42/1043160242.db2.gz NGZAWSYHHRXKDX-UHFFFAOYSA-N -1 1 340.376 4.035 20 0 EIADMM Cc1ccc2c(CCC(=O)Nc3ccc([O-])c(Cl)c3)c[nH]c2c1 ZINC000509173542 1043179872 /nfs/dbraw/zinc/17/98/72/1043179872.db2.gz XPQIYINYCWTZDH-UHFFFAOYSA-N -1 1 328.799 4.407 20 0 EIADMM CCc1ccc(S(=O)(=O)[N-]c2cccc(SC(F)F)c2)cc1 ZINC000727363455 1043208734 /nfs/dbraw/zinc/20/87/34/1043208734.db2.gz PQYOQERHBVBVFQ-UHFFFAOYSA-N -1 1 343.420 4.365 20 0 EIADMM COC(=O)c1cc(F)c(C)c(Nc2cc(F)c([O-])c(Cl)c2)c1 ZINC001214494354 1043298852 /nfs/dbraw/zinc/29/88/52/1043298852.db2.gz NYJMGECWSHQWPI-UHFFFAOYSA-N -1 1 327.714 4.162 20 0 EIADMM [O-]c1cccc(CN2CCO[C@H](c3ccccc3Cl)C2)c1Cl ZINC000508209829 1043304404 /nfs/dbraw/zinc/30/44/04/1043304404.db2.gz SCFHBABHTXDVIG-INIZCTEOSA-N -1 1 338.234 4.273 20 0 EIADMM O=C1[N-]C(=O)C(=Cc2ccc(SCc3ccccc3)cc2)S1 ZINC000199202872 1043336949 /nfs/dbraw/zinc/33/69/49/1043336949.db2.gz LPHJKXKWXJPHAP-XNTDXEJSSA-N -1 1 327.430 4.303 20 0 EIADMM Cc1nc(CC(C)C)oc1C(=O)[N-]c1nc(-c2cccs2)ns1 ZINC000189180852 1043461969 /nfs/dbraw/zinc/46/19/69/1043461969.db2.gz OVSWAMXYYGGRTN-UHFFFAOYSA-N -1 1 348.453 4.014 20 0 EIADMM CCc1ccccc1[N-]S(=O)(=O)c1ccc(CC(F)(F)F)cc1 ZINC000189233671 1043497003 /nfs/dbraw/zinc/49/70/03/1043497003.db2.gz BCFIPOAMTHOEHQ-UHFFFAOYSA-N -1 1 343.370 4.155 20 0 EIADMM Cc1c(F)cccc1[N-]S(=O)(=O)c1ccc(CC(F)(F)F)cc1 ZINC000189304573 1043536447 /nfs/dbraw/zinc/53/64/47/1043536447.db2.gz QKHRAQNDBGEDDE-UHFFFAOYSA-N -1 1 347.333 4.040 20 0 EIADMM Cc1ccc(CCCCC(=O)Nc2ccc(-c3cc(=O)[nH][n-]3)cc2)cc1 ZINC000521168048 1043606344 /nfs/dbraw/zinc/60/63/44/1043606344.db2.gz HIKDDVAQNIMQTD-UHFFFAOYSA-N -1 1 349.434 4.442 20 0 EIADMM C[C@@H]1CO[C@H](c2ccccc2)[C@@H](C)N1C(=O)c1ccc(Cl)cc1[O-] ZINC000732019436 1043870322 /nfs/dbraw/zinc/87/03/22/1043870322.db2.gz IMWLWCUTGKPJAJ-VFVRVIDISA-N -1 1 345.826 4.036 20 0 EIADMM COc1cc(C(=O)NCC(C)(C)Cc2ccccc2)cc(Cl)c1[O-] ZINC000442968183 1043928515 /nfs/dbraw/zinc/92/85/15/1043928515.db2.gz SAURSWPQRMEOHF-UHFFFAOYSA-N -1 1 347.842 4.053 20 0 EIADMM COc1cc(C(=O)Nc2ccc3c(c2)CC(C)(C)O3)cc(Cl)c1[O-] ZINC000443067956 1043987636 /nfs/dbraw/zinc/98/76/36/1043987636.db2.gz HNVCEEFZJNEOTL-UHFFFAOYSA-N -1 1 347.798 4.020 20 0 EIADMM COc1cc(C(=O)N2CCCC[C@H]2CC(C)C)cc(Cl)c1[O-] ZINC000443052548 1043991517 /nfs/dbraw/zinc/99/15/17/1043991517.db2.gz UTSGCTHOKDVUQL-ZDUSSCGKSA-N -1 1 325.836 4.095 20 0 EIADMM COc1cc(C(=O)N[C@H]2CC(C)(C)c3ccccc32)cc(Cl)c1[O-] ZINC000443057891 1043995358 /nfs/dbraw/zinc/99/53/58/1043995358.db2.gz LJZXYDAZUWKFLR-HNNXBMFYSA-N -1 1 345.826 4.207 20 0 EIADMM COc1cc(C(=O)NCc2cccc(C(C)C)c2)cc(Cl)c1[O-] ZINC000443107602 1044023844 /nfs/dbraw/zinc/02/38/44/1044023844.db2.gz KQJWZMQMANQSMX-UHFFFAOYSA-N -1 1 333.815 4.108 20 0 EIADMM COc1cc(C(=O)Nc2cc(SC)ccc2C)cc(Cl)c1[O-] ZINC000443135167 1044046569 /nfs/dbraw/zinc/04/65/69/1044046569.db2.gz VHDXNSJEMZIYFY-UHFFFAOYSA-N -1 1 337.828 4.337 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N1CCC[C@H]1c1ccc(F)c(F)c1 ZINC000733002685 1044057537 /nfs/dbraw/zinc/05/75/37/1044057537.db2.gz HMANBVXZKRTUCZ-HNNXBMFYSA-N -1 1 337.753 4.301 20 0 EIADMM CC[C@@H](Cc1ccccc1)N(C)C(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC000443288071 1044157198 /nfs/dbraw/zinc/15/71/98/1044157198.db2.gz AMPMUSYSZRALDE-HNNXBMFYSA-N -1 1 347.842 4.148 20 0 EIADMM Cc1csc(-c2cccc(S(=O)(=O)[N-]c3ccc(C)cc3)c2)n1 ZINC000443401949 1044259276 /nfs/dbraw/zinc/25/92/76/1044259276.db2.gz FDNNYGSBKPJHJU-UHFFFAOYSA-N -1 1 344.461 4.228 20 0 EIADMM O=C(c1ncccc1[O-])N1CCCCC[C@H]1Cc1ccccc1Cl ZINC000508426147 1044443261 /nfs/dbraw/zinc/44/32/61/1044443261.db2.gz FUYWZLNDTKLGCK-HNNXBMFYSA-N -1 1 344.842 4.068 20 0 EIADMM O=C([N-]c1nnc(-c2cccc(Cl)c2)s1)c1sccc1F ZINC000550573530 1044696590 /nfs/dbraw/zinc/69/65/90/1044696590.db2.gz PACMKFPNSQCSAK-UHFFFAOYSA-N -1 1 339.804 4.311 20 0 EIADMM O=C([N-]c1nc(C2CC2)no1)c1sc2cc(F)ccc2c1Cl ZINC000734874483 1044706242 /nfs/dbraw/zinc/70/62/42/1044706242.db2.gz FFUWVUMYGUETLX-UHFFFAOYSA-N -1 1 337.763 4.207 20 0 EIADMM CCC1(CC)CCN(C(=O)c2ccc(Br)c([O-])c2)CC1 ZINC000230234857 1044809843 /nfs/dbraw/zinc/80/98/43/1044809843.db2.gz WFPDIRRUROVVLL-UHFFFAOYSA-N -1 1 340.261 4.197 20 0 EIADMM Cc1cc(C)cc(NNC(=O)c2c[nH]nc2-c2ccc(Cl)s2)c1 ZINC000187086793 1044950607 /nfs/dbraw/zinc/95/06/07/1044950607.db2.gz JOVDUVZEJYVYFI-UHFFFAOYSA-N -1 1 346.843 4.165 20 0 EIADMM O=C([O-])CCCN1CCC[C@H]1c1ccc(Br)cc1Cl ZINC000626009060 1045122506 /nfs/dbraw/zinc/12/25/06/1045122506.db2.gz VOJDQDMCMPEVPV-ZDUSSCGKSA-N -1 1 346.652 4.104 20 0 EIADMM CC[C@]1(C(=O)[O-])CCCN(Cc2ccc(Cl)c(C(F)(F)F)c2)C1 ZINC000923469100 1045124552 /nfs/dbraw/zinc/12/45/52/1045124552.db2.gz HDTSXVHSEKVYOM-HNNXBMFYSA-N -1 1 349.780 4.436 20 0 EIADMM CSc1ccc(S(=O)(=O)[N-]c2cccc(SC)c2C)cc1 ZINC000611371838 1045290929 /nfs/dbraw/zinc/29/09/29/1045290929.db2.gz DKWYHFKGIAOHJG-UHFFFAOYSA-N -1 1 339.507 4.240 20 0 EIADMM Cc1cnc(SCc2cccc(NC(=O)OC(C)(C)C)c2)[n-]c1=O ZINC000496117304 1045505997 /nfs/dbraw/zinc/50/59/97/1045505997.db2.gz CWYHYMIUTMGSCT-UHFFFAOYSA-N -1 1 347.440 4.130 20 0 EIADMM Cc1c(=O)[n-]c(SC[C@H]2CC2(Cl)Cl)nc1-c1ccccc1 ZINC000767440860 1045527797 /nfs/dbraw/zinc/52/77/97/1045527797.db2.gz VSSUMETVQDUMRC-LLVKDONJSA-N -1 1 341.263 4.444 20 0 EIADMM O=C(Nc1nc(/C=C/c2ccccc2)cs1)c1ccc([O-])c(F)c1 ZINC000768168101 1045734428 /nfs/dbraw/zinc/73/44/28/1045734428.db2.gz SWICIHYWKXNFCW-SOFGYWHQSA-N -1 1 340.379 4.411 20 0 EIADMM [O-]c1cccc(CNCc2cc(F)ccc2Br)c1Cl ZINC000328203173 1045938002 /nfs/dbraw/zinc/93/80/02/1045938002.db2.gz GRHANRZPEOYJJI-UHFFFAOYSA-N -1 1 344.611 4.237 20 0 EIADMM O=C(c1c([O-])cccc1Cl)N(Cc1ccco1)Cc1ccco1 ZINC000769668791 1046042675 /nfs/dbraw/zinc/04/26/75/1046042675.db2.gz YHNRZMRFBRHADU-UHFFFAOYSA-N -1 1 331.755 4.074 20 0 EIADMM COc1ccccc1[C@@H]1CCCN1C(=O)c1c([O-])cccc1Cl ZINC000769751347 1046056020 /nfs/dbraw/zinc/05/60/20/1046056020.db2.gz GYTQCHUYZRYTNS-AWEZNQCLSA-N -1 1 331.799 4.032 20 0 EIADMM O=S(=O)(/C=C/c1ccc(Cl)cc1)[N-]c1ccc2ccccc2n1 ZINC000729811467 1046178522 /nfs/dbraw/zinc/17/85/22/1046178522.db2.gz KGHLWEYOTANMRH-VAWYXSNFSA-N -1 1 344.823 4.301 20 0 EIADMM O=C([O-])c1ccc(CN2CCC[C@@H](Oc3ccccc3Cl)C2)cc1 ZINC000455659097 1046389486 /nfs/dbraw/zinc/38/94/86/1046389486.db2.gz ORXRNNMXBCRJMH-MRXNPFEDSA-N -1 1 345.826 4.082 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc(SC(F)F)cc2)cc1F ZINC000917712550 1047079738 /nfs/dbraw/zinc/07/97/38/1047079738.db2.gz HOLFMTJVPWKAOX-UHFFFAOYSA-N -1 1 347.383 4.250 20 0 EIADMM CCc1nc(SC[C@@H]2[C@@H](c3ccccc3)C2(F)F)[n-]c(=O)c1C ZINC000917842888 1047168932 /nfs/dbraw/zinc/16/89/32/1047168932.db2.gz KCGJJHDKHVWAFS-TZMCWYRMSA-N -1 1 336.407 4.194 20 0 EIADMM Cc1nn(-c2ccccc2)c(C)c1C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000129559593 1047429428 /nfs/dbraw/zinc/42/94/28/1047429428.db2.gz INYIIIYGHMIPFR-UHFFFAOYSA-N -1 1 341.798 4.100 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1c[nH]cc1-c1ccc(F)cc1 ZINC000129620896 1047448149 /nfs/dbraw/zinc/44/81/49/1047448149.db2.gz XOWXAWFJCINWFH-UHFFFAOYSA-N -1 1 330.746 4.432 20 0 EIADMM CCCc1ccc([N-]S(=O)(=O)c2ccc(C(F)F)cc2)cc1 ZINC000808070431 1047596702 /nfs/dbraw/zinc/59/67/02/1047596702.db2.gz PDYYDTVZLXDZBK-UHFFFAOYSA-N -1 1 325.380 4.378 20 0 EIADMM CC1CCN(c2ccc(NC(=O)c3ccc([O-])cc3F)cc2)CC1 ZINC000154895990 1047754712 /nfs/dbraw/zinc/75/47/12/1047754712.db2.gz VDFVPVKQDVRJPZ-UHFFFAOYSA-N -1 1 328.387 4.020 20 0 EIADMM Cc1nc(C(C)(C)C)[n-]c(=O)c1C(=O)NCC(C)(C)C1CCCCC1 ZINC000498904101 1047921082 /nfs/dbraw/zinc/92/10/82/1047921082.db2.gz QGFSEVPVHOYZIR-UHFFFAOYSA-N -1 1 347.503 4.124 20 0 EIADMM C[C@@H]1C[C@H](c2cccc(F)c2)N(C(=O)c2c([O-])cccc2Cl)C1 ZINC001137014973 1048066022 /nfs/dbraw/zinc/06/60/22/1048066022.db2.gz RURIHXOZQNBVFM-IAQYHMDHSA-N -1 1 333.790 4.408 20 0 EIADMM CCc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)c2ccc([O-])c(F)c2)o1 ZINC001137026360 1048075981 /nfs/dbraw/zinc/07/59/81/1048075981.db2.gz ICMKVUCMIOJDGD-LRDDRELGSA-N -1 1 331.387 4.300 20 0 EIADMM C[C@@H](CC(=O)Nc1c([O-])cc(Br)cc1Cl)C1CC1 ZINC000843887418 1048137698 /nfs/dbraw/zinc/13/76/98/1048137698.db2.gz ULJNXWSCLLQFLJ-ZETCQYMHSA-N -1 1 332.625 4.183 20 0 EIADMM O=C(CCCC1CC1)Nc1c([O-])cc(Br)cc1Cl ZINC000843885675 1048137837 /nfs/dbraw/zinc/13/78/37/1048137837.db2.gz IRXLYIXYUXDPOV-UHFFFAOYSA-N -1 1 332.625 4.327 20 0 EIADMM CCCCC[C@H](NC(=O)c1cnc(C2CC2)[n-]c1=O)c1ccccc1 ZINC001143658635 1048139853 /nfs/dbraw/zinc/13/98/53/1048139853.db2.gz OSCXIPWJMLFQGL-KRWDZBQOSA-N -1 1 339.439 4.111 20 0 EIADMM O=C(Nc1cc(C(F)(F)F)ccc1F)c1c(F)ccc([O-])c1F ZINC001143891246 1048267906 /nfs/dbraw/zinc/26/79/06/1048267906.db2.gz JGTWWDIDDFVSTF-UHFFFAOYSA-N -1 1 335.203 4.081 20 0 EIADMM O=S(=O)(c1ccc([O-])cc1)[C@@H]1CCc2c1cc(Cl)cc2Cl ZINC000133155095 1048636924 /nfs/dbraw/zinc/63/69/24/1048636924.db2.gz ZOQGFRPHSVYDJZ-OAHLLOKOSA-N -1 1 343.231 4.160 20 0 EIADMM CCCOc1ccc([C@@H](C)NC(=O)c2c([O-])cccc2Cl)cc1 ZINC000920444791 1048675350 /nfs/dbraw/zinc/67/53/50/1048675350.db2.gz LEOYJOOWEBERHR-GFCCVEGCSA-N -1 1 333.815 4.325 20 0 EIADMM CC(C)CC(CC(C)C)NC(=O)c1c([O-])cnc2c(F)cccc21 ZINC001144530197 1048714478 /nfs/dbraw/zinc/71/44/78/1048714478.db2.gz RGAYICUWFZWNBF-UHFFFAOYSA-N -1 1 332.419 4.270 20 0 EIADMM CCC[C@H](C(=O)c1ccccc1)N(C)Cc1cc(F)c([O-])cc1F ZINC001144663838 1048781129 /nfs/dbraw/zinc/78/11/29/1048781129.db2.gz KVCLSCPCLJFCTH-QGZVFWFLSA-N -1 1 333.378 4.154 20 0 EIADMM CN(Cc1cccc(C(F)(F)F)c1)Cc1cc(F)c([O-])cc1F ZINC001144667579 1048783794 /nfs/dbraw/zinc/78/37/94/1048783794.db2.gz WIZFPOSCDWFPDN-UHFFFAOYSA-N -1 1 331.284 4.321 20 0 EIADMM O=S(=O)(/C=C\c1cccc(Cl)c1)[N-]c1cc(Cl)ccc1O ZINC000768880509 1048804535 /nfs/dbraw/zinc/80/45/35/1048804535.db2.gz CVNBJWWUXCLGLD-SREVYHEPSA-N -1 1 344.219 4.112 20 0 EIADMM C[C@@H]1CC/C(=C\C(=O)Nc2c([O-])cc(Br)cc2Cl)C1 ZINC000816590695 1048832369 /nfs/dbraw/zinc/83/23/69/1048832369.db2.gz JDCFAUGSPVCZQL-CBVZUMJXSA-N -1 1 344.636 4.493 20 0 EIADMM Cc1cnc(C(=O)N(Cc2ccccc2Cl)C2CCCC2)c([O-])c1 ZINC001144746316 1048844305 /nfs/dbraw/zinc/84/43/05/1048844305.db2.gz YFDRZDFNHAPBNI-UHFFFAOYSA-N -1 1 344.842 4.334 20 0 EIADMM O=C(NCc1cccc2ccccc21)c1c([O-])cnc2c(F)cccc21 ZINC001144751988 1048844420 /nfs/dbraw/zinc/84/44/20/1048844420.db2.gz CEPGXNXZTVKAIA-UHFFFAOYSA-N -1 1 346.361 4.163 20 0 EIADMM Cc1cccc(Oc2ccccc2CNC(=O)c2ncc(C)cc2[O-])c1 ZINC001144769544 1048854153 /nfs/dbraw/zinc/85/41/53/1048854153.db2.gz PYIBDALAXJBWHP-UHFFFAOYSA-N -1 1 348.402 4.126 20 0 EIADMM O=C(N[C@@H]1CC[C@H]2CCCC[C@H]2C1)c1c([O-])cnc2c(F)cccc21 ZINC001135794394 1048887576 /nfs/dbraw/zinc/88/75/76/1048887576.db2.gz KAJNRMMEVFXELL-HZSPNIEDSA-N -1 1 342.414 4.168 20 0 EIADMM CCOc1cccc2cc([C@@H](C)NC(=O)c3c([O-])cccc3F)oc21 ZINC001135846684 1048926771 /nfs/dbraw/zinc/92/67/71/1048926771.db2.gz SZNSBUINGXCBRH-LLVKDONJSA-N -1 1 343.354 4.167 20 0 EIADMM O=C([N-][C@@H]1CCC(F)(F)C1)C(F)(F)c1cc(Cl)ccc1Cl ZINC000817439609 1048974862 /nfs/dbraw/zinc/97/48/62/1048974862.db2.gz AFWVPIVGTADXGN-MRVPVSSYSA-N -1 1 344.135 4.389 20 0 EIADMM Cc1cc(C=O)c([O-])c(C(=O)N[C@@H](CC(C)C)c2ccccc2C)c1 ZINC001146488308 1049030756 /nfs/dbraw/zinc/03/07/56/1049030756.db2.gz JFEBQAKQZBICAX-IBGZPJMESA-N -1 1 339.435 4.339 20 0 EIADMM CC(C)c1ccc(CN(C)C(=O)Cc2ccc([O-])c(Cl)c2)cc1 ZINC001136152255 1049184345 /nfs/dbraw/zinc/18/43/45/1049184345.db2.gz KSFPRTLAPSNMIV-UHFFFAOYSA-N -1 1 331.843 4.370 20 0 EIADMM Cc1ccc([C@@H]2[C@@H](C)CCCN2C(=O)c2ccc([O-])c(F)c2)cc1 ZINC001147796244 1049220225 /nfs/dbraw/zinc/22/02/25/1049220225.db2.gz QXKRZSBMHGQQTN-LIRRHRJNSA-N -1 1 327.399 4.453 20 0 EIADMM CC(C)Cc1ccc(S(=O)(=O)[N-]c2ccc3[nH]ccc3c2)cc1 ZINC000078677407 1049268100 /nfs/dbraw/zinc/26/81/00/1049268100.db2.gz AIFZEJMSWXFCDO-UHFFFAOYSA-N -1 1 328.437 4.167 20 0 EIADMM CC1(C)CO[C@H](CC(=O)Nc2cc(Cl)c([O-])c3ccccc23)C1 ZINC001148253063 1049287904 /nfs/dbraw/zinc/28/79/04/1049287904.db2.gz OTIQYJMVFDJECN-LLVKDONJSA-N -1 1 333.815 4.343 20 0 EIADMM Cc1c(N)c(C(=O)Nc2cc(Cl)c([O-])c3ccccc23)ccc1F ZINC001148251817 1049288089 /nfs/dbraw/zinc/28/80/89/1049288089.db2.gz CGQKODAWAMJBTQ-UHFFFAOYSA-N -1 1 344.773 4.481 20 0 EIADMM O=C(Nc1cc(Cl)c([O-])c2ccccc12)c1cc(C(F)F)ncn1 ZINC001148253411 1049288460 /nfs/dbraw/zinc/28/84/60/1049288460.db2.gz RQXFAUVRZHRKFN-UHFFFAOYSA-N -1 1 349.724 4.179 20 0 EIADMM Cc1cc(=O)n(-c2ccc(C(=O)Nc3ccccc3C(C)C)cc2)[n-]1 ZINC001148325971 1049301361 /nfs/dbraw/zinc/30/13/61/1049301361.db2.gz DJLXUBYHDAQMCV-UHFFFAOYSA-N -1 1 335.407 4.175 20 0 EIADMM CCC(CC)(CNC(=O)Cc1ccc([O-])c(Cl)c1)c1ccccc1 ZINC001148421147 1049314542 /nfs/dbraw/zinc/31/45/42/1049314542.db2.gz GGCUHERTFHQQAT-UHFFFAOYSA-N -1 1 345.870 4.462 20 0 EIADMM CC(C)Cc1ccccc1CNC(=O)c1ccc2ccc(O)cc2c1[O-] ZINC001148578381 1049340049 /nfs/dbraw/zinc/34/00/49/1049340049.db2.gz CRQLNQDZKKAPSO-UHFFFAOYSA-N -1 1 349.430 4.380 20 0 EIADMM CCC(CC)CN(CC)C(=O)c1cc(-c2ccc(C=O)o2)ccc1[O-] ZINC001136238934 1049347340 /nfs/dbraw/zinc/34/73/40/1049347340.db2.gz HVAGRTLOPUNXNR-UHFFFAOYSA-N -1 1 343.423 4.363 20 0 EIADMM CCC(=CC(=O)Nc1c([O-])cc(Br)cc1Cl)CC ZINC000819787263 1049377889 /nfs/dbraw/zinc/37/78/89/1049377889.db2.gz JYAGWRZGAGEBNZ-UHFFFAOYSA-N -1 1 332.625 4.493 20 0 EIADMM O=C(N[C@H]1CCc2c1cccc2O)c1cccc(-c2ccccc2)c1[O-] ZINC001148872495 1049393925 /nfs/dbraw/zinc/39/39/25/1049393925.db2.gz KLFKEHAUSXHACN-IBGZPJMESA-N -1 1 345.398 4.182 20 0 EIADMM COc1cccc([O-])c1C(=O)Nc1nc(-c2ccccc2)c(C)s1 ZINC001136306203 1049441784 /nfs/dbraw/zinc/44/17/84/1049441784.db2.gz WSMOMLIFRDKOBS-UHFFFAOYSA-N -1 1 340.404 4.085 20 0 EIADMM Cc1cc(Cl)cnc1[N-]S(=O)(=O)/C=C/c1cccc(Cl)c1 ZINC000812339273 1049443772 /nfs/dbraw/zinc/44/37/72/1049443772.db2.gz SVBNTSZLYMRCQG-AATRIKPKSA-N -1 1 343.235 4.109 20 0 EIADMM CCN(C(=O)c1ncc2ccccc2c1[O-])[C@H](C)c1ccc(F)cc1 ZINC001136315643 1049465219 /nfs/dbraw/zinc/46/52/19/1049465219.db2.gz GAWCNPSUWXYHEZ-CYBMUJFWSA-N -1 1 338.382 4.303 20 0 EIADMM CC(C)Oc1ccc([C@@H](C)NC(=O)Cc2ccc([O-])c(Cl)c2)cc1 ZINC001136408675 1049591487 /nfs/dbraw/zinc/59/14/87/1049591487.db2.gz WOSKIDZZVFUQEO-CYBMUJFWSA-N -1 1 347.842 4.253 20 0 EIADMM COc1cnc(C=Cc2ccc(-c3ccccc3Cl)o2)[n-]c1=O ZINC000821007239 1049593252 /nfs/dbraw/zinc/59/32/52/1049593252.db2.gz GEMGHIVKYUIDDS-VQHVLOKHSA-N -1 1 328.755 4.275 20 0 EIADMM COc1cnc(C=Cc2ccc(-c3cccs3)cc2F)[n-]c1=O ZINC000821007698 1049594519 /nfs/dbraw/zinc/59/45/19/1049594519.db2.gz KHOQOYUFYAHDHU-VOTSOKGWSA-N -1 1 328.368 4.229 20 0 EIADMM O=C(c1cc(Cl)ccc1[O-])N(C1CC1)[C@H]1CCc2ccccc21 ZINC001136430903 1049621832 /nfs/dbraw/zinc/62/18/32/1049621832.db2.gz KSYQQWIBDSDQAN-KRWDZBQOSA-N -1 1 327.811 4.338 20 0 EIADMM CCC[C@H](NC(=O)c1ccc([O-])cn1)c1cccc(C(F)(F)F)c1 ZINC001136563240 1049748141 /nfs/dbraw/zinc/74/81/41/1049748141.db2.gz UCXNQTCEMGGUAY-AWEZNQCLSA-N -1 1 338.329 4.077 20 0 EIADMM COc1ccc(N(CC2CC2)C(=O)c2cc(SC)ccc2[O-])cc1 ZINC000615841765 1049795531 /nfs/dbraw/zinc/79/55/31/1049795531.db2.gz FBKPHFJXRLDKGD-UHFFFAOYSA-N -1 1 343.448 4.180 20 0 EIADMM O=C(N[C@H](c1ccc(Cl)cc1)C1CCC1)c1c([O-])cccc1F ZINC001136712736 1049842574 /nfs/dbraw/zinc/84/25/74/1049842574.db2.gz KYROAWNUKAQZIT-KRWDZBQOSA-N -1 1 333.790 4.456 20 0 EIADMM Cc1ccccc1[C@H](NC(=O)c1cncc([O-])c1)[C@@H]1CCC[C@@H](C)C1 ZINC001136731653 1049856379 /nfs/dbraw/zinc/85/63/79/1049856379.db2.gz DEWOABJJNXZISF-AKCHCHLHSA-N -1 1 338.451 4.393 20 0 EIADMM O=C(c1cccc([O-])c1F)N(CCc1ccc(Cl)cc1)CC1CC1 ZINC001136752284 1049864415 /nfs/dbraw/zinc/86/44/15/1049864415.db2.gz LNZCKQDYUZGOKS-UHFFFAOYSA-N -1 1 347.817 4.280 20 0 EIADMM O=c1oc2cc([O-])ccc2cc1Nc1ccc(C2CCOCC2)cc1 ZINC001212652243 1049880848 /nfs/dbraw/zinc/88/08/48/1049880848.db2.gz FAWWITHGMJMEGV-UHFFFAOYSA-N -1 1 337.375 4.136 20 0 EIADMM O=C(Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)c1cc2sccc2s1 ZINC000617014872 1049945569 /nfs/dbraw/zinc/94/55/69/1049945569.db2.gz UDDAYLWOHKACMH-UHFFFAOYSA-N -1 1 341.417 4.311 20 0 EIADMM Cc1cc(Cl)cc(C)c1[N-]S(=O)(=O)c1cccc(F)c1C ZINC001185836483 1050168699 /nfs/dbraw/zinc/16/86/99/1050168699.db2.gz NYKSVZMXUUPMMX-UHFFFAOYSA-N -1 1 327.808 4.205 20 0 EIADMM FC(F)(F)c1cnc(-c2nc(-c3cccc4c3CCCC4)no2)[n-]1 ZINC001212689389 1050228581 /nfs/dbraw/zinc/22/85/81/1050228581.db2.gz BRZATBUUVHSSNV-UHFFFAOYSA-N -1 1 334.301 4.024 20 0 EIADMM FC(F)(F)c1c[n-]c(-c2nc(-c3cccc4c3CCCC4)no2)n1 ZINC001212689389 1050228589 /nfs/dbraw/zinc/22/85/89/1050228589.db2.gz BRZATBUUVHSSNV-UHFFFAOYSA-N -1 1 334.301 4.024 20 0 EIADMM Cc1ccc(Cl)cc1-c1noc(-c2ncc(C(F)(F)F)[n-]2)n1 ZINC001212690095 1050228652 /nfs/dbraw/zinc/22/86/52/1050228652.db2.gz XVCRSFLESLAIKJ-UHFFFAOYSA-N -1 1 328.681 4.107 20 0 EIADMM Cc1ccc(Cl)cc1-c1noc(-c2nc(C(F)(F)F)c[n-]2)n1 ZINC001212690095 1050228656 /nfs/dbraw/zinc/22/86/56/1050228656.db2.gz XVCRSFLESLAIKJ-UHFFFAOYSA-N -1 1 328.681 4.107 20 0 EIADMM FC(F)(F)c1cnc(-c2nc(-c3cccc4ccccc43)no2)[n-]1 ZINC001212689442 1050229307 /nfs/dbraw/zinc/22/93/07/1050229307.db2.gz DYSDYQXLPPAPFW-UHFFFAOYSA-N -1 1 330.269 4.299 20 0 EIADMM FC(F)(F)c1c[n-]c(-c2nc(-c3cccc4ccccc43)no2)n1 ZINC001212689442 1050229319 /nfs/dbraw/zinc/22/93/19/1050229319.db2.gz DYSDYQXLPPAPFW-UHFFFAOYSA-N -1 1 330.269 4.299 20 0 EIADMM CCc1cc(Br)cc(NC(=O)c2ccc([O-])c(F)c2)c1 ZINC001186226935 1050265233 /nfs/dbraw/zinc/26/52/33/1050265233.db2.gz VEPHPMQEZAXNID-UHFFFAOYSA-N -1 1 338.176 4.109 20 0 EIADMM O=C(NCc1cscc1Cl)c1ccc(C(F)(F)F)c([O-])c1 ZINC001178014159 1050355582 /nfs/dbraw/zinc/35/55/82/1050355582.db2.gz YWSSEFVRHREYCC-UHFFFAOYSA-N -1 1 335.734 4.056 20 0 EIADMM CC(C)(Cc1ccncc1)C(=O)Nc1cccc(C(F)(F)F)c1[O-] ZINC001178253085 1050412693 /nfs/dbraw/zinc/41/26/93/1050412693.db2.gz KQQMHGQJJGCQLG-UHFFFAOYSA-N -1 1 338.329 4.013 20 0 EIADMM Cc1csc([N-]S(=O)(=O)Cc2cc(Cl)cc(Cl)c2)c1 ZINC001187044608 1050466259 /nfs/dbraw/zinc/46/62/59/1050466259.db2.gz WWDOBBVWOBVJJO-UHFFFAOYSA-N -1 1 336.265 4.305 20 0 EIADMM O=C(Nc1cccc(Br)c1)Nc1cccc([O-])c1Cl ZINC001187464183 1050545540 /nfs/dbraw/zinc/54/55/40/1050545540.db2.gz ORMVEWKZHYLSTP-UHFFFAOYSA-N -1 1 341.592 4.452 20 0 EIADMM CCOc1ccc(Nc2ccc(F)c(Br)c2[O-])cc1 ZINC001173854069 1050586338 /nfs/dbraw/zinc/58/63/38/1050586338.db2.gz PCQVYJBDHBHJSA-UHFFFAOYSA-N -1 1 326.165 4.436 20 0 EIADMM CCc1ccccc1NC(=O)Nc1cccc([O-])c1Br ZINC001187644027 1050586694 /nfs/dbraw/zinc/58/66/94/1050586694.db2.gz QPHUWMPIYKJCIY-UHFFFAOYSA-N -1 1 335.201 4.361 20 0 EIADMM COc1cc(Nc2ccc(Cl)c(Cl)c2[O-])cc(OC)c1OC ZINC001173907107 1050618878 /nfs/dbraw/zinc/61/88/78/1050618878.db2.gz AARSYDOOSQLSSE-UHFFFAOYSA-N -1 1 344.194 4.468 20 0 EIADMM O=C(Nc1cc(F)c([O-])cc1Cl)c1cc(-c2ccccc2)no1 ZINC001179656002 1050737235 /nfs/dbraw/zinc/73/72/35/1050737235.db2.gz MDMYDCWLNKHVGF-UHFFFAOYSA-N -1 1 332.718 4.092 20 0 EIADMM O=C(Nc1cc(F)c([O-])cc1Cl)c1cccc(N2CCCC2)c1 ZINC001179659516 1050740776 /nfs/dbraw/zinc/74/07/76/1050740776.db2.gz ALBILUVUFVPWMK-UHFFFAOYSA-N -1 1 334.778 4.037 20 0 EIADMM CCN(CC)C(=O)c1cccc(Nc2cc([O-])c(Cl)cc2F)c1 ZINC001174166719 1050810374 /nfs/dbraw/zinc/81/03/74/1050810374.db2.gz XZEUOWCSRKARRE-UHFFFAOYSA-N -1 1 336.794 4.410 20 0 EIADMM CCS[C@H]1CCCC[C@@H]1NC(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC000619582732 1050825371 /nfs/dbraw/zinc/82/53/71/1050825371.db2.gz HXGAAWOXAZRUCV-JSGCOSHPSA-N -1 1 347.402 4.205 20 0 EIADMM [O-]c1c(Br)ccc(Cl)c1Nc1cnc2[nH]ccc2c1 ZINC001174401402 1050920165 /nfs/dbraw/zinc/92/01/65/1050920165.db2.gz ZMHFIBPEIMRASI-UHFFFAOYSA-N -1 1 338.592 4.380 20 0 EIADMM CCc1cc(=O)[n-]c(SCc2ccc3ccc(Cl)cc3n2)n1 ZINC001189175100 1050928974 /nfs/dbraw/zinc/92/89/74/1050928974.db2.gz YUGYPDALGAIMKH-UHFFFAOYSA-N -1 1 331.828 4.239 20 0 EIADMM COc1cc([N-]S(=O)(=O)c2ccc(F)c3ccccc32)ccc1C ZINC001189385668 1050975277 /nfs/dbraw/zinc/97/52/77/1050975277.db2.gz NMPHBNWDVWTIFR-UHFFFAOYSA-N -1 1 345.395 4.097 20 0 EIADMM Cc1cnc(SCc2ccc(Br)c(Cl)c2)[n-]c1=O ZINC001189399847 1050984209 /nfs/dbraw/zinc/98/42/09/1050984209.db2.gz ZJGCTAVAQSSNPM-UHFFFAOYSA-N -1 1 345.649 4.199 20 0 EIADMM C[C@H]1CCCC[C@@H]1CC(=O)N1CCC(C(=O)c2ccc([O-])cc2)CC1 ZINC000620170552 1051046389 /nfs/dbraw/zinc/04/63/89/1051046389.db2.gz MSZUOUIJTXHJQP-MAUKXSAKSA-N -1 1 343.467 4.030 20 0 EIADMM CNc1ccc(Nc2c([O-])c(Br)ccc2Cl)c(F)n1 ZINC001203363478 1051050991 /nfs/dbraw/zinc/05/09/91/1051050991.db2.gz SNIPQELVJCATJJ-UHFFFAOYSA-N -1 1 346.587 4.128 20 0 EIADMM CCc1cccc(C)c1NC(=O)Nc1cc2ccc([O-])cc2oc1=O ZINC001189949055 1051087958 /nfs/dbraw/zinc/08/79/58/1051087958.db2.gz AEJUMNCKFXTJEQ-UHFFFAOYSA-N -1 1 338.363 4.013 20 0 EIADMM Cc1ccccc1-c1cccc(C(=O)Nc2n[n-]c(C(F)(F)F)n2)c1 ZINC001190281053 1051149281 /nfs/dbraw/zinc/14/92/81/1051149281.db2.gz NPIHYCBYWVDUSP-UHFFFAOYSA-N -1 1 346.312 4.051 20 0 EIADMM CCC(CC)(C(=O)Nc1cc(=O)n(-c2ccccc2)[n-]1)c1ccccc1 ZINC001181134413 1051162237 /nfs/dbraw/zinc/16/22/37/1051162237.db2.gz HGEVDUWUOJZPEU-UHFFFAOYSA-N -1 1 349.434 4.274 20 0 EIADMM Cc1nc(-c2ccccc2)ncc1C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000163205403 1051177469 /nfs/dbraw/zinc/17/74/69/1051177469.db2.gz PHSQHSRNCPLVRT-UHFFFAOYSA-N -1 1 339.782 4.063 20 0 EIADMM CCC(C)(C)c1ccc(S(=O)(=O)[N-]c2nc(C)ccc2F)cc1 ZINC001190432142 1051183542 /nfs/dbraw/zinc/18/35/42/1051183542.db2.gz PHGDILAZQMTEJV-UHFFFAOYSA-N -1 1 336.432 4.018 20 0 EIADMM Cc1ccc(Nc2c(Cl)ccc(Br)c2[O-])cc1N ZINC001174937871 1051260392 /nfs/dbraw/zinc/26/03/92/1051260392.db2.gz HMDUCDNKCJWLBA-UHFFFAOYSA-N -1 1 327.609 4.442 20 0 EIADMM O=S(=O)([N-]c1ccc(Sc2ccccc2)cc1)c1ccncc1 ZINC001190886981 1051297999 /nfs/dbraw/zinc/29/79/99/1051297999.db2.gz ICHUQOFYCXGEBH-UHFFFAOYSA-N -1 1 342.445 4.034 20 0 EIADMM CC1(C[N-]S(=O)(=O)c2cc(Cl)sc2Cl)CCCCC1 ZINC001190937249 1051306603 /nfs/dbraw/zinc/30/66/03/1051306603.db2.gz DUKICOMQQJCYEO-UHFFFAOYSA-N -1 1 342.313 4.304 20 0 EIADMM COc1cc(C(=O)NC/C=C(\C)CCC=C(C)C)cc(Cl)c1[O-] ZINC001191155835 1051366694 /nfs/dbraw/zinc/36/66/94/1051366694.db2.gz NUPVJOKRPDRUCB-MDWZMJQESA-N -1 1 337.847 4.477 20 0 EIADMM CC[C@@H](C)C1CCC(NC(=O)c2cc(Cl)c([O-])c(OC)c2)CC1 ZINC001191157758 1051369348 /nfs/dbraw/zinc/36/93/48/1051369348.db2.gz CHTBZISGFGLLFG-LKSINWNRSA-N -1 1 339.863 4.389 20 0 EIADMM CC(C)Oc1cc(F)cc(Nc2cc3ccc([O-])cc3oc2=O)c1 ZINC001175140499 1051408823 /nfs/dbraw/zinc/40/88/23/1051408823.db2.gz LEUVAYZEDLHCGJ-UHFFFAOYSA-N -1 1 329.327 4.169 20 0 EIADMM Cc1cc(C)cc(-c2nnc([N-]C(=O)c3cc(C(C)C)on3)s2)c1 ZINC000157781165 1051672003 /nfs/dbraw/zinc/67/20/03/1051672003.db2.gz AUDUZNIEASQWKB-UHFFFAOYSA-N -1 1 342.424 4.186 20 0 EIADMM O=C([N-]c1cc2ccccc2s1)c1nc(Cc2ccccc2)no1 ZINC001192262815 1051675930 /nfs/dbraw/zinc/67/59/30/1051675930.db2.gz RIDHJICMVAEPDO-UHFFFAOYSA-N -1 1 335.388 4.127 20 0 EIADMM CC(C)Sc1ccc(Nc2cc(S(C)(=O)=O)ccc2[O-])cc1 ZINC001175626562 1051682077 /nfs/dbraw/zinc/68/20/77/1051682077.db2.gz ORYFKVPRYOCBGR-UHFFFAOYSA-N -1 1 337.466 4.040 20 0 EIADMM Cc1c(NC(=O)c2ccc(C(C)(C)C)cc2[O-])ccc2c1OCCO2 ZINC001192335748 1051694965 /nfs/dbraw/zinc/69/49/65/1051694965.db2.gz NJALKJTXDPTHQX-UHFFFAOYSA-N -1 1 341.407 4.022 20 0 EIADMM Cc1ccc(CNC(=O)c2c(F)ccc([O-])c2F)c2ccccc12 ZINC001192552835 1051755137 /nfs/dbraw/zinc/75/51/37/1051755137.db2.gz UDELTZGBJIJPRZ-UHFFFAOYSA-N -1 1 327.330 4.062 20 0 EIADMM CC[C@H](CCc1ccccc1)[N-]S(=O)(=O)c1cc2ccccc2o1 ZINC001192551009 1051755678 /nfs/dbraw/zinc/75/56/78/1051755678.db2.gz AALRVGIKKKBDFJ-QGZVFWFLSA-N -1 1 343.448 4.123 20 0 EIADMM O=C(Nc1c(Cl)ccc2ncccc21)c1c(F)ccc([O-])c1F ZINC001192541519 1051765089 /nfs/dbraw/zinc/76/50/89/1051765089.db2.gz XPFYWZUUQUXGCM-UHFFFAOYSA-N -1 1 334.709 4.124 20 0 EIADMM Cc1ccc(C)c([C@@H](C)NC(=O)c2ccc(Br)c([O-])c2)c1 ZINC001183102671 1051790092 /nfs/dbraw/zinc/79/00/92/1051790092.db2.gz RGHVEEJYANXYDZ-GFCCVEGCSA-N -1 1 348.240 4.263 20 0 EIADMM CCN(CC)c1ccc(NC(=O)c2cc([O-])cc(F)c2F)c(C)c1 ZINC001192664494 1051797704 /nfs/dbraw/zinc/79/77/04/1051797704.db2.gz ACWOCWJNBBJMDW-UHFFFAOYSA-N -1 1 334.366 4.077 20 0 EIADMM O=C(N[C@H](c1cccc(Cl)c1)C(F)F)c1cc(Cl)ccc1[O-] ZINC001175805097 1051803057 /nfs/dbraw/zinc/80/30/57/1051803057.db2.gz HXYBISXWRXJZGJ-CYBMUJFWSA-N -1 1 346.160 4.435 20 0 EIADMM [O-]c1cc(Nc2cccnc2OCc2ccccc2)cc(F)c1F ZINC001175876674 1051808185 /nfs/dbraw/zinc/80/81/85/1051808185.db2.gz CMAAPOXOMHHSEM-UHFFFAOYSA-N -1 1 328.318 4.388 20 0 EIADMM CC1(C)CCC[C@@H]1CC[N-]S(=O)(=O)c1cc2cc(F)ccc2o1 ZINC001192855643 1051825439 /nfs/dbraw/zinc/82/54/39/1051825439.db2.gz BDEPWLYRAPEDMC-CYBMUJFWSA-N -1 1 339.432 4.067 20 0 EIADMM O=C(Nc1ccc([C@H](F)C(F)(F)F)cc1)c1cccc([O-])c1F ZINC001175871680 1051829006 /nfs/dbraw/zinc/82/90/06/1051829006.db2.gz KHEURGJXGDDATK-ZDUSSCGKSA-N -1 1 331.240 4.357 20 0 EIADMM O=C(Nc1ccc([C@@H](F)C(F)(F)F)cc1)c1cc(F)ccc1[O-] ZINC001175873948 1051830665 /nfs/dbraw/zinc/83/06/65/1051830665.db2.gz SEZGEYCNSGOCLL-CYBMUJFWSA-N -1 1 331.240 4.357 20 0 EIADMM C[C@@H](SCCC[N-]C(=O)C(F)(F)F)c1cccc(Cl)c1 ZINC000774674574 1051891313 /nfs/dbraw/zinc/89/13/13/1051891313.db2.gz IKUCDLVZTLVMEP-SECBINFHSA-N -1 1 325.783 4.203 20 0 EIADMM [O-]c1ccc(-c2nc(-c3cc(C(F)(F)F)ccc3Cl)no2)nn1 ZINC001205293691 1051978995 /nfs/dbraw/zinc/97/89/95/1051978995.db2.gz GRBYAUYOVAYEKX-UHFFFAOYSA-N -1 1 342.664 4.132 20 0 EIADMM COc1cc([N-]S(=O)(=O)c2ccc(C)c3ccccc32)ccc1C ZINC001193856222 1052015723 /nfs/dbraw/zinc/01/57/23/1052015723.db2.gz BAKLSZIKHHUUKC-UHFFFAOYSA-N -1 1 341.432 4.266 20 0 EIADMM O=C([O-])CCC1CCN(Cc2coc(-c3cccc(Cl)c3)n2)CC1 ZINC000324256620 1052033302 /nfs/dbraw/zinc/03/33/02/1052033302.db2.gz FWPIWMLPWYHIKU-UHFFFAOYSA-N -1 1 348.830 4.072 20 0 EIADMM CC[C@@H](OC(=O)c1ccc([O-])cc1F)C(=O)c1ccc(Cl)cc1 ZINC000773575277 1052038626 /nfs/dbraw/zinc/03/86/26/1052038626.db2.gz XIFOAFULEDXCPD-OAHLLOKOSA-N -1 1 336.746 4.003 20 0 EIADMM [O-]c1c(F)cc(F)c(Nc2cc(F)ccc2OCC(F)F)c1F ZINC001176670673 1052157187 /nfs/dbraw/zinc/15/71/87/1052157187.db2.gz KIERJJLJKGAWEZ-UHFFFAOYSA-N -1 1 337.219 4.336 20 0 EIADMM CCOC(=O)c1cc(Cl)cc(Nc2c(F)cc(F)c([O-])c2F)c1 ZINC001176670590 1052157396 /nfs/dbraw/zinc/15/73/96/1052157396.db2.gz HIOQRVRUDJFLML-UHFFFAOYSA-N -1 1 345.704 4.383 20 0 EIADMM Cc1cc(Nc2c(F)cc(F)c([O-])c2F)n(-c2ccc(F)cc2)n1 ZINC001176664036 1052157627 /nfs/dbraw/zinc/15/76/27/1052157627.db2.gz RRFQVEVPFZSNBF-UHFFFAOYSA-N -1 1 337.276 4.186 20 0 EIADMM [O-]c1c(F)cc(F)c(Nc2cccc(O)c2Br)c1F ZINC001176672974 1052159550 /nfs/dbraw/zinc/15/95/50/1052159550.db2.gz CERQFIQILADDMB-UHFFFAOYSA-N -1 1 334.091 4.021 20 0 EIADMM CC(C)OC(=O)c1ccc(Nc2c(F)cc(F)c([O-])c2F)cc1 ZINC001176671804 1052159661 /nfs/dbraw/zinc/15/96/61/1052159661.db2.gz PNHZZDRBNKERLY-UHFFFAOYSA-N -1 1 325.286 4.118 20 0 EIADMM CCc1cccc([N-]S(=O)(=O)c2cccc3c(Cl)nccc32)c1 ZINC001194490474 1052159894 /nfs/dbraw/zinc/15/98/94/1052159894.db2.gz MDVROUCFPWMLSW-UHFFFAOYSA-N -1 1 346.839 4.251 20 0 EIADMM [O-]c1c(F)cc(F)c(Nc2ccccc2OCC(F)(F)F)c1F ZINC001176671057 1052160106 /nfs/dbraw/zinc/16/01/06/1052160106.db2.gz RVBQIHADNCPYDC-UHFFFAOYSA-N -1 1 337.219 4.494 20 0 EIADMM COc1c(N)cc(C(C)(C)C)cc1Nc1c(F)cc(F)c([O-])c1F ZINC001176673773 1052161428 /nfs/dbraw/zinc/16/14/28/1052161428.db2.gz LBFBTPRTQMNAIO-UHFFFAOYSA-N -1 1 340.345 4.441 20 0 EIADMM [O-]c1c(F)cc(F)c(Nc2cn3cc(C(F)(F)F)ccc3n2)c1F ZINC001176663374 1052172411 /nfs/dbraw/zinc/17/24/11/1052172411.db2.gz HNICDOQUWIOPAJ-UHFFFAOYSA-N -1 1 347.218 4.220 20 0 EIADMM [O-]c1c(F)cc(F)c(Nc2cnc3cc(F)c(F)cc3c2)c1F ZINC001176662866 1052173040 /nfs/dbraw/zinc/17/30/40/1052173040.db2.gz BGFLJUKYFFAWSC-UHFFFAOYSA-N -1 1 326.224 4.380 20 0 EIADMM O=C(Nc1ccc(Cl)cc1[O-])Oc1ccc(Br)cc1 ZINC001194598577 1052175138 /nfs/dbraw/zinc/17/51/38/1052175138.db2.gz AXBXFAHDZFLLBE-UHFFFAOYSA-N -1 1 342.576 4.419 20 0 EIADMM CC(C)c1ccc(CN(C(=O)c2cc(F)ccc2[O-])C2CC2)cc1 ZINC000622284996 1052180357 /nfs/dbraw/zinc/18/03/57/1052180357.db2.gz XTYSGZIZMLXCNN-UHFFFAOYSA-N -1 1 327.399 4.460 20 0 EIADMM CCCc1nc2ccc([N-]S(=O)(=O)c3c(C)cccc3C)cc2o1 ZINC001194634369 1052182230 /nfs/dbraw/zinc/18/22/30/1052182230.db2.gz QXMJDUDSLSLKHK-UHFFFAOYSA-N -1 1 344.436 4.198 20 0 EIADMM CCCOc1ccc(CCC(=O)NCc2ccc([O-])c(Cl)c2)cc1 ZINC001176988568 1052213445 /nfs/dbraw/zinc/21/34/45/1052213445.db2.gz OKJMDSGDOIKXTH-UHFFFAOYSA-N -1 1 347.842 4.083 20 0 EIADMM O=C(NCc1ccc([O-])c(Cl)c1)c1cccc(OC2CCCC2)c1 ZINC001176987963 1052214738 /nfs/dbraw/zinc/21/47/38/1052214738.db2.gz FOBYUIZZCBRZPT-UHFFFAOYSA-N -1 1 345.826 4.297 20 0 EIADMM CCCN(CCC)c1ccc([N-]S(=O)(=O)c2ccsc2)cc1 ZINC001185384090 1052226428 /nfs/dbraw/zinc/22/64/28/1052226428.db2.gz OHZVDDUDGRVESW-UHFFFAOYSA-N -1 1 338.498 4.175 20 0 EIADMM C[C@H](Cc1cccc(C(F)(F)F)c1)C(=O)[N-]Oc1ccccc1F ZINC001177109603 1052232583 /nfs/dbraw/zinc/23/25/83/1052232583.db2.gz LFGBUZDXILRHET-LLVKDONJSA-N -1 1 341.304 4.133 20 0 EIADMM CSc1ccc([N-]S(=O)(=O)c2ccc(Cl)c(C)c2)cc1 ZINC001185521545 1052256573 /nfs/dbraw/zinc/25/65/73/1052256573.db2.gz WCPVQKHHEZIDHQ-UHFFFAOYSA-N -1 1 327.858 4.171 20 0 EIADMM CC(C)N(C(=O)c1ccc(C(F)(F)F)cc1[O-])C1CC(C)(C)C1 ZINC000622675408 1052384596 /nfs/dbraw/zinc/38/45/96/1052384596.db2.gz JKHBYEJIPKYMMO-UHFFFAOYSA-N -1 1 329.362 4.450 20 0 EIADMM Cc1cc(F)c(F)cc1[N-]S(=O)(=O)c1cccc(C(C)C)c1 ZINC001195156052 1053305294 /nfs/dbraw/zinc/30/52/94/1053305294.db2.gz FBTGPFJDVNXNEH-UHFFFAOYSA-N -1 1 325.380 4.197 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2cccc(C(C)C)c2)c2cccnc12 ZINC001195154266 1053305802 /nfs/dbraw/zinc/30/58/02/1053305802.db2.gz WJHKFLGHZRBEMV-UHFFFAOYSA-N -1 1 340.448 4.467 20 0 EIADMM CC(C)c1cccc(S(=O)(=O)[N-]c2cccc3cc(O)ccc32)c1 ZINC001195159634 1053309422 /nfs/dbraw/zinc/30/94/22/1053309422.db2.gz RYLVAWJZEZTDSD-UHFFFAOYSA-N -1 1 341.432 4.470 20 0 EIADMM CC(C)(C)Sc1ccccc1[N-]S(=O)(=O)c1ccc(O)cc1 ZINC001195805234 1053492511 /nfs/dbraw/zinc/49/25/11/1053492511.db2.gz BQMDIRABACCDBZ-UHFFFAOYSA-N -1 1 337.466 4.084 20 0 EIADMM O=S(=O)([N-]c1ccc(C2CC2)c2ccccc12)c1ccc(O)cc1 ZINC001195805293 1053493039 /nfs/dbraw/zinc/49/30/39/1053493039.db2.gz FOZFMTWHUOFUMV-UHFFFAOYSA-N -1 1 339.416 4.224 20 0 EIADMM C[C@H]([N-]C(=O)C(F)(F)c1ccccc1F)c1ccc(F)cc1F ZINC000765546166 1053664396 /nfs/dbraw/zinc/66/43/96/1053664396.db2.gz WHBGQWVYZLZGEA-VIFPVBQESA-N -1 1 329.268 4.073 20 0 EIADMM COc1cc(C(=O)Nc2ccc([O-])c(Cl)c2)ccc1OCC(C)C ZINC000111665900 1053719909 /nfs/dbraw/zinc/71/99/09/1053719909.db2.gz QFWAXYCVSJOVEX-UHFFFAOYSA-N -1 1 349.814 4.341 20 0 EIADMM CSc1ccc([O-])c(-c2nc(C[C@@]3(C)CC3(Cl)Cl)no2)c1 ZINC000854063020 1053748481 /nfs/dbraw/zinc/74/84/81/1053748481.db2.gz IVWNIGTUTCBDDN-ZDUSSCGKSA-N -1 1 345.251 4.291 20 0 EIADMM CCC(CC)n1nc(C)cc1C(=O)Nc1cc(F)c([O-])cc1Cl ZINC000885676930 1053800500 /nfs/dbraw/zinc/80/05/00/1053800500.db2.gz XIPPJCOXAUFWOJ-UHFFFAOYSA-N -1 1 339.798 4.303 20 0 EIADMM CCCc1nc(C)c([N-]S(=O)(=O)/C=C/c2ccc(C)cc2)s1 ZINC000776742207 1053815902 /nfs/dbraw/zinc/81/59/02/1053815902.db2.gz SKYYRTGZIYEFLI-ZHACJKMWSA-N -1 1 336.482 4.125 20 0 EIADMM CCCCc1oc2ccccc2c1C=CC(=O)Nc1c(C)[n-][nH]c1=O ZINC000854634978 1053833273 /nfs/dbraw/zinc/83/32/73/1053833273.db2.gz KTTMTCBNRODVHZ-ZHACJKMWSA-N -1 1 339.395 4.164 20 0 EIADMM COc1ccc(OC(C)C)c(NC(=O)Cc2ccc([O-])c(Cl)c2)c1 ZINC000630946340 1053844087 /nfs/dbraw/zinc/84/40/87/1053844087.db2.gz STELPYNTLWQVIS-UHFFFAOYSA-N -1 1 349.814 4.023 20 0 EIADMM CCOC1CC2(C[C@@H]2C(=O)Nc2cc(Cl)c([O-])c3ccccc23)C1 ZINC000869376672 1053994280 /nfs/dbraw/zinc/99/42/80/1053994280.db2.gz XGYZYGQMQMVNLP-OTBSTLSISA-N -1 1 345.826 4.343 20 0 EIADMM Cc1cccc(-c2nnc([C@@H](C)Sc3nc(C)c(C)c(=O)[n-]3)o2)c1 ZINC000776869093 1054015046 /nfs/dbraw/zinc/01/50/46/1054015046.db2.gz ZEMTUAAKAVVHKD-GFCCVEGCSA-N -1 1 342.424 4.011 20 0 EIADMM CCS[C@@H]1CCC[C@H](NC(=O)c2ccc3ccccc3c2[O-])C1 ZINC001149045329 1054172795 /nfs/dbraw/zinc/17/27/95/1054172795.db2.gz SYRQOAAZQVAGEP-LSDHHAIUSA-N -1 1 329.465 4.340 20 0 EIADMM Cc1nc2cc([N-]S(=O)(=O)c3ccc4occc4c3)ccc2s1 ZINC001198816142 1054272025 /nfs/dbraw/zinc/27/20/25/1054272025.db2.gz FFUIIBBNVHMAMK-UHFFFAOYSA-N -1 1 344.417 4.152 20 0 EIADMM C[C@@H](C(=O)[N-]OCc1ccc(F)cc1)c1ccc(Cl)c(Cl)c1 ZINC000857484611 1054274597 /nfs/dbraw/zinc/27/45/97/1054274597.db2.gz JBCZBZKRUQTMTR-SNVBAGLBSA-N -1 1 342.197 4.484 20 0 EIADMM CCc1cc(Cl)ccc1[N-]S(=O)(=O)c1ccc2occc2c1 ZINC001198858783 1054283608 /nfs/dbraw/zinc/28/36/08/1054283608.db2.gz JPHJJXDBKFROQA-UHFFFAOYSA-N -1 1 335.812 4.449 20 0 EIADMM O=S(=O)([N-]c1ccc(-c2ccco2)cc1)c1ccc2occc2c1 ZINC001198862410 1054288399 /nfs/dbraw/zinc/28/83/99/1054288399.db2.gz TYDOSYFJASQNNA-UHFFFAOYSA-N -1 1 339.372 4.494 20 0 EIADMM CCOc1cc(-c2noc(C3(C)CC(F)(F)C3)n2)cc(Cl)c1[O-] ZINC000871842710 1054297529 /nfs/dbraw/zinc/29/75/29/1054297529.db2.gz RCNKZNGGLOFLMU-UHFFFAOYSA-N -1 1 344.745 4.181 20 0 EIADMM CCCCCC(=O)Nc1cccc(S(=O)(=O)[N-]c2ccccc2)c1 ZINC000046588627 1054386619 /nfs/dbraw/zinc/38/66/19/1054386619.db2.gz XIORZYQAMLNKHI-UHFFFAOYSA-N -1 1 346.452 4.006 20 0 EIADMM Cc1c(Cl)onc1C(=O)[N-]c1cc(-c2ccc(Cl)s2)on1 ZINC001199670191 1054441185 /nfs/dbraw/zinc/44/11/85/1054441185.db2.gz AYYHGLAMJOTJCR-UHFFFAOYSA-N -1 1 344.179 4.259 20 0 EIADMM COc1ccc(C2CC2)c([N-]S(=O)(=O)c2ccc(SC)cc2)c1 ZINC000872412996 1054442592 /nfs/dbraw/zinc/44/25/92/1054442592.db2.gz BSVOHJLDTQYUNV-UHFFFAOYSA-N -1 1 349.477 4.095 20 0 EIADMM O=S(=O)([N-]c1ccccc1F)c1cc(Cl)c(Cl)cc1F ZINC001201243839 1054726871 /nfs/dbraw/zinc/72/68/71/1054726871.db2.gz ALTLOWZHRNOBNB-UHFFFAOYSA-N -1 1 338.162 4.072 20 0 EIADMM CN(C)C(=O)c1cc(F)cc(Nc2ccc(Cl)c(Cl)c2[O-])c1 ZINC001201533682 1054845291 /nfs/dbraw/zinc/84/52/91/1054845291.db2.gz DDBXNPNDORCFFA-UHFFFAOYSA-N -1 1 343.185 4.284 20 0 EIADMM O=C(CSc1ccc(Cl)cc1)Nc1ccc([O-])c(Cl)c1 ZINC000109013485 1054871335 /nfs/dbraw/zinc/87/13/35/1054871335.db2.gz IOULRCULDUBNEZ-UHFFFAOYSA-N -1 1 328.220 4.430 20 0 EIADMM O=C(NCc1cccc(Cl)c1F)c1ccc2ccccc2c1[O-] ZINC001137052144 1054907070 /nfs/dbraw/zinc/90/70/70/1054907070.db2.gz PLOFCEQCPVOYPL-UHFFFAOYSA-N -1 1 329.758 4.268 20 0 EIADMM O=C(Nc1ccc(F)cc1F)Nc1cccc([O-])c1Br ZINC001202022509 1054981834 /nfs/dbraw/zinc/98/18/34/1054981834.db2.gz QLTGLNDWQMECLC-UHFFFAOYSA-N -1 1 343.127 4.077 20 0 EIADMM CC(C)(C)c1nsc([N-]C(=O)c2cc(Cl)sc2Cl)n1 ZINC000068073705 1055067157 /nfs/dbraw/zinc/06/71/57/1055067157.db2.gz PWIRRTSUSHKYPK-UHFFFAOYSA-N -1 1 336.269 4.456 20 0 EIADMM CC[C@H](C)c1cccc(NC(=O)c2c(C)nc(C(C)C)[n-]c2=O)c1 ZINC000862485708 1055074260 /nfs/dbraw/zinc/07/42/60/1055074260.db2.gz COXVHFPUAZTYCG-LBPRGKRZSA-N -1 1 327.428 4.380 20 0 EIADMM CCC1=NO[C@@H](c2nc(=O)c3c(C[C@H](C)CC)c(C)sc3[n-]2)C1 ZINC000126617494 1055092510 /nfs/dbraw/zinc/09/25/10/1055092510.db2.gz VNMLZFUBNHKQOD-NOZJJQNGSA-N -1 1 333.457 4.109 20 0 EIADMM CC(C)c1csc2[n-]c([C@H]3COc4ccccc4O3)nc(=O)c12 ZINC000429552567 1055130556 /nfs/dbraw/zinc/13/05/56/1055130556.db2.gz YJPWFKXRIIZVQM-CYBMUJFWSA-N -1 1 328.393 4.033 20 0 EIADMM O=C1N[C@H](c2cccc([O-])c2Cl)Nc2c3ccccc3sc21 ZINC000877855696 1055139536 /nfs/dbraw/zinc/13/95/36/1055139536.db2.gz TUABVKLPNQPRCX-OAHLLOKOSA-N -1 1 330.796 4.114 20 0 EIADMM O=C(Nc1ccc(Br)cc1)Nc1cccc([O-])c1Cl ZINC001202333210 1055142968 /nfs/dbraw/zinc/14/29/68/1055142968.db2.gz PQVLMDFNOOPKDF-UHFFFAOYSA-N -1 1 341.592 4.452 20 0 EIADMM O=C(Nc1ccc(Br)cc1)Nc1cc(F)c([O-])cc1F ZINC001202335414 1055144315 /nfs/dbraw/zinc/14/43/15/1055144315.db2.gz AQARIELGHTVQCI-UHFFFAOYSA-N -1 1 343.127 4.077 20 0 EIADMM CC[C@H]1CCC[C@]1(C)C(=O)N1CCC(C(=O)c2ccc([O-])cc2)CC1 ZINC000878046100 1055178588 /nfs/dbraw/zinc/17/85/88/1055178588.db2.gz QTHQIHQZPFNCTN-UWJYYQICSA-N -1 1 343.467 4.030 20 0 EIADMM Oc1ccccc1-c1nnc(C[N@H+]2CCCCC[C@@H]2c2ccco2)o1 ZINC000878116608 1055189366 /nfs/dbraw/zinc/18/93/66/1055189366.db2.gz JXGLMXVAOVJGGI-OAHLLOKOSA-N -1 1 339.395 4.153 20 0 EIADMM Oc1ccccc1-c1nnc(C[NH2+][C@H](CC2CCC2)c2ccccc2)o1 ZINC000878383180 1055283300 /nfs/dbraw/zinc/28/33/00/1055283300.db2.gz KIRPGEDVYZLDQQ-GOSISDBHSA-N -1 1 349.434 4.463 20 0 EIADMM CCCn1cc(N[C@@H](C)c2cc(Br)cc(F)c2[O-])cn1 ZINC000186339947 1055369631 /nfs/dbraw/zinc/36/96/31/1055369631.db2.gz AGGFYGNNFREBKA-VIFPVBQESA-N -1 1 342.212 4.073 20 0 EIADMM O=C([N-]c1nnc(-c2ccsc2)s1)c1conc1C1CCCC1 ZINC000878709037 1055378529 /nfs/dbraw/zinc/37/85/29/1055378529.db2.gz DLOOQAQDMVCFJD-UHFFFAOYSA-N -1 1 346.437 4.165 20 0 EIADMM Cc1nc(C(C)(C)C)[n-]c(=O)c1C(=O)Nc1csc2ccccc12 ZINC000542773612 1055979193 /nfs/dbraw/zinc/97/91/93/1055979193.db2.gz FCODHFYWDJUIHT-UHFFFAOYSA-N -1 1 341.436 4.255 20 0 EIADMM CCCCCCN(C)CC(=O)Nc1cc(Cl)c([O-])c(Cl)c1 ZINC000765863403 1056023994 /nfs/dbraw/zinc/02/39/94/1056023994.db2.gz PJYUSFRGVWXOLW-UHFFFAOYSA-N -1 1 333.259 4.150 20 0 EIADMM COc1cc(Nc2cc(F)c([O-])c(Cl)c2)cnc1Br ZINC001214483018 1056783591 /nfs/dbraw/zinc/78/35/91/1056783591.db2.gz YWXUTIOOWYTKTE-UHFFFAOYSA-N -1 1 347.571 4.094 20 0 EIADMM Cc1cc(F)ccc1[N-]S(=O)(=O)c1cc(Cl)cc(Cl)c1 ZINC000007381979 1056791131 /nfs/dbraw/zinc/79/11/31/1056791131.db2.gz CIWGVBUQRMVOLY-UHFFFAOYSA-N -1 1 334.199 4.242 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2cc(Cl)ccc2Cl)c(F)c1 ZINC000007428121 1056794926 /nfs/dbraw/zinc/79/49/26/1056794926.db2.gz WBPBXLLLPXURHQ-UHFFFAOYSA-N -1 1 334.199 4.242 20 0 EIADMM O=C(NCCc1c[nH]c2ccc(Cl)cc12)c1c([O-])cccc1Cl ZINC000743720056 1059095166 /nfs/dbraw/zinc/09/51/66/1059095166.db2.gz LNYCQLYTPCAJTJ-UHFFFAOYSA-N -1 1 349.217 4.153 20 0 EIADMM CC(=O)c1ccc([O-])c(CCOC(=O)CC(C)(C)c2ccccc2)c1 ZINC000744874190 1059663453 /nfs/dbraw/zinc/66/34/53/1059663453.db2.gz CMIDWMABHPLFTM-UHFFFAOYSA-N -1 1 340.419 4.048 20 0 EIADMM Cc1nc(C)c(COC(=O)c2ccc(Cl)c(Cl)c2[O-])s1 ZINC000744978833 1059684688 /nfs/dbraw/zinc/68/46/88/1059684688.db2.gz SRPRJGKBEWHLDH-UHFFFAOYSA-N -1 1 332.208 4.129 20 0 EIADMM CC[C@@H](CC1CCCC1)C(=O)OCCc1cc(C(C)=O)ccc1[O-] ZINC000745040838 1059708558 /nfs/dbraw/zinc/70/85/58/1059708558.db2.gz XAYIFALVHXGXRJ-INIZCTEOSA-N -1 1 332.440 4.287 20 0 EIADMM CC(=O)c1ccc([O-])c(CCOC(=O)[C@@H](c2ccccc2)C(C)C)c1 ZINC000745551186 1059845461 /nfs/dbraw/zinc/84/54/61/1059845461.db2.gz KFQVPECMQFARMY-HXUWFJFHSA-N -1 1 340.419 4.120 20 0 EIADMM O=C(Nc1ccc(Oc2cc(F)cc(F)c2)nc1)c1ccccc1[O-] ZINC001169200021 1060683291 /nfs/dbraw/zinc/68/32/91/1060683291.db2.gz VTVFVZBPBJFVEC-UHFFFAOYSA-N -1 1 342.301 4.110 20 0 EIADMM O=C(c1c([O-])cccc1Cl)N1C[C@H](c2ccccc2)[C@@H]2CCC[C@@H]21 ZINC000804347610 1061135422 /nfs/dbraw/zinc/13/54/22/1061135422.db2.gz IBJLWCKHRYCJNJ-UXLLHSPISA-N -1 1 341.838 4.454 20 0 EIADMM Cc1ccc(Cl)cc1NC(=O)c1cc(Br)ccc1[O-] ZINC000048544545 213944264 /nfs/dbraw/zinc/94/42/64/213944264.db2.gz WGDZAKXFDYBJNY-UHFFFAOYSA-N -1 1 340.604 4.369 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2ccc(OC(C)C)cc2C)c(C)s1 ZINC000614863577 1032102365 /nfs/dbraw/zinc/10/23/65/1032102365.db2.gz DAODNFROCOCROE-UHFFFAOYSA-N -1 1 339.482 4.261 20 0 EIADMM COc1ccc(Br)cc1NCc1cccc([O-])c1Cl ZINC000380850215 1053044723 /nfs/dbraw/zinc/04/47/23/1053044723.db2.gz SIOYHWZUCJMHDR-UHFFFAOYSA-N -1 1 342.620 4.429 20 0 EIADMM CSc1ccc(Cl)cc1[N-]C(=O)c1cc(-c2cccnc2)on1 ZINC000064848184 1032159350 /nfs/dbraw/zinc/15/93/50/1032159350.db2.gz DJGQSZBQFSZRKT-UHFFFAOYSA-N -1 1 345.811 4.364 20 0 EIADMM O=C(CCC1CCOCC1)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000529539777 1032431213 /nfs/dbraw/zinc/43/12/13/1032431213.db2.gz UEPOVGDQKBPQKR-UHFFFAOYSA-N -1 1 333.815 4.344 20 0 EIADMM CCOc1cc(C(=O)N2CCC(C(C)(C)C)CC2)cc(Cl)c1[O-] ZINC000530467789 1019023377 /nfs/dbraw/zinc/02/33/77/1019023377.db2.gz WSESBCHOYVJDAT-UHFFFAOYSA-N -1 1 339.863 4.343 20 0 EIADMM Cc1noc(C)c1C[N-]C(=O)C(F)(F)c1cccc(Cl)c1Cl ZINC000843537525 1019059526 /nfs/dbraw/zinc/05/95/26/1019059526.db2.gz WQLZFPPLIOPQQV-UHFFFAOYSA-N -1 1 349.164 4.006 20 0 EIADMM CCCCOc1ccc(F)c([N-]c2ncco2)c1Br ZINC001211492383 1019093578 /nfs/dbraw/zinc/09/35/78/1019093578.db2.gz URBOCRWKUUGJSD-UHFFFAOYSA-N -1 1 329.169 4.499 20 0 EIADMM O=S(=O)([N-]c1ccc(-c2cc[nH]n2)cc1)c1ccc2ccccc2c1 ZINC000045095912 1019363462 /nfs/dbraw/zinc/36/34/62/1019363462.db2.gz YSZWNPBGXMXPNO-UHFFFAOYSA-N -1 1 349.415 4.031 20 0 EIADMM C[C@H](CN(C)C(=O)c1cc(Br)ccc1[O-])c1ccccc1 ZINC000066459800 1019561455 /nfs/dbraw/zinc/56/14/55/1019561455.db2.gz PLBNCMSBQRYNLD-GFCCVEGCSA-N -1 1 348.240 4.030 20 0 EIADMM C[C@H](c1ccccc1)N(Cc1ccccc1)C(=O)c1cncc([O-])c1 ZINC000339833200 1019905843 /nfs/dbraw/zinc/90/58/43/1019905843.db2.gz BHQBYXPIJBMKSD-MRXNPFEDSA-N -1 1 332.403 4.191 20 0 EIADMM O=C(CCCc1nc2ccccc2s1)Nc1ccc(F)cc1[O-] ZINC000340328625 1020764391 /nfs/dbraw/zinc/76/43/91/1020764391.db2.gz LTORAKUNQCSPBO-UHFFFAOYSA-N -1 1 330.384 4.102 20 0 EIADMM [O-]c1ccc(-c2noc(C3(c4ccc(F)cc4)CCC3)n2)c(F)c1 ZINC000683592056 1020945881 /nfs/dbraw/zinc/94/58/81/1020945881.db2.gz INERUIUVNIFTKS-UHFFFAOYSA-N -1 1 328.318 4.190 20 0 EIADMM CC(=O)Nc1ccc([O-])c(C(=O)Nc2ccccc2-c2ccccc2)c1 ZINC000121700494 1021002372 /nfs/dbraw/zinc/00/23/72/1021002372.db2.gz KIACLTDZJJBDRT-UHFFFAOYSA-N -1 1 346.386 4.270 20 0 EIADMM CSc1ccc(Cl)cc1[N-]S(=O)(=O)CCc1ccccc1 ZINC000064374843 1021029525 /nfs/dbraw/zinc/02/95/25/1021029525.db2.gz LMZFWJIFSOXUSL-UHFFFAOYSA-N -1 1 341.885 4.046 20 0 EIADMM [O-]c1ccc(-c2noc(-c3ccc([C@@H]4CCCOC4)cc3)n2)c(F)c1 ZINC000570355880 1021363453 /nfs/dbraw/zinc/36/34/53/1021363453.db2.gz RJSBBAPUFVZPEP-CQSZACIVSA-N -1 1 340.354 4.142 20 0 EIADMM O=C([O-])CCC1CCN(Cc2nc(C3CCCCC3)cs2)CC1 ZINC000570456782 1021463886 /nfs/dbraw/zinc/46/38/86/1021463886.db2.gz LXRTYEYICPVKGX-UHFFFAOYSA-N -1 1 336.501 4.268 20 0 EIADMM COc1cc(CN(C)[C@@H](C)c2cc(C)c(C(=O)[O-])o2)ccc1SC ZINC000580456604 1022044962 /nfs/dbraw/zinc/04/49/62/1022044962.db2.gz JMWUTOCBMLEEGN-LBPRGKRZSA-N -1 1 349.452 4.210 20 0 EIADMM Cc1cc(Br)c([O-])c(NC(=O)c2sccc2Cl)c1 ZINC000580461330 1022053037 /nfs/dbraw/zinc/05/30/37/1022053037.db2.gz MOVIFJDHMJZJAX-UHFFFAOYSA-N -1 1 346.633 4.430 20 0 EIADMM O=C(Nc1cc([O-])c(F)cc1F)c1cc(Oc2ccccc2)ccn1 ZINC001625894047 1022172297 /nfs/dbraw/zinc/17/22/97/1022172297.db2.gz PSFFEPMIDMPATG-UHFFFAOYSA-N -1 1 342.301 4.110 20 0 EIADMM CCS[C@H]1CC[C@@H](N(C)C(=O)c2cc3ccccc3cc2[O-])C1 ZINC000175393104 1022349323 /nfs/dbraw/zinc/34/93/23/1022349323.db2.gz FCBINFWCJJBVKL-CVEARBPZSA-N -1 1 329.465 4.292 20 0 EIADMM CCOc1cc(C(=O)N(C)C2CCCCCC2)cc(Cl)c1[O-] ZINC000186447211 1022611433 /nfs/dbraw/zinc/61/14/33/1022611433.db2.gz GLYHZRWNBMGRDL-UHFFFAOYSA-N -1 1 325.836 4.239 20 0 EIADMM CCOc1cc(C(=O)Nc2ccc(OC(C)C)cc2)cc(Cl)c1[O-] ZINC000186634850 1022701938 /nfs/dbraw/zinc/70/19/38/1022701938.db2.gz BZMKPMLEGZEWNW-UHFFFAOYSA-N -1 1 349.814 4.484 20 0 EIADMM CCOc1cc(C(=O)Nc2nc(C(C)C)cs2)cc(Cl)c1[O-] ZINC000186680194 1022728438 /nfs/dbraw/zinc/72/84/38/1022728438.db2.gz MXDJHWPHFRZFRH-UHFFFAOYSA-N -1 1 340.832 4.277 20 0 EIADMM CCOc1cc(C(=O)Nc2ccc(C)c(O)c2C)cc(Cl)c1[O-] ZINC000186867627 1022782000 /nfs/dbraw/zinc/78/20/00/1022782000.db2.gz ZTGMIRLBZXQLJX-UHFFFAOYSA-N -1 1 335.787 4.019 20 0 EIADMM CSc1cccc(N(C)C(=O)c2ccc(C(F)(F)F)cc2[O-])c1 ZINC000182028781 1023285480 /nfs/dbraw/zinc/28/54/80/1023285480.db2.gz HBTUAMLFNQYHON-UHFFFAOYSA-N -1 1 341.354 4.410 20 0 EIADMM CC(C)c1ccc(C(=O)N2C[C@H]3CCC(=O)c4cccc2c43)c([O-])c1 ZINC000274460684 1023349825 /nfs/dbraw/zinc/34/98/25/1023349825.db2.gz WNFUJCNVZIZDPH-CQSZACIVSA-N -1 1 335.403 4.236 20 0 EIADMM C[C@@H](OC(C)(C)C)[C@H](NCc1cc(-c2ccccc2)cs1)C(=O)[O-] ZINC000417586344 1023365972 /nfs/dbraw/zinc/36/59/72/1023365972.db2.gz QSXNUSQKDLQUJM-DYVFJYSZSA-N -1 1 347.480 4.162 20 0 EIADMM CN(C[C@H]1CC=CCC1)C(=O)c1c([O-])cnc2ccc(Cl)cc21 ZINC000549191215 1023452102 /nfs/dbraw/zinc/45/21/02/1023452102.db2.gz LRNFTVBBVHJLGV-LBPRGKRZSA-N -1 1 330.815 4.022 20 0 EIADMM Cc1cccc(CS(=O)(=O)[N-]c2cc(C)ccc2C(F)(F)F)c1 ZINC000656741612 1023475790 /nfs/dbraw/zinc/47/57/90/1023475790.db2.gz KCVPCGGGIDWGGJ-UHFFFAOYSA-N -1 1 343.370 4.264 20 0 EIADMM O=C([O-])c1cccc(-c2nc(CN3CCC[C@@H](CCF)C3)cs2)c1 ZINC000656764289 1023505870 /nfs/dbraw/zinc/50/58/70/1023505870.db2.gz WSHAHFNDIUCVNM-ZDUSSCGKSA-N -1 1 348.443 4.080 20 0 EIADMM CC[C@H](C)c1ccc(S(=O)(=O)[N-]c2cccc3[nH]ccc32)cc1 ZINC000110139182 1033171278 /nfs/dbraw/zinc/17/12/78/1033171278.db2.gz KBIOADWVBLONPJ-ZDUSSCGKSA-N -1 1 328.437 4.482 20 0 EIADMM CC(C)N(C(=O)c1ccc(NC(=O)OC(C)(C)C)cc1[O-])C1CCC1 ZINC000091730285 1024356021 /nfs/dbraw/zinc/35/60/21/1024356021.db2.gz NBODNLAYWSESEO-UHFFFAOYSA-N -1 1 348.443 4.142 20 0 EIADMM C[C@@H](c1ccc(Cl)c(Cl)c1)N(C)Cc1occc1C(=O)[O-] ZINC000652391164 1024802382 /nfs/dbraw/zinc/80/23/82/1024802382.db2.gz KIQVCLRPUWCXJO-VIFPVBQESA-N -1 1 328.195 4.478 20 0 EIADMM Cc1cc([C@H](C)N2CC[C@H](Oc3ccccc3Cl)C2)oc1C(=O)[O-] ZINC000652434841 1024829192 /nfs/dbraw/zinc/82/91/92/1024829192.db2.gz GBWKAHGQUWGLLF-STQMWFEESA-N -1 1 349.814 4.154 20 0 EIADMM Cc1nc(CNCc2cccc(Oc3ccccc3)c2)ccc1C(=O)[O-] ZINC000426645858 1025844401 /nfs/dbraw/zinc/84/44/01/1025844401.db2.gz GEYVYTLJMNQUHS-UHFFFAOYSA-N -1 1 348.402 4.170 20 0 EIADMM CC[C@H](C)c1ccc(S(=O)(=O)[N-]c2ccc(Cl)nc2C)cc1 ZINC000318359797 1026065066 /nfs/dbraw/zinc/06/50/66/1026065066.db2.gz GGOXHDNWMIYZPL-NSHDSACASA-N -1 1 338.860 4.358 20 0 EIADMM CCc1noc(C)c1[N-]C(=O)c1cc(F)c(C(F)(F)F)cc1F ZINC000342394478 1026079643 /nfs/dbraw/zinc/07/96/43/1026079643.db2.gz CYGBWPFKGMOGCQ-UHFFFAOYSA-N -1 1 334.244 4.095 20 0 EIADMM Cc1ccc(-c2nc(CSc3nc(C(F)F)cc(=O)[n-]3)co2)cc1 ZINC000582091526 1026129364 /nfs/dbraw/zinc/12/93/64/1026129364.db2.gz WWAOYSDRIROALF-UHFFFAOYSA-N -1 1 349.362 4.376 20 0 EIADMM O=C(N[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1)c1ccc([O-])c(F)c1 ZINC000684776895 1026263744 /nfs/dbraw/zinc/26/37/44/1026263744.db2.gz NVXHAPGPOOMTNJ-IINYFYTJSA-N -1 1 340.181 4.124 20 0 EIADMM Cc1c([N-]C(=O)c2ocnc2C(F)F)onc1C1CCCCC1 ZINC000637278885 1026266505 /nfs/dbraw/zinc/26/65/05/1026266505.db2.gz DVIYXIMHTVCEBM-UHFFFAOYSA-N -1 1 325.315 4.209 20 0 EIADMM Cc1nc(-c2ccc(NC3CCC(C(F)F)CC3)nc2)[n-]c(=O)c1C ZINC000413453798 1026270768 /nfs/dbraw/zinc/27/07/68/1026270768.db2.gz VHHBVWQWQGOFEG-UHFFFAOYSA-N -1 1 348.397 4.097 20 0 EIADMM COc1ccc(S[C@@H](C)C(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000111667005 1026314851 /nfs/dbraw/zinc/31/48/51/1026314851.db2.gz VWAHTWVBMCGYEE-JTQLQIEISA-N -1 1 337.828 4.174 20 0 EIADMM O=C([O-])C[C@H](NCc1ccc(Cl)cc1Cl)c1ccsc1 ZINC000426681599 1026471650 /nfs/dbraw/zinc/47/16/50/1026471650.db2.gz BKBDOAHQSONTSX-ZDUSSCGKSA-N -1 1 330.236 4.361 20 0 EIADMM Cc1ccc(-c2ccc(CN[C@@H](Cc3ccccc3)C(=O)[O-])o2)cc1 ZINC000426685075 1026475117 /nfs/dbraw/zinc/47/51/17/1026475117.db2.gz FVQOSWVRSGUPKJ-IBGZPJMESA-N -1 1 335.403 4.041 20 0 EIADMM O=C([O-])[C@@H](NCc1ccc(F)cc1Cl)c1ccc(Cl)c(F)c1 ZINC000426723451 1026505370 /nfs/dbraw/zinc/50/53/70/1026505370.db2.gz ZBFDVAIPLFFCTF-AWEZNQCLSA-N -1 1 346.160 4.187 20 0 EIADMM O=C([O-])[C@H](NCc1ccc(F)cc1Cl)c1cccc(Cl)c1 ZINC000426744046 1026525775 /nfs/dbraw/zinc/52/57/75/1026525775.db2.gz VWSFLOZIXAXQQP-CQSZACIVSA-N -1 1 328.170 4.048 20 0 EIADMM COc1ccc2c(c1)N(C(=O)c1cc3ccccc3cc1[O-])CCC2 ZINC001167877488 1026528945 /nfs/dbraw/zinc/52/89/45/1026528945.db2.gz XDTHAFULDMJQPL-UHFFFAOYSA-N -1 1 333.387 4.147 20 0 EIADMM O=C([O-])[C@@H](NCc1c(Cl)oc2ccccc21)c1cccc(F)c1 ZINC000426762265 1026530223 /nfs/dbraw/zinc/53/02/23/1026530223.db2.gz ISPQAFMTDLTVME-HNNXBMFYSA-N -1 1 333.746 4.141 20 0 EIADMM O=C([O-])[C@H](NCc1cccc2[nH]ccc21)c1c(Cl)cccc1Cl ZINC000426752661 1026538965 /nfs/dbraw/zinc/53/89/65/1026538965.db2.gz AUNNBVWMSSDMBP-MRXNPFEDSA-N -1 1 349.217 4.390 20 0 EIADMM CCCSC[C@H](NCc1ccc(-c2ccccc2)s1)C(=O)[O-] ZINC000426763216 1026546749 /nfs/dbraw/zinc/54/67/49/1026546749.db2.gz RCONLWWNUFBDGC-HNNXBMFYSA-N -1 1 335.494 4.101 20 0 EIADMM Cc1cc([C@H](NCc2cc(Cl)ccc2F)C(=O)[O-])ccc1Cl ZINC000426780028 1026556237 /nfs/dbraw/zinc/55/62/37/1026556237.db2.gz NNPYERIIXKUHOE-HNNXBMFYSA-N -1 1 342.197 4.356 20 0 EIADMM O=C([O-])C[C@H](NCc1coc2ccccc12)c1ccc(F)cc1F ZINC000426782390 1026558328 /nfs/dbraw/zinc/55/83/28/1026558328.db2.gz GMZQAKOONKNJMR-INIZCTEOSA-N -1 1 331.318 4.017 20 0 EIADMM Cc1ccc([C@H](CC(=O)[O-])NCc2cnc(-c3ccccc3)s2)o1 ZINC000426790264 1026563644 /nfs/dbraw/zinc/56/36/44/1026563644.db2.gz CCIIVPDRQDARKE-HNNXBMFYSA-N -1 1 342.420 4.017 20 0 EIADMM Cc1cc([C@H](NCc2cccc(Cl)c2F)C(=O)[O-])ccc1Cl ZINC000426801166 1026569368 /nfs/dbraw/zinc/56/93/68/1026569368.db2.gz SETYSWGCJSNRSS-HNNXBMFYSA-N -1 1 342.197 4.356 20 0 EIADMM CC[C@@H](Nc1ccc(-c2nc(C)c(C)c(=O)[n-]2)cn1)c1ccccc1 ZINC000413485489 1026596720 /nfs/dbraw/zinc/59/67/20/1026596720.db2.gz HEIRREQNBYEEIJ-QGZVFWFLSA-N -1 1 334.423 4.424 20 0 EIADMM O=c1nc([C@@H]2COc3ccccc3O2)[n-]c2sc3ccccc3c21 ZINC000337773009 1026598215 /nfs/dbraw/zinc/59/82/15/1026598215.db2.gz WDILCPSDQAVSIC-ZDUSSCGKSA-N -1 1 336.372 4.063 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc(OC(F)F)cc2)c(Cl)c1 ZINC000025366093 1026617100 /nfs/dbraw/zinc/61/71/00/1026617100.db2.gz PAYPVMJQIBULKV-UHFFFAOYSA-N -1 1 347.770 4.051 20 0 EIADMM CN(Cc1ccc(Cl)cc1)C(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684870178 1026627758 /nfs/dbraw/zinc/62/77/58/1026627758.db2.gz QUNMIFBKPLOURG-UHFFFAOYSA-N -1 1 343.732 4.337 20 0 EIADMM C[C@@H](c1ccccc1F)N(C)C(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684870779 1026633192 /nfs/dbraw/zinc/63/31/92/1026633192.db2.gz PHKNWNCDSULTLL-JTQLQIEISA-N -1 1 341.304 4.383 20 0 EIADMM O=C(c1ccc(C(F)(F)F)c([O-])c1)N1CCC[C@H]1Cc1ccccc1 ZINC000684870701 1026633484 /nfs/dbraw/zinc/63/34/84/1026633484.db2.gz KLYDCIOAHLRZLD-HNNXBMFYSA-N -1 1 349.352 4.258 20 0 EIADMM O=C(Nc1ccc(-c2cnco2)cc1)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684872672 1026640605 /nfs/dbraw/zinc/64/06/05/1026640605.db2.gz HUJXFMAZUVUIJD-UHFFFAOYSA-N -1 1 348.280 4.318 20 0 EIADMM CCCCN(CC(F)(F)F)C(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684874893 1026648444 /nfs/dbraw/zinc/64/84/44/1026648444.db2.gz WULSPCLAFCGMEC-UHFFFAOYSA-N -1 1 343.267 4.216 20 0 EIADMM O=S(=O)([N-]c1ccc2cc[nH]c2c1)c1ccc(Cl)c(Cl)c1 ZINC000432644848 1026663871 /nfs/dbraw/zinc/66/38/71/1026663871.db2.gz UFYCHDYRJOTCHT-UHFFFAOYSA-N -1 1 341.219 4.276 20 0 EIADMM CC(C)COc1ccc(S(=O)(=O)[N-]c2ccc3cc[nH]c3c2)cc1 ZINC000432649729 1026681603 /nfs/dbraw/zinc/68/16/03/1026681603.db2.gz UMPMAIDECAIWOR-UHFFFAOYSA-N -1 1 344.436 4.004 20 0 EIADMM [O-]c1cccc(CN2CCO[C@H](c3ccc(Cl)cc3)C2)c1Cl ZINC000507267805 1026726723 /nfs/dbraw/zinc/72/67/23/1026726723.db2.gz NIRSCZIWMOQVTN-INIZCTEOSA-N -1 1 338.234 4.273 20 0 EIADMM Cc1c2cccc(C)c2oc1C(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC000507347512 1026754586 /nfs/dbraw/zinc/75/45/86/1026754586.db2.gz GOBAWIOPLKJRIM-UHFFFAOYSA-N -1 1 347.374 4.398 20 0 EIADMM COc1c(C)ccc([N-]S(=O)(=O)c2cccc(C(F)F)c2)c1C ZINC000780376376 1026769657 /nfs/dbraw/zinc/76/96/57/1026769657.db2.gz GKTOPHQNUIQKLU-UHFFFAOYSA-N -1 1 341.379 4.050 20 0 EIADMM CCSc1cccc(F)c1[N-]S(=O)(=O)c1ccccc1Cl ZINC000582698705 1026963220 /nfs/dbraw/zinc/96/32/20/1026963220.db2.gz XMPMIMNNDISSEK-UHFFFAOYSA-N -1 1 345.848 4.392 20 0 EIADMM CCC[C@@]1(C)CCCN(C(=O)c2cc(Br)ccc2[O-])C1 ZINC000440922331 1027122598 /nfs/dbraw/zinc/12/25/98/1027122598.db2.gz FSJAINGZIVNZLU-INIZCTEOSA-N -1 1 340.261 4.197 20 0 EIADMM CCC[C@]1(C)CCCN(C(=O)c2ccc(Br)cc2[O-])C1 ZINC000440933523 1027132560 /nfs/dbraw/zinc/13/25/60/1027132560.db2.gz GMOHANDGWXKTQR-MRXNPFEDSA-N -1 1 340.261 4.197 20 0 EIADMM COC[C@@H](C)Cc1noc(-c2cc(Oc3ccccc3)ccc2[O-])n1 ZINC000650653900 1027252112 /nfs/dbraw/zinc/25/21/12/1027252112.db2.gz ALYCVBAZHVCNCR-ZDUSSCGKSA-N -1 1 340.379 4.060 20 0 EIADMM COc1cc(C(=O)N(C)[C@@H](C)c2ccccc2F)cc(Cl)c1[O-] ZINC000153548201 1027578560 /nfs/dbraw/zinc/57/85/60/1027578560.db2.gz JDEAJTACMYDDEP-JTQLQIEISA-N -1 1 337.778 4.027 20 0 EIADMM COc1cc(C(=O)N[C@@H](C)c2cc(C)sc2C)cc(Cl)c1[O-] ZINC000153557619 1027605260 /nfs/dbraw/zinc/60/52/60/1027605260.db2.gz ORECAAMYMYEBCD-VIFPVBQESA-N -1 1 339.844 4.224 20 0 EIADMM Cc1ccc(F)cc1S(=O)(=O)[N-]c1ccc2oc(C(C)C)nc2c1 ZINC000614788568 1027674148 /nfs/dbraw/zinc/67/41/48/1027674148.db2.gz CQGNNPRXPPNHNL-UHFFFAOYSA-N -1 1 348.399 4.200 20 0 EIADMM Cc1cc2cc[nH]c2cc1NC(=O)c1cc(Br)ccc1[O-] ZINC000444443699 1027753043 /nfs/dbraw/zinc/75/30/43/1027753043.db2.gz CUAJANJXGSCRCI-UHFFFAOYSA-N -1 1 345.196 4.197 20 0 EIADMM Cc1c(NC(=O)c2ccc(C(C)C)cc2[O-])cnn1C1CCCC1 ZINC000444500132 1027851309 /nfs/dbraw/zinc/85/13/09/1027851309.db2.gz WFLZZWHYJGWDSW-UHFFFAOYSA-N -1 1 327.428 4.388 20 0 EIADMM CCOCc1cccc([N-]S(=O)(=O)c2ccc(C(C)(C)C)cc2)c1 ZINC000523287838 1027939904 /nfs/dbraw/zinc/93/99/04/1027939904.db2.gz DLMDTMWGHNTMSB-UHFFFAOYSA-N -1 1 347.480 4.321 20 0 EIADMM Cc1ncc(-c2ccc([N-]S(=O)(=O)c3cccc(Cl)c3)cc2)o1 ZINC000029433194 1028197692 /nfs/dbraw/zinc/19/76/92/1028197692.db2.gz RWLRPLNHMKUSJJ-UHFFFAOYSA-N -1 1 348.811 4.104 20 0 EIADMM CCCc1nc(-c2nc(=O)c3c4c(sc3[n-]2)SCCC4)co1 ZINC000281079266 1028378650 /nfs/dbraw/zinc/37/86/50/1028378650.db2.gz UHZWOZKUQJDQRF-UHFFFAOYSA-N -1 1 333.438 4.043 20 0 EIADMM CSc1cccc([N-]S(=O)(=O)c2ccc(C(F)(F)F)cc2)c1 ZINC000016101266 1028472115 /nfs/dbraw/zinc/47/21/15/1028472115.db2.gz TWXZJNWIEWVYER-UHFFFAOYSA-N -1 1 347.383 4.228 20 0 EIADMM CCOc1cc(-c2noc(CC[C@H](C)SC)n2)cc(Cl)c1[O-] ZINC000445429857 1028526507 /nfs/dbraw/zinc/52/65/07/1028526507.db2.gz GLZMUBSBQRQMDY-VIFPVBQESA-N -1 1 342.848 4.178 20 0 EIADMM [O-]c1ccc(-c2noc([C@H]3Cc4ccccc4S3)n2)c(Cl)c1 ZINC000445449770 1028538741 /nfs/dbraw/zinc/53/87/41/1028538741.db2.gz PHZZEAQYWWCEJR-CQSZACIVSA-N -1 1 330.796 4.485 20 0 EIADMM CCc1ccc(OCc2nc(-c3ccc([O-])cc3Cl)no2)cc1 ZINC000445442604 1028565511 /nfs/dbraw/zinc/56/55/11/1028565511.db2.gz DDHDTMFWPNRVKW-UHFFFAOYSA-N -1 1 330.771 4.237 20 0 EIADMM COc1cc(/C=C/c2nc(-c3ccc([O-])cc3Cl)no2)ccc1F ZINC000445443763 1028567894 /nfs/dbraw/zinc/56/78/94/1028567894.db2.gz DJGCLNRCMHJMSU-XVNBXDOJSA-N -1 1 346.745 4.414 20 0 EIADMM CSc1ccccc1Cc1nc(-c2ccc([O-])cc2Cl)no1 ZINC000445446887 1028577263 /nfs/dbraw/zinc/57/72/63/1028577263.db2.gz FZWTWRUJFNDQIG-UHFFFAOYSA-N -1 1 332.812 4.408 20 0 EIADMM [O-]c1ccc(-c2noc(CSc3ccc(F)c(F)c3)n2)c(F)c1 ZINC000445466250 1028589664 /nfs/dbraw/zinc/58/96/64/1028589664.db2.gz YANSPSAEKLAXAY-UHFFFAOYSA-N -1 1 338.310 4.152 20 0 EIADMM CCc1ccccc1OCc1nc(-c2ccc([O-])cc2Cl)no1 ZINC000445453739 1028603781 /nfs/dbraw/zinc/60/37/81/1028603781.db2.gz JJZXBWPUHXCDEO-UHFFFAOYSA-N -1 1 330.771 4.237 20 0 EIADMM [O-]c1ccc(-c2noc(-c3ccccc3Br)n2)c(F)c1 ZINC000445454524 1028606637 /nfs/dbraw/zinc/60/66/37/1028606637.db2.gz LGVMNHUDOIOPIE-UHFFFAOYSA-N -1 1 335.132 4.011 20 0 EIADMM C[C@@H](CSc1ccccc1)c1nc(-c2ccc([O-])cc2F)no1 ZINC000445456742 1028609622 /nfs/dbraw/zinc/60/96/22/1028609622.db2.gz PXLGFCXDBXMZFE-NSHDSACASA-N -1 1 330.384 4.477 20 0 EIADMM [O-]c1ccc(-c2noc([C@H]3CCC[C@H](C(F)(F)F)C3)n2)c(F)c1 ZINC000445457941 1028612437 /nfs/dbraw/zinc/61/24/37/1028612437.db2.gz VEVWQYZFZLKXJQ-IUCAKERBSA-N -1 1 330.281 4.417 20 0 EIADMM CSc1ccc(O[C@@H](C)c2nc(-c3ccc([O-])cc3F)no2)cc1 ZINC000445459425 1028615720 /nfs/dbraw/zinc/61/57/20/1028615720.db2.gz AUWOINSBZIIECL-JTQLQIEISA-N -1 1 346.383 4.443 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cncc(-c4ccccc4)c3)n2)cc1F ZINC000445477409 1028623261 /nfs/dbraw/zinc/62/32/61/1028623261.db2.gz NYTRGZFEFKNMRI-UHFFFAOYSA-N -1 1 333.322 4.310 20 0 EIADMM CC[C@@H](Oc1cccc(C)c1)c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445478377 1028624059 /nfs/dbraw/zinc/62/40/59/1028624059.db2.gz DTTPSHLHQBVZFG-MRXNPFEDSA-N -1 1 328.343 4.420 20 0 EIADMM Cc1cc(C)c(OCc2nc(-c3ccc([O-])c(F)c3)no2)c(C)c1 ZINC000445477564 1028624382 /nfs/dbraw/zinc/62/43/82/1028624382.db2.gz CUQDQUOJBBOBFK-UHFFFAOYSA-N -1 1 328.343 4.086 20 0 EIADMM CCOc1ccccc1/C=C\c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445480198 1028627217 /nfs/dbraw/zinc/62/72/17/1028627217.db2.gz LNAKUINASLCGAU-NTMALXAHSA-N -1 1 326.327 4.150 20 0 EIADMM COc1ccc(S[C@H](C)c2nc(-c3ccc([O-])c(F)c3)no2)cc1 ZINC000445481640 1028627607 /nfs/dbraw/zinc/62/76/07/1028627607.db2.gz NJQROXKUESXYJU-SNVBAGLBSA-N -1 1 346.383 4.443 20 0 EIADMM Cc1ccc(-c2nc(-c3ccc([O-])c(F)c3)no2)c(Br)c1 ZINC000445481523 1028628201 /nfs/dbraw/zinc/62/82/01/1028628201.db2.gz LKKFUFXQXBKERK-UHFFFAOYSA-N -1 1 349.159 4.319 20 0 EIADMM [O-]c1ccc(-c2noc(CCCc3ccc(F)c(F)c3)n2)cc1F ZINC000445482827 1028630680 /nfs/dbraw/zinc/63/06/80/1028630680.db2.gz QXXBGZVXIAKRRO-UHFFFAOYSA-N -1 1 334.297 4.035 20 0 EIADMM [O-]c1ccc(-c2noc([C@@H]3C[C@H]3c3cc(F)ccc3F)n2)cc1F ZINC000445484432 1028633367 /nfs/dbraw/zinc/63/33/67/1028633367.db2.gz ZFCJMVTZGPLHJK-CMPLNLGQSA-N -1 1 332.281 4.131 20 0 EIADMM Cc1cc(OCc2nc(-c3ccc([O-])c(F)c3)no2)ccc1Cl ZINC000445483804 1028634016 /nfs/dbraw/zinc/63/40/16/1028634016.db2.gz WVLPATCSXRBFNJ-UHFFFAOYSA-N -1 1 334.734 4.122 20 0 EIADMM Cc1cc(Cl)ccc1OCc1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445482113 1028634300 /nfs/dbraw/zinc/63/43/00/1028634300.db2.gz RALUKVSJGPFHMX-UHFFFAOYSA-N -1 1 334.734 4.122 20 0 EIADMM Cc1cccc(-c2nc(-c3ccc([O-])c(F)c3)no2)c1Br ZINC000445482979 1028634312 /nfs/dbraw/zinc/63/43/12/1028634312.db2.gz RYPOSEMZQVSXOP-UHFFFAOYSA-N -1 1 349.159 4.319 20 0 EIADMM COc1ccc(C)cc1/C=C\c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445473077 1028644334 /nfs/dbraw/zinc/64/43/34/1028644334.db2.gz MIXKAXWHLRPMOE-YVMONPNESA-N -1 1 326.327 4.069 20 0 EIADMM CC(=O)Nc1ccc([O-])c(-c2nc(-c3oc4ccccc4c3C)no2)c1 ZINC000445504588 1028652557 /nfs/dbraw/zinc/65/25/57/1028652557.db2.gz PMLQBLBSDOXNFK-UHFFFAOYSA-N -1 1 349.346 4.122 20 0 EIADMM O=S(=O)([N-]c1ccc(F)cc1F)c1cccc(Cl)c1Cl ZINC000016129359 1028784807 /nfs/dbraw/zinc/78/48/07/1028784807.db2.gz CIQYRHBFRMTBJQ-UHFFFAOYSA-N -1 1 338.162 4.072 20 0 EIADMM Cc1ccc(F)c([N-]S(=O)(=O)c2c(Cl)cccc2Cl)c1 ZINC000016148119 1028879546 /nfs/dbraw/zinc/87/95/46/1028879546.db2.gz DUSWVEPKRBJWIY-UHFFFAOYSA-N -1 1 334.199 4.242 20 0 EIADMM Cc1nnc(SCC(=O)c2ccc([O-])cc2)n1[C@@H]1CCC[C@@H](C)C1 ZINC000536090898 1028974588 /nfs/dbraw/zinc/97/45/88/1028974588.db2.gz RDDDOGPSJSEWEO-IUODEOHRSA-N -1 1 345.468 4.018 20 0 EIADMM C[C@@H](Oc1[n-]c(=S)ncc1F)c1c(Cl)ccc(F)c1Cl ZINC001227383926 1029001301 /nfs/dbraw/zinc/00/13/01/1029001301.db2.gz SYUOVIILGQHFKN-RXMQYKEDSA-N -1 1 337.178 4.490 20 0 EIADMM CCSCc1cccc([N-]S(=O)(=O)c2ccc3c(c2)CCC3)c1 ZINC000525010112 1029401239 /nfs/dbraw/zinc/40/12/39/1029401239.db2.gz RKLJHLRFVNPIJH-UHFFFAOYSA-N -1 1 347.505 4.229 20 0 EIADMM C[C@H](Oc1cccc2ccccc21)C(=O)Nc1ccc(F)cc1[O-] ZINC000444332187 1029452994 /nfs/dbraw/zinc/45/29/94/1029452994.db2.gz RYJVZKMOJLVEMA-LBPRGKRZSA-N -1 1 325.339 4.091 20 0 EIADMM Cc1nc(-c2ccc(NC3CCCCCCC3)nc2)[n-]c(=O)c1C ZINC000301162396 1029679159 /nfs/dbraw/zinc/67/91/59/1029679159.db2.gz GJEKKMUFOXCMIV-UHFFFAOYSA-N -1 1 326.444 4.386 20 0 EIADMM CCOc1ccc(NC(=O)c2cc(Cl)c([O-])c(OCC)c2)cc1 ZINC000193053177 1029709184 /nfs/dbraw/zinc/70/91/84/1029709184.db2.gz RHUMMQKBMYCHBV-UHFFFAOYSA-N -1 1 335.787 4.095 20 0 EIADMM Cc1nc(-c2ccc(N[C@@H](C)[C@@H](C)c3ccccc3)nc2)[n-]c(=O)c1C ZINC000080687963 1029714742 /nfs/dbraw/zinc/71/47/42/1029714742.db2.gz NAGVUZJILRKFKO-HIFRSBDPSA-N -1 1 348.450 4.053 20 0 EIADMM CC(=O)c1ccc([N-]S(=O)(=O)c2ccccc2C(C)C)cc1C ZINC000468372617 1029751083 /nfs/dbraw/zinc/75/10/83/1029751083.db2.gz MLYFUUXIAJMJGJ-UHFFFAOYSA-N -1 1 331.437 4.122 20 0 EIADMM Cc1nc(-c2ccc(N3CCCC[C@@H]3CC(C)C)nc2)[n-]c(=O)c1C ZINC000301752725 1029804598 /nfs/dbraw/zinc/80/45/98/1029804598.db2.gz VTBNYZUFZCNZHI-QGZVFWFLSA-N -1 1 340.471 4.266 20 0 EIADMM COc1cc(C)cc([N-]S(=O)(=O)c2ccc(C(C)C)cc2)c1C ZINC000447257503 1029944730 /nfs/dbraw/zinc/94/47/30/1029944730.db2.gz AVEXXTWSBMPGQX-UHFFFAOYSA-N -1 1 333.453 4.236 20 0 EIADMM COc1cc(C)cc([N-]S(=O)(=O)c2ccc(C)c(Cl)c2)c1C ZINC000447265958 1029952565 /nfs/dbraw/zinc/95/25/65/1029952565.db2.gz UBFSIGQULHKXAS-UHFFFAOYSA-N -1 1 339.844 4.075 20 0 EIADMM C[C@H]1C[C@@H](c2cccnc2)N(C(=O)c2ccc3ccccc3c2[O-])C1 ZINC000182821519 1029966880 /nfs/dbraw/zinc/96/68/80/1029966880.db2.gz WPWSPDJUKMBBSL-LIRRHRJNSA-N -1 1 332.403 4.164 20 0 EIADMM CCOc1cc(C(=O)N(C)[C@@H](C)C2CCCCC2)cc(Cl)c1[O-] ZINC000447318947 1030006994 /nfs/dbraw/zinc/00/69/94/1030006994.db2.gz VKBIVZSSSMXFMV-LBPRGKRZSA-N -1 1 339.863 4.485 20 0 EIADMM CC[C@@H](c1ccccc1)S(=O)(=O)c1ncc(-c2ccc(F)cc2)[n-]1 ZINC000447492190 1030103851 /nfs/dbraw/zinc/10/38/51/1030103851.db2.gz YHZRUJJZEWZYFV-KRWDZBQOSA-N -1 1 344.411 4.141 20 0 EIADMM CC[C@@H](c1ccccc1)S(=O)(=O)c1nc(-c2ccc(F)cc2)c[n-]1 ZINC000447492190 1030103863 /nfs/dbraw/zinc/10/38/63/1030103863.db2.gz YHZRUJJZEWZYFV-KRWDZBQOSA-N -1 1 344.411 4.141 20 0 EIADMM CCCCOc1cccc([N-]S(=O)(=O)c2ccc(OCC)cc2)c1 ZINC000511262239 1030159303 /nfs/dbraw/zinc/15/93/03/1030159303.db2.gz ZPFCAANNVBRKJK-UHFFFAOYSA-N -1 1 349.452 4.065 20 0 EIADMM CCOc1cc(C(=O)N(C)[C@H]2CCC[C@H](C)C2)cc(Cl)c1[O-] ZINC000186579370 1030288665 /nfs/dbraw/zinc/28/86/65/1030288665.db2.gz SPRIWVODJVIHNO-AAEUAGOBSA-N -1 1 325.836 4.095 20 0 EIADMM O=C1c2ccc([O-])cc2CC/C1=C/c1ccc(Br)cc1 ZINC000143454675 1030502472 /nfs/dbraw/zinc/50/24/72/1030502472.db2.gz BCPPBPLRTBDNJU-LCYFTJDESA-N -1 1 329.193 4.367 20 0 EIADMM CO[C@@H](CSc1nc(C(F)F)cc(=O)[n-]1)c1ccc(Cl)cc1 ZINC000685574964 1030534734 /nfs/dbraw/zinc/53/47/34/1030534734.db2.gz NKGBQASBKZAMLM-NSHDSACASA-N -1 1 346.786 4.253 20 0 EIADMM Cc1nc(-c2cccc([N-]S(=O)(=O)c3cccc(C)c3)c2)cs1 ZINC000000577271 1030576363 /nfs/dbraw/zinc/57/63/63/1030576363.db2.gz LUQAQWICFGGNOY-UHFFFAOYSA-N -1 1 344.461 4.228 20 0 EIADMM Cc1cc(Cl)ccc1[N-]S(=O)(=O)c1ccc(F)c(Cl)c1 ZINC000006425199 1030909726 /nfs/dbraw/zinc/90/97/26/1030909726.db2.gz RSTNRWDZYSRAJX-UHFFFAOYSA-N -1 1 334.199 4.242 20 0 EIADMM CC(C)C[N@@H+](Cc1ccc(C(=O)[O-])cc1Br)C(C)C ZINC000226725449 1031104726 /nfs/dbraw/zinc/10/47/26/1031104726.db2.gz HEKNKODLFKKNMT-UHFFFAOYSA-N -1 1 328.250 4.014 20 0 EIADMM CCC[C@H](OCC)c1nc(-c2cc(Cl)c([O-])c(OCC)c2)no1 ZINC000528166479 1031198468 /nfs/dbraw/zinc/19/84/68/1031198468.db2.gz LLYWLIJXPFJEQY-LBPRGKRZSA-N -1 1 340.807 4.372 20 0 EIADMM CC1(C)C[C@H](C(=O)Nc2ccc([O-])c(Cl)c2)c2ccccc2O1 ZINC000413661050 1031384115 /nfs/dbraw/zinc/38/41/15/1031384115.db2.gz XFRKIFFEOSLINM-ZDUSSCGKSA-N -1 1 331.799 4.329 20 0 EIADMM CC1(C)CN(Cc2ccc(C(=O)[O-])c(Cl)c2)CC[C@@H]1C(F)(F)F ZINC000584475576 1031437373 /nfs/dbraw/zinc/43/73/73/1031437373.db2.gz PHHRHMIOZCSOLJ-ZDUSSCGKSA-N -1 1 349.780 4.449 20 0 EIADMM O=S(=O)([N-]c1ccc(F)c(Cl)c1)c1cccc2ccccc21 ZINC000389564852 1031488211 /nfs/dbraw/zinc/48/82/11/1031488211.db2.gz DAFNXZGOVTYWPD-UHFFFAOYSA-N -1 1 335.787 4.433 20 0 EIADMM COCc1c(C(=O)Nc2ccc(F)cc2[O-])sc2cccc(F)c21 ZINC000531755667 1031531608 /nfs/dbraw/zinc/53/16/08/1031531608.db2.gz STKUPNILJNBNHF-UHFFFAOYSA-N -1 1 349.358 4.284 20 0 EIADMM CC(C)(C(=O)N1CCC(C(=O)c2ccc([O-])cc2)CC1)C1CCCC1 ZINC000128696115 1031754623 /nfs/dbraw/zinc/75/46/23/1031754623.db2.gz SHXBQMVNBRTUBZ-UHFFFAOYSA-N -1 1 343.467 4.030 20 0 EIADMM O=c1nc(-c2ccc(O)cc2)[n-]c2cc(-c3ccc(F)cc3)sc21 ZINC000614111481 1033380700 /nfs/dbraw/zinc/38/07/00/1033380700.db2.gz BXMREKRBCIEBDU-UHFFFAOYSA-N -1 1 338.363 4.163 20 0 EIADMM Cc1cccc2nc(-c3cccc(NC(=O)c4ccco4)c3)[n-]c(=O)c12 ZINC000614113654 1033397440 /nfs/dbraw/zinc/39/74/40/1033397440.db2.gz WITYWXXPZLETOE-UHFFFAOYSA-N -1 1 345.358 4.156 20 0 EIADMM [O-]c1cccc(CNc2cccc(OC[C@H]3CCCO3)c2)c1Cl ZINC000645155780 1033889882 /nfs/dbraw/zinc/88/98/82/1033889882.db2.gz DDSYNCPDYDKYOP-MRXNPFEDSA-N -1 1 333.815 4.216 20 0 EIADMM CC[C@@H](C)Oc1cccc([N-]S(=O)(=O)c2cc(C)ccc2C)c1 ZINC000512827820 1034028011 /nfs/dbraw/zinc/02/80/11/1034028011.db2.gz OESTVLMOOCHDLV-OAHLLOKOSA-N -1 1 333.453 4.282 20 0 EIADMM CCc1cccc(S(=O)(=O)[N-]c2ccc3nc(C4CC4)oc3c2)c1 ZINC000433516708 1034600362 /nfs/dbraw/zinc/60/03/62/1034600362.db2.gz IYVZJFXWUCYBMT-UHFFFAOYSA-N -1 1 342.420 4.068 20 0 EIADMM CCCCc1cccc(NC2([P@](=O)([O-])O)Cc3ccccc3C2)c1 ZINC001167937556 1034763121 /nfs/dbraw/zinc/76/31/21/1034763121.db2.gz DUJXAWHNFXEDAQ-UHFFFAOYSA-N -1 1 345.379 4.114 20 0 EIADMM C[C@H](C(=O)Nc1ccc(F)cc1[O-])c1ccc(Br)cc1 ZINC000501740811 1035557924 /nfs/dbraw/zinc/55/79/24/1035557924.db2.gz WAVVLKVHGHONCN-VIFPVBQESA-N -1 1 338.176 4.036 20 0 EIADMM CCCCSc1ccc(Cl)cc1C(=O)Nc1c(C)[n-][nH]c1=O ZINC000615221453 1035683662 /nfs/dbraw/zinc/68/36/62/1035683662.db2.gz LAYXMPPINYWGSD-UHFFFAOYSA-N -1 1 339.848 4.222 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2cccc(F)c2Cl)sc1Cl ZINC000571319319 1036023767 /nfs/dbraw/zinc/02/37/67/1036023767.db2.gz RZSQDUQRMRSLBK-UHFFFAOYSA-N -1 1 340.228 4.303 20 0 EIADMM CCN(CC[C@H](C(=O)[O-])c1ccccc1)Cc1c(F)cccc1F ZINC000571453249 1036050657 /nfs/dbraw/zinc/05/06/57/1036050657.db2.gz PAWLFQFAGKAPGW-HNNXBMFYSA-N -1 1 333.378 4.045 20 0 EIADMM O=C(Cc1c[nH]c2cccc(Cl)c12)Nc1ccc([O-])c(Cl)c1 ZINC000485657654 1036129977 /nfs/dbraw/zinc/12/99/77/1036129977.db2.gz MDBGVNCNEAFCNJ-UHFFFAOYSA-N -1 1 335.190 4.362 20 0 EIADMM CC(C)COc1ccc(S(=O)(=O)[N-]c2cccc3[nH]ccc32)cc1 ZINC000588633954 1036385977 /nfs/dbraw/zinc/38/59/77/1036385977.db2.gz NTLXAFXSZFQXIA-UHFFFAOYSA-N -1 1 344.436 4.004 20 0 EIADMM Cc1ccc(C)c(S(=O)(=O)[N-]c2ccc(C(=O)C3CCC3)cc2)c1 ZINC000486093823 1036479063 /nfs/dbraw/zinc/47/90/63/1036479063.db2.gz STFSFKBDZIKXQF-UHFFFAOYSA-N -1 1 343.448 4.087 20 0 EIADMM COc1cc(C)c(NC(=O)Nc2ccc([O-])c(Cl)c2)cc1OC ZINC000486197267 1036556177 /nfs/dbraw/zinc/55/61/77/1036556177.db2.gz WBETVJMBPLJZTM-UHFFFAOYSA-N -1 1 336.775 4.015 20 0 EIADMM O=C([N-]c1ncc(C2CCCCC2)s1)c1nnc(-c2ccco2)o1 ZINC000907305447 1036583520 /nfs/dbraw/zinc/58/35/20/1036583520.db2.gz UZDTUISCFYRMDA-UHFFFAOYSA-N -1 1 344.396 4.086 20 0 EIADMM [O-]c1ccc(-c2noc(CCSCc3ccccc3)n2)c(F)c1 ZINC000436879022 1036687106 /nfs/dbraw/zinc/68/71/06/1036687106.db2.gz LYVQVRDEAKDUEY-UHFFFAOYSA-N -1 1 330.384 4.057 20 0 EIADMM CC(C)(C)C[C@H]1CCCN1C(=O)c1ccc(Br)c([O-])c1 ZINC000486657625 1036795468 /nfs/dbraw/zinc/79/54/68/1036795468.db2.gz ZSVUQMAOKCMREJ-GFCCVEGCSA-N -1 1 340.261 4.196 20 0 EIADMM CCCCCc1ccc([N-]S(=O)(=O)c2cccc(COC)c2)cc1 ZINC000589428896 1036799720 /nfs/dbraw/zinc/79/97/20/1036799720.db2.gz CIJJLEQUWAJYJB-UHFFFAOYSA-N -1 1 347.480 4.367 20 0 EIADMM Cc1cccc([C@H](C)NC(=O)c2ccc(Br)c([O-])c2)c1C ZINC000486721395 1036828277 /nfs/dbraw/zinc/82/82/77/1036828277.db2.gz CWIFKOYVVUPIHV-LBPRGKRZSA-N -1 1 348.240 4.263 20 0 EIADMM CCCCCn1nc(C)cc1NC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000486919841 1036890455 /nfs/dbraw/zinc/89/04/55/1036890455.db2.gz JSVBLYOPMMYZTE-UHFFFAOYSA-N -1 1 336.823 4.385 20 0 EIADMM Cc1c(C(=O)Nc2cccc([O-])c2Br)ccn1C(C)C ZINC000908708435 1036922069 /nfs/dbraw/zinc/92/20/69/1036922069.db2.gz WHUIPAPPBMIQOX-UHFFFAOYSA-N -1 1 337.217 4.098 20 0 EIADMM CC[C@H](C)c1ccc(S(=O)(=O)[N-]c2cc3n[nH]cc3cc2C)cc1 ZINC000589980835 1036924499 /nfs/dbraw/zinc/92/44/99/1036924499.db2.gz PFDISTCEOMLHKX-LBPRGKRZSA-N -1 1 343.452 4.186 20 0 EIADMM CCc1ccccc1S(=O)(=O)[N-]c1ccccc1N1CCCCC1 ZINC000488303755 1037495767 /nfs/dbraw/zinc/49/57/67/1037495767.db2.gz BRPZJWAFAFMOSN-UHFFFAOYSA-N -1 1 344.480 4.040 20 0 EIADMM CCc1ccccc1S(=O)(=O)[N-]c1cccc(CC(F)(F)F)c1 ZINC000488302035 1037497377 /nfs/dbraw/zinc/49/73/77/1037497377.db2.gz RTJQNMFTBBIODW-UHFFFAOYSA-N -1 1 343.370 4.155 20 0 EIADMM CCc1ccc(-c2nc(CN3C[C@H](C(=O)[O-])CC[C@@H]3C)cs2)cc1 ZINC000573723029 1037678435 /nfs/dbraw/zinc/67/84/35/1037678435.db2.gz QJIKUBAFWTYWKH-XJKSGUPXSA-N -1 1 344.480 4.058 20 0 EIADMM Cc1nc(-c2ccc(F)cc2)sc1C(=O)Nc1c([O-])cccc1F ZINC000605434950 1037788098 /nfs/dbraw/zinc/78/80/98/1037788098.db2.gz DNJMXLYZCPYDIX-UHFFFAOYSA-N -1 1 346.358 4.355 20 0 EIADMM CCc1cccc(CC)c1S(=O)(=O)[N-]c1ccc2oc(C)nc2c1 ZINC000605492241 1037821501 /nfs/dbraw/zinc/82/15/01/1037821501.db2.gz IBKJUNVGECBKFS-UHFFFAOYSA-N -1 1 344.436 4.062 20 0 EIADMM CC(=C([O-])Nc1nc(-c2cccc(Cl)c2)ns1)c1ccsc1 ZINC000606184560 1037905652 /nfs/dbraw/zinc/90/56/52/1037905652.db2.gz FULFNMDDLMTBKA-VIFPVBQESA-N -1 1 349.868 4.084 20 0 EIADMM O=C([O-])C[C@@H](NCc1csc(Cl)c1Cl)c1cccs1 ZINC000669472637 1037941089 /nfs/dbraw/zinc/94/10/89/1037941089.db2.gz HKZRFHOYSRVWFO-MRVPVSSYSA-N -1 1 336.265 4.422 20 0 EIADMM Cc1oc(-c2ccccc2F)nc1C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000150718850 1037975041 /nfs/dbraw/zinc/97/50/41/1037975041.db2.gz QCKLMSJTWZAAFM-UHFFFAOYSA-N -1 1 346.745 4.400 20 0 EIADMM COc1cc(C(=O)NCc2cc3ccccc3s2)cc(Cl)c1[O-] ZINC000489597110 1038153563 /nfs/dbraw/zinc/15/35/63/1038153563.db2.gz QMCRPLHRXQZBHW-UHFFFAOYSA-N -1 1 347.823 4.199 20 0 EIADMM Cc1ccc(Cl)cc1S(=O)(=O)[N-]c1ccc(Cl)cc1C ZINC000031665628 1038341191 /nfs/dbraw/zinc/34/11/91/1038341191.db2.gz DURCNCGZPSRCEY-UHFFFAOYSA-N -1 1 330.236 4.411 20 0 EIADMM Cc1[n-][nH]c(=O)c1NC(=O)CCCCc1ccc(Cl)c(Cl)c1 ZINC000615221595 1038377037 /nfs/dbraw/zinc/37/70/37/1038377037.db2.gz MOKNZXRHIOQXBT-UHFFFAOYSA-N -1 1 342.226 4.082 20 0 EIADMM CC(=O)c1c(C)cc(C)c(COC(=O)c2c([O-])cc(F)cc2F)c1C ZINC000063543482 1038428498 /nfs/dbraw/zinc/42/84/98/1038428498.db2.gz AVJQZAWJPPBNAX-UHFFFAOYSA-N -1 1 348.345 4.155 20 0 EIADMM Cc1ccc(C(=O)Nc2c([O-])cccc2F)cc1Oc1ccncc1 ZINC000608365572 1038804853 /nfs/dbraw/zinc/80/48/53/1038804853.db2.gz NLJUYWWVXJYKDD-UHFFFAOYSA-N -1 1 338.338 4.279 20 0 EIADMM O=C(CSc1cccc(C(F)(F)F)c1)Nc1c([O-])cccc1F ZINC000608365598 1038805137 /nfs/dbraw/zinc/80/51/37/1038805137.db2.gz HHCPMIBJWMWRJT-UHFFFAOYSA-N -1 1 345.317 4.281 20 0 EIADMM CCc1nc(C)c([C@H](C)N(C)C(=O)c2ccc(Cl)cc2[O-])s1 ZINC000120002683 1039025682 /nfs/dbraw/zinc/02/56/82/1039025682.db2.gz TZEZWZPSLLEPOU-JTQLQIEISA-N -1 1 338.860 4.206 20 0 EIADMM Cc1cccc([N-]S(=O)(=O)c2c(Cl)cccc2Cl)c1F ZINC000539398066 1039056319 /nfs/dbraw/zinc/05/63/19/1039056319.db2.gz ZFYCLXGNADWDJT-UHFFFAOYSA-N -1 1 334.199 4.242 20 0 EIADMM Cc1nc(C(C)(C)C)[n-]c(=O)c1C(=O)N[C@H](C)[C@H](C)C1CCCCC1 ZINC000481208312 1039125015 /nfs/dbraw/zinc/12/50/15/1039125015.db2.gz YCRMRYKYXUNDQL-QWHCGFSZSA-N -1 1 347.503 4.123 20 0 EIADMM COC(=O)CC(C)(C)CC(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000600135828 1039313287 /nfs/dbraw/zinc/31/32/87/1039313287.db2.gz MVADJKDHYBWZBJ-UHFFFAOYSA-N -1 1 349.814 4.117 20 0 EIADMM O=C(NCc1ccc(C(F)(F)F)cc1)Nc1cc(F)c([O-])c(F)c1 ZINC000149511004 1039501840 /nfs/dbraw/zinc/50/18/40/1039501840.db2.gz QZEQWBIEZBZSHZ-UHFFFAOYSA-N -1 1 346.255 4.011 20 0 EIADMM CCCc1cc(=O)[n-]c(SCc2ncc(-c3ccccc3C)o2)n1 ZINC000534527397 1039538226 /nfs/dbraw/zinc/53/82/26/1039538226.db2.gz JTVRWXJTIZFXNT-UHFFFAOYSA-N -1 1 341.436 4.390 20 0 EIADMM CCn1ccnc1[C@H]1CCCCN1C(=O)c1cc2ccccc2cc1[O-] ZINC000281477166 1039854467 /nfs/dbraw/zinc/85/44/67/1039854467.db2.gz CXMJOJLBWNUCSP-GOSISDBHSA-N -1 1 349.434 4.129 20 0 EIADMM Cc1cc2[nH]ncc2cc1[N-]S(=O)(=O)c1ccc(C(C)(C)C)s1 ZINC000479141480 1040159196 /nfs/dbraw/zinc/15/91/96/1040159196.db2.gz OMGXSOCBGBDIHV-UHFFFAOYSA-N -1 1 349.481 4.031 20 0 EIADMM O=c1cc(C(F)F)nc(SCc2ncc(-c3cccs3)o2)[n-]1 ZINC000514760560 1040213142 /nfs/dbraw/zinc/21/31/42/1040213142.db2.gz XIMHZILHWAOPQD-UHFFFAOYSA-N -1 1 341.364 4.129 20 0 EIADMM CCS[C@@H](C(=O)Nc1cc(C)cc(Br)c1[O-])C(C)C ZINC000482571324 1040364542 /nfs/dbraw/zinc/36/45/42/1040364542.db2.gz AVPRZXPOBYJQCZ-CYBMUJFWSA-N -1 1 346.290 4.179 20 0 EIADMM Cc1cc(Br)c([O-])c(NC(=O)c2ccc(C)c(F)c2)c1 ZINC000482579463 1040365476 /nfs/dbraw/zinc/36/54/76/1040365476.db2.gz RKEZSSDWMLBIKV-UHFFFAOYSA-N -1 1 338.176 4.163 20 0 EIADMM Cc1cc(Br)c([O-])c(NC(=O)c2cccc(C)c2F)c1 ZINC000482673093 1040423956 /nfs/dbraw/zinc/42/39/56/1040423956.db2.gz MICZCRGMNXPAAW-UHFFFAOYSA-N -1 1 338.176 4.163 20 0 EIADMM COc1cc(C)c([N-]S(=O)(=O)c2ccc(C)cc2Cl)cc1C ZINC000435737153 1040590519 /nfs/dbraw/zinc/59/05/19/1040590519.db2.gz FEZDNJLJDBNMSV-UHFFFAOYSA-N -1 1 339.844 4.075 20 0 EIADMM Cc1ccc2c(c1)N(C(=O)c1cc3ccccc3cc1[O-])C[C@@H](C)O2 ZINC000539871745 1040855987 /nfs/dbraw/zinc/85/59/87/1040855987.db2.gz IETSSBXGFBCAFA-CQSZACIVSA-N -1 1 333.387 4.282 20 0 EIADMM CCc1ccc(S(=O)(=O)[N-]c2cccc(C(C)(F)F)c2)cc1 ZINC000436173368 1040936852 /nfs/dbraw/zinc/93/68/52/1040936852.db2.gz GOJXOCVKROBBDY-UHFFFAOYSA-N -1 1 325.380 4.162 20 0 EIADMM Cc1nc(-c2ccc(N[C@@H](C)C3CCC(F)CC3)nc2)[n-]c(=O)c1C ZINC000664540565 1041074428 /nfs/dbraw/zinc/07/44/28/1041074428.db2.gz XLEWSJMHKQFIEM-HLIUYOAVSA-N -1 1 344.434 4.190 20 0 EIADMM CCc1cc(C(=O)[N-]c2c(F)cc(C(C)=O)c(F)c2F)oc1CC ZINC000461086596 1041208398 /nfs/dbraw/zinc/20/83/98/1041208398.db2.gz QOPOQHGBDVMDLS-UHFFFAOYSA-N -1 1 339.313 4.277 20 0 EIADMM CC[C@@H](C)[C@H](C)[N@@H+](Cc1coc(-c2ccc(C(=O)[O-])cc2)n1)C1CC1 ZINC000567359167 1041245318 /nfs/dbraw/zinc/24/53/18/1041245318.db2.gz MEOSWMYEMVIALV-KGLIPLIRSA-N -1 1 342.439 4.439 20 0 EIADMM CC[C@@H](C)[C@@H](C)[N@@H+](Cc1coc(-c2ccc(C(=O)[O-])cc2)n1)C1CC1 ZINC000567359169 1041245455 /nfs/dbraw/zinc/24/54/55/1041245455.db2.gz MEOSWMYEMVIALV-ZIAGYGMSSA-N -1 1 342.439 4.439 20 0 EIADMM CC(=O)c1cc(F)c([N-]C(=O)c2cc(C)c(F)cc2F)c(F)c1F ZINC000461114141 1041245338 /nfs/dbraw/zinc/24/53/38/1041245338.db2.gz YVIGWENHKDXVGA-UHFFFAOYSA-N -1 1 343.251 4.145 20 0 EIADMM Cc1ccc(Oc2ccccc2[N-]S(=O)(=O)CCCCF)cc1 ZINC000436479176 1041264880 /nfs/dbraw/zinc/26/48/80/1041264880.db2.gz PLTLGMQLUFVVOC-UHFFFAOYSA-N -1 1 337.416 4.279 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1CC[C@H](c2ccccc2F)C1 ZINC000436482680 1041265916 /nfs/dbraw/zinc/26/59/16/1041265916.db2.gz BBRVXHMJNTUJEK-HNNXBMFYSA-N -1 1 335.378 4.314 20 0 EIADMM C=Cc1ccc(S(=O)(=O)[N-]c2ccc3cnn(C(C)C)c3c2)cc1 ZINC000436474838 1041272030 /nfs/dbraw/zinc/27/20/30/1041272030.db2.gz DXKCWLDRBLAFSJ-UHFFFAOYSA-N -1 1 341.436 4.061 20 0 EIADMM C=Cc1ccc(S(=O)(=O)[N-]c2ccc3nc(C)sc3c2)cc1 ZINC000436477641 1041276881 /nfs/dbraw/zinc/27/68/81/1041276881.db2.gz JMRAYTRGIXCHID-UHFFFAOYSA-N -1 1 330.434 4.049 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N1CCC[C@H]1Cc1cccc(F)c1 ZINC000436495355 1041280876 /nfs/dbraw/zinc/28/08/76/1041280876.db2.gz XZXRBAIZLNRQEQ-HNNXBMFYSA-N -1 1 333.790 4.032 20 0 EIADMM CC(C)CCC[C@H](NCc1ccc(-c2ccc(F)cc2)o1)C(=O)[O-] ZINC000904039405 1041293379 /nfs/dbraw/zinc/29/33/79/1041293379.db2.gz ZJRUWLYTSRVSGE-KRWDZBQOSA-N -1 1 333.403 4.455 20 0 EIADMM CCC(=O)Nc1ccc(C)c(NC(=O)c2ccc(C(C)C)cc2[O-])c1 ZINC000436524786 1041308448 /nfs/dbraw/zinc/30/84/48/1041308448.db2.gz BKDMRGRGLNTPOU-UHFFFAOYSA-N -1 1 340.423 4.425 20 0 EIADMM Cc1ccccc1[C@@H]1C[C@@H](C)N(C(=O)c2cc(Cl)ccc2[O-])C1 ZINC000436528926 1041312608 /nfs/dbraw/zinc/31/26/08/1041312608.db2.gz MYDXWDVEWPKZAJ-ZIAGYGMSSA-N -1 1 329.827 4.372 20 0 EIADMM Cc1ccccc1C[C@H]1CCCN1C(=O)c1ccc(Cl)cc1[O-] ZINC000436551649 1041326042 /nfs/dbraw/zinc/32/60/42/1041326042.db2.gz QIIZCFATSBFYDF-MRXNPFEDSA-N -1 1 329.827 4.201 20 0 EIADMM CCc1nc([C@@H](C)NC(=O)c2cc3ccccc3cc2[O-])cs1 ZINC000436554741 1041328282 /nfs/dbraw/zinc/32/82/82/1041328282.db2.gz LNVLFNSSJNBGRS-LLVKDONJSA-N -1 1 326.421 4.055 20 0 EIADMM CCN(C(=O)c1cc(Cl)ccc1[O-])[C@@H](C)Cc1ccc(OC)cc1 ZINC000436553672 1041328888 /nfs/dbraw/zinc/32/88/88/1041328888.db2.gz FYQWKUYXEPRVLW-ZDUSSCGKSA-N -1 1 347.842 4.148 20 0 EIADMM O=C(c1cc(Cl)ccc1[O-])N1C[C@H](c2ccccc2)[C@@H]2CCC[C@@H]21 ZINC000436552231 1041329087 /nfs/dbraw/zinc/32/90/87/1041329087.db2.gz BLOLUPPHNZXVHU-JQHSSLGASA-N -1 1 341.838 4.454 20 0 EIADMM C[C@@H](CC(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)c1ccc(F)cc1 ZINC000515994141 1041334227 /nfs/dbraw/zinc/33/42/27/1041334227.db2.gz CMJKQBKEHZZUTD-LBPRGKRZSA-N -1 1 339.370 4.054 20 0 EIADMM Cc1nc(-c2ccccc2)c(NC(=O)c2cc(F)ccc2[O-])s1 ZINC000436545595 1041338687 /nfs/dbraw/zinc/33/86/87/1041338687.db2.gz RVZQLFTUKGUKTC-UHFFFAOYSA-N -1 1 328.368 4.216 20 0 EIADMM C[C@H]1CN(C(=O)c2cc3ccccc3cc2[O-])[C@@H](c2ccccc2)CO1 ZINC000436575120 1041339216 /nfs/dbraw/zinc/33/92/16/1041339216.db2.gz NNSKGIGTOYMSKF-MGPUTAFESA-N -1 1 347.414 4.148 20 0 EIADMM C[C@@H]1CN(C(=O)c2cc(Cl)ccc2[O-])CC[C@@H]1c1ccccc1 ZINC000436592115 1041351234 /nfs/dbraw/zinc/35/12/34/1041351234.db2.gz ZOYZSBRDFWMXCX-CJNGLKHVSA-N -1 1 329.827 4.311 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1CC[C@H](Cc2ccccc2)C1 ZINC000436592706 1041352255 /nfs/dbraw/zinc/35/22/55/1041352255.db2.gz XZQALJFGSVTDBC-QGZVFWFLSA-N -1 1 331.415 4.250 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1CCc2ccc(F)c(F)c2C1 ZINC000436601912 1041369221 /nfs/dbraw/zinc/36/92/21/1041369221.db2.gz IMHFZZCTHRACIY-UHFFFAOYSA-N -1 1 339.341 4.022 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1CCc2ccc(F)c(F)c2C1 ZINC000436608356 1041371373 /nfs/dbraw/zinc/37/13/73/1041371373.db2.gz UJKSOWPVYQBOSN-UHFFFAOYSA-N -1 1 339.341 4.022 20 0 EIADMM O=C(Nc1ccc([C@H]2CCOC2)cc1)c1cc2ccccc2cc1[O-] ZINC000436696518 1041429591 /nfs/dbraw/zinc/42/95/91/1041429591.db2.gz HPQDXQLLQRTNKY-KRWDZBQOSA-N -1 1 333.387 4.302 20 0 EIADMM O=C(C(=O)N1CCCCC[C@H]1/C=C\c1ccccc1)c1ccc([O-])cc1 ZINC000436704461 1041433957 /nfs/dbraw/zinc/43/39/57/1041433957.db2.gz PBYMNVYKUDGSQV-XGCMIMOYSA-N -1 1 349.430 4.060 20 0 EIADMM O=C(NCC1(c2ccc(F)cc2F)CCCC1)c1ccc([O-])cc1F ZINC000436705515 1041435935 /nfs/dbraw/zinc/43/59/35/1041435935.db2.gz OVOUWZXHUVKEOT-UHFFFAOYSA-N -1 1 349.352 4.051 20 0 EIADMM C[C@@H]1CN(C(=O)c2ccc(Cl)cc2[O-])CC[C@@H]1c1ccccc1 ZINC000436718720 1041440843 /nfs/dbraw/zinc/44/08/43/1041440843.db2.gz LIDKMNXSXKEZCR-CJNGLKHVSA-N -1 1 329.827 4.311 20 0 EIADMM C[C@@H]1CN(C(=O)c2ccc(C(F)(F)F)cc2[O-])[C@@H]2CCCC[C@H]21 ZINC000436736009 1041446808 /nfs/dbraw/zinc/44/68/08/1041446808.db2.gz FJEPIBQKYWRXST-SCDSUCTJSA-N -1 1 327.346 4.062 20 0 EIADMM CC[C@]1(C(=O)[O-])CCCN(Cc2cc(Cl)cc(C(F)(F)F)c2)C1 ZINC000904399796 1041467570 /nfs/dbraw/zinc/46/75/70/1041467570.db2.gz BRGNGZRCGRRNNH-HNNXBMFYSA-N -1 1 349.780 4.436 20 0 EIADMM O=C(Nc1nccn1Cc1ccccc1)c1cc2ccccc2cc1[O-] ZINC000436804477 1041489037 /nfs/dbraw/zinc/48/90/37/1041489037.db2.gz BHYRTIAMAJPXEG-UHFFFAOYSA-N -1 1 343.386 4.043 20 0 EIADMM Cc1sc(CNC(=O)c2cc3ccccc3cc2[O-])nc1C(C)C ZINC000436842987 1041509468 /nfs/dbraw/zinc/50/94/68/1041509468.db2.gz YOPMCKVNZBGQKE-UHFFFAOYSA-N -1 1 340.448 4.364 20 0 EIADMM Cc1cccc([C@H]2CCN(C(=O)c3ccc4ccccc4c3[O-])C2)c1 ZINC000436847018 1041515790 /nfs/dbraw/zinc/51/57/90/1041515790.db2.gz DFSQAJWLWNWAGI-SFHVURJKSA-N -1 1 331.415 4.484 20 0 EIADMM CN(Cc1cc(F)c(F)c(F)c1)C(=O)c1cc2ccccc2cc1[O-] ZINC000436852332 1041517905 /nfs/dbraw/zinc/51/79/05/1041517905.db2.gz PDCXICRZZPCFCC-UHFFFAOYSA-N -1 1 345.320 4.235 20 0 EIADMM CC(C)COc1ccc(NC(=O)c2ccc([O-])cc2F)cc1Cl ZINC000436859386 1041520628 /nfs/dbraw/zinc/52/06/28/1041520628.db2.gz BHPJQRQNIPOFPA-UHFFFAOYSA-N -1 1 337.778 4.472 20 0 EIADMM O=C(NCc1ccccc1Oc1ccccc1)c1ccc([O-])cc1F ZINC000436872181 1041530232 /nfs/dbraw/zinc/53/02/32/1041530232.db2.gz SZGYDZQZIGSDDU-UHFFFAOYSA-N -1 1 337.350 4.254 20 0 EIADMM [O-]c1ccc(-c2noc(C3(Oc4ccccc4F)CC3)n2)c(Cl)c1 ZINC000436872446 1041531310 /nfs/dbraw/zinc/53/13/10/1041531310.db2.gz WOWQARYTQRZQJC-UHFFFAOYSA-N -1 1 346.745 4.303 20 0 EIADMM C[C@@H](c1cn(C)c2ccccc12)c1nc(-c2ccc([O-])cc2F)no1 ZINC000436874823 1041532671 /nfs/dbraw/zinc/53/26/71/1041532671.db2.gz RTSGYRLVFHEOML-NSHDSACASA-N -1 1 337.354 4.225 20 0 EIADMM CCOc1cc(-c2noc(C3(SC)CCC3)n2)cc(Cl)c1[O-] ZINC000436875873 1041533149 /nfs/dbraw/zinc/53/31/49/1041533149.db2.gz YVJQTZVSGYGOPE-UHFFFAOYSA-N -1 1 340.832 4.237 20 0 EIADMM CCOc1cc(-c2noc(C[C@@H]3C=CCCC3)n2)cc(Cl)c1[O-] ZINC000436874668 1041533213 /nfs/dbraw/zinc/53/32/13/1041533213.db2.gz AXWYJBGBDMAMAO-LLVKDONJSA-N -1 1 334.803 4.393 20 0 EIADMM O=C(N[C@H]1CC=C(c2ccc(F)cc2)CC1)c1ccc([O-])cc1F ZINC000436889134 1041543931 /nfs/dbraw/zinc/54/39/31/1041543931.db2.gz PMDBAGCSUFBPIC-HNNXBMFYSA-N -1 1 329.346 4.036 20 0 EIADMM [O-]c1ccc(F)cc1-c1nc(-c2ccc(OC(F)(F)F)cc2)no1 ZINC000436890183 1041544197 /nfs/dbraw/zinc/54/41/97/1041544197.db2.gz SBWXHJRKZHMVIH-UHFFFAOYSA-N -1 1 340.232 4.147 20 0 EIADMM COc1ccc(C(=O)Nc2cc(-c3cccnc3)ccc2C)c([O-])c1 ZINC000436898499 1041551992 /nfs/dbraw/zinc/55/19/92/1041551992.db2.gz YDVCKOIRJTUCPX-UHFFFAOYSA-N -1 1 334.375 4.024 20 0 EIADMM O=C(c1ccc(C(F)(F)F)cc1[O-])N(CC1CC1)CC1CCC1 ZINC000436925137 1041560837 /nfs/dbraw/zinc/56/08/37/1041560837.db2.gz GBNZCKNHPLUSSQ-UHFFFAOYSA-N -1 1 327.346 4.063 20 0 EIADMM Cc1ccccc1OCc1noc(-c2ccc3ccccc3c2[O-])n1 ZINC000436936270 1041565511 /nfs/dbraw/zinc/56/55/11/1041565511.db2.gz AMLCTWORKSRQQD-UHFFFAOYSA-N -1 1 332.359 4.483 20 0 EIADMM O=C(c1ccc(O)cc1[O-])N(Cc1ccco1)c1cccc(Cl)c1 ZINC000436942369 1041568112 /nfs/dbraw/zinc/56/81/12/1041568112.db2.gz HXVJBEWKGHKMRH-UHFFFAOYSA-N -1 1 343.766 4.191 20 0 EIADMM CCC[C@@H]1CCCCN1C(=O)c1cc(Cl)c([O-])c(OCC)c1 ZINC000436972702 1041578185 /nfs/dbraw/zinc/57/81/85/1041578185.db2.gz USPKLGIKNVHTIS-CYBMUJFWSA-N -1 1 325.836 4.239 20 0 EIADMM CCCOc1cccc([N-]S(=O)(=O)c2ccc3ccccc3c2)c1 ZINC000032599806 1041579369 /nfs/dbraw/zinc/57/93/69/1041579369.db2.gz LLQVEDYOYDCGRT-UHFFFAOYSA-N -1 1 341.432 4.429 20 0 EIADMM CN(C(=O)c1cc(Cl)ccc1[O-])[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000289013663 1041701215 /nfs/dbraw/zinc/70/12/15/1041701215.db2.gz VAKFDFHZPUFRHG-JGZJWPJOSA-N -1 1 335.753 4.239 20 0 EIADMM Cc1ccc2[nH]c(C(=O)Nc3ccc(-c4cc(=O)[nH][n-]4)cc3)cc2c1C ZINC000516705804 1041714355 /nfs/dbraw/zinc/71/43/55/1041714355.db2.gz CFDDPOBCZULANN-UHFFFAOYSA-N -1 1 346.390 4.133 20 0 EIADMM Cc1cc([N-]S(=O)(=O)c2ccc(Cl)cc2)c2cccnc2c1C ZINC000437335053 1041763557 /nfs/dbraw/zinc/76/35/57/1041763557.db2.gz USJJEHNXTUJCLR-UHFFFAOYSA-N -1 1 346.839 4.306 20 0 EIADMM O=C(Nc1nc(-c2ccccc2)cs1)c1c(F)ccc([O-])c1F ZINC000438781503 1042347034 /nfs/dbraw/zinc/34/70/34/1042347034.db2.gz AFSPDDHFIKSDQR-UHFFFAOYSA-N -1 1 332.331 4.046 20 0 EIADMM CC(C)CC[C@@H]1CCCN1C(=O)c1ccc(Br)c([O-])c1 ZINC000491992884 1042529152 /nfs/dbraw/zinc/52/91/52/1042529152.db2.gz AZOCBHMBVDLBEO-ZDUSSCGKSA-N -1 1 340.261 4.196 20 0 EIADMM CCCc1ccc(S(=O)(=O)[N-]c2cccc(C(F)F)c2)cc1 ZINC000509609792 1042689493 /nfs/dbraw/zinc/68/94/93/1042689493.db2.gz HYESSDXIEIDARP-UHFFFAOYSA-N -1 1 325.380 4.378 20 0 EIADMM CC(C)Oc1ccccc1CSc1nc(C(F)F)cc(=O)[n-]1 ZINC000518841073 1042718882 /nfs/dbraw/zinc/71/88/82/1042718882.db2.gz GKHCLVCLHLIOGJ-UHFFFAOYSA-N -1 1 326.368 4.199 20 0 EIADMM CC1(C)CN(C(=O)c2ccc(Cl)cc2[O-])CC[C@@H]1C(F)(F)F ZINC000190645068 1042873889 /nfs/dbraw/zinc/87/38/89/1042873889.db2.gz SGQCCAUAIHBPSU-LBPRGKRZSA-N -1 1 335.753 4.096 20 0 EIADMM O=C([O-])CC[C@@H](NCc1ccco1)c1ccc(Cl)c(Cl)c1 ZINC000417578763 1042891541 /nfs/dbraw/zinc/89/15/41/1042891541.db2.gz ZHAXFJCOYLRHHG-CQSZACIVSA-N -1 1 328.195 4.282 20 0 EIADMM O=C(Nc1ccc(F)cc1[O-])c1c[nH]c2cccc(Br)c21 ZINC000493946799 1042991134 /nfs/dbraw/zinc/99/11/34/1042991134.db2.gz LFVJBFUJOPLQHI-UHFFFAOYSA-N -1 1 349.159 4.027 20 0 EIADMM Cc1cc(Br)c([O-])c(NC(=O)c2ccc3cc[nH]c3c2)c1 ZINC000182924214 1043035941 /nfs/dbraw/zinc/03/59/41/1043035941.db2.gz VCSWZBFFNKQSET-UHFFFAOYSA-N -1 1 345.196 4.197 20 0 EIADMM Cc1cccc(S(=O)(=O)[N-]c2ccc(-c3ccncc3)c(C)c2)c1 ZINC000427637779 1043058207 /nfs/dbraw/zinc/05/82/07/1043058207.db2.gz QXXBVBODDWYNQA-UHFFFAOYSA-N -1 1 338.432 4.166 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@H]1C[C@@]12CCCc1ccccc12 ZINC000509153326 1043082227 /nfs/dbraw/zinc/08/22/27/1043082227.db2.gz GILRYDZOUHIQGL-DNVCBOLYSA-N -1 1 327.811 4.278 20 0 EIADMM CC1(C)Cc2nc([N-]c3ncnc4sccc43)sc2C(=O)C1 ZINC000163089034 1043086380 /nfs/dbraw/zinc/08/63/80/1043086380.db2.gz PWAWYKXKLLHBJZ-UHFFFAOYSA-N -1 1 330.438 4.047 20 0 EIADMM CCOc1cc(C(=O)Nc2ccc(O)c(Cl)c2)cc(Cl)c1[O-] ZINC000186901232 1043153986 /nfs/dbraw/zinc/15/39/86/1043153986.db2.gz AHLCFRCUHFVGLE-UHFFFAOYSA-N -1 1 342.178 4.056 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1cc(Oc2ccccc2)ccn1 ZINC000509167097 1043157170 /nfs/dbraw/zinc/15/71/70/1043157170.db2.gz LIKDEVLAXVDXKQ-UHFFFAOYSA-N -1 1 340.766 4.485 20 0 EIADMM COc1ccc([C@H](C)N(C)C(=O)c2cc3ccccc3cc2[O-])cc1 ZINC000219205554 1043201271 /nfs/dbraw/zinc/20/12/71/1043201271.db2.gz UPLDUTJPSBZWEZ-AWEZNQCLSA-N -1 1 335.403 4.387 20 0 EIADMM Cc1ccc(/C=C/S(=O)(=O)[N-]c2cccc3ccc(C)nc32)cc1 ZINC000727361344 1043205877 /nfs/dbraw/zinc/20/58/77/1043205877.db2.gz KLCYIRBJRBDWFT-OUKQBFOZSA-N -1 1 338.432 4.264 20 0 EIADMM Cc1ccc2ncccc2c1S(=O)(=O)[N-]c1cccc(Cl)c1C ZINC000673981656 1043233232 /nfs/dbraw/zinc/23/32/32/1043233232.db2.gz HUQMKSAJRBTPKC-UHFFFAOYSA-N -1 1 346.839 4.306 20 0 EIADMM CSc1ccc(S(=O)(=O)[N-]c2cccc(-n3cccc3)c2)cc1 ZINC000727720704 1043275690 /nfs/dbraw/zinc/27/56/90/1043275690.db2.gz VNDYEFJMJNZILR-UHFFFAOYSA-N -1 1 344.461 4.000 20 0 EIADMM Cc1noc(-c2ccccc2)c1[N-]C(=O)c1cc2nc(C)ccc2o1 ZINC000186725721 1043306266 /nfs/dbraw/zinc/30/62/66/1043306266.db2.gz UZWBKOJYZXMUEO-UHFFFAOYSA-N -1 1 333.347 4.352 20 0 EIADMM CC[C@H](CC(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)c1ccccc1 ZINC000508355050 1043382697 /nfs/dbraw/zinc/38/26/97/1043382697.db2.gz ODYQKHGMKOPXEV-CQSZACIVSA-N -1 1 335.407 4.305 20 0 EIADMM [O-]c1cccnc1-c1nc(-c2ccccc2OCc2ccccc2)no1 ZINC001212481077 1043435601 /nfs/dbraw/zinc/43/56/01/1043435601.db2.gz ZCFFZIFJJXLOBL-UHFFFAOYSA-N -1 1 345.358 4.083 20 0 EIADMM Cc1sc(Br)c(C(=O)Nc2ccc(F)cc2[O-])c1C ZINC000442564802 1043750301 /nfs/dbraw/zinc/75/03/01/1043750301.db2.gz FXDTXHXQIVGIDK-UHFFFAOYSA-N -1 1 344.205 4.224 20 0 EIADMM CSc1cc(O)ccc1[N-]C(=O)c1cc(-c2ccccc2)no1 ZINC000191168554 1043790760 /nfs/dbraw/zinc/79/07/60/1043790760.db2.gz MXTCXQVQEBYGDT-UHFFFAOYSA-N -1 1 326.377 4.021 20 0 EIADMM CCCOc1cc(C)ccc1NC(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC000442732860 1043818945 /nfs/dbraw/zinc/81/89/45/1043818945.db2.gz OCMAMNFORYIELR-UHFFFAOYSA-N -1 1 349.814 4.404 20 0 EIADMM CC[C@H]([N-]S(=O)(=O)c1cc(Cl)sc1Cl)C(C)(C)C ZINC000521557918 1043835961 /nfs/dbraw/zinc/83/59/61/1043835961.db2.gz YJFGRIRDMCUUCK-QMMMGPOBSA-N -1 1 330.302 4.158 20 0 EIADMM CCc1nc(SCc2cc(C(C)C)ccc2OC)[n-]c(=O)c1C ZINC000657264191 1043846480 /nfs/dbraw/zinc/84/64/80/1043846480.db2.gz IWEJYFJQILMDAG-UHFFFAOYSA-N -1 1 332.469 4.477 20 0 EIADMM COc1cc(C(=O)N(Cc2ccccc2C)C2CC2)cc(Cl)c1[O-] ZINC000442860041 1043864901 /nfs/dbraw/zinc/86/49/01/1043864901.db2.gz BAYZKOJQOULZHS-UHFFFAOYSA-N -1 1 345.826 4.167 20 0 EIADMM CCOC(=O)c1cnc(NC(=O)CC2CCC(C(C)(C)CC)CC2)[n-]1 ZINC001128846597 1043891965 /nfs/dbraw/zinc/89/19/65/1043891965.db2.gz FJNYUCJWDXEKSW-UHFFFAOYSA-N -1 1 349.475 4.158 20 0 EIADMM CCOC(=O)c1c[n-]c(NC(=O)CC2CCC(C(C)(C)CC)CC2)n1 ZINC001128846597 1043891972 /nfs/dbraw/zinc/89/19/72/1043891972.db2.gz FJNYUCJWDXEKSW-UHFFFAOYSA-N -1 1 349.475 4.158 20 0 EIADMM COc1cc(C(=O)NCCCCCc2ccccc2)cc(Cl)c1[O-] ZINC000442956893 1043906405 /nfs/dbraw/zinc/90/64/05/1043906405.db2.gz QSIUREKPEZFRPR-UHFFFAOYSA-N -1 1 347.842 4.197 20 0 EIADMM CCN(C(=O)c1cc(Cl)c([O-])c(OC)c1)[C@@H]1CCCC[C@H]1C ZINC000442966742 1043929382 /nfs/dbraw/zinc/92/93/82/1043929382.db2.gz NGVZAAAUCLYKPQ-BXUZGUMPSA-N -1 1 325.836 4.095 20 0 EIADMM CCC[C@@H](C)[C@H]1CCCN1C(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC000443042928 1043979433 /nfs/dbraw/zinc/97/94/33/1043979433.db2.gz CSLXPQVOBNNCJN-BXUZGUMPSA-N -1 1 325.836 4.095 20 0 EIADMM CCCC[C@@H](NC(=O)c1cc(Cl)c([O-])c(OC)c1)C1CCC1 ZINC000443055045 1043990539 /nfs/dbraw/zinc/99/05/39/1043990539.db2.gz VQWQYRHPIOEUHF-CQSZACIVSA-N -1 1 325.836 4.143 20 0 EIADMM COc1cc(C(=O)Nc2cc(C)cc3cccnc32)cc(Cl)c1[O-] ZINC000443114277 1044030028 /nfs/dbraw/zinc/03/00/28/1044030028.db2.gz KFCFIMVAAYXEJS-UHFFFAOYSA-N -1 1 342.782 4.163 20 0 EIADMM COc1cc(C(=O)Nc2ccc(C3CC3)c(C)c2)cc(Cl)c1[O-] ZINC000443114712 1044030350 /nfs/dbraw/zinc/03/03/50/1044030350.db2.gz WMHNOQWQYJWMCW-UHFFFAOYSA-N -1 1 331.799 4.492 20 0 EIADMM COc1cc(C(=O)Nc2ccc(-c3ccc[nH]3)cc2)cc(Cl)c1[O-] ZINC000443113487 1044040678 /nfs/dbraw/zinc/04/06/78/1044040678.db2.gz CLRUIKVHBYUKNY-UHFFFAOYSA-N -1 1 342.782 4.302 20 0 EIADMM COc1cc(C(=O)Nc2ccc(OC(C)C)c(C)c2)cc(Cl)c1[O-] ZINC000443272574 1044145671 /nfs/dbraw/zinc/14/56/71/1044145671.db2.gz KSBSLWLHLKAJNT-UHFFFAOYSA-N -1 1 349.814 4.402 20 0 EIADMM CCCCOc1ccccc1NC(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC000443308723 1044169781 /nfs/dbraw/zinc/16/97/81/1044169781.db2.gz FRZXKRZHUUCEEK-UHFFFAOYSA-N -1 1 349.814 4.485 20 0 EIADMM CC[C@@H](C)Oc1ccc(NC(=O)c2cc(Cl)c([O-])c(OC)c2)cc1 ZINC000443317476 1044178620 /nfs/dbraw/zinc/17/86/20/1044178620.db2.gz XUZYZFLNAXBZTR-LLVKDONJSA-N -1 1 349.814 4.484 20 0 EIADMM CCCCCC[C@@H](C)C(=O)Nc1nc(Br)ccc1[O-] ZINC001154597125 1044461245 /nfs/dbraw/zinc/46/12/45/1044461245.db2.gz ABDZFUNDXDRLMQ-SNVBAGLBSA-N -1 1 329.238 4.095 20 0 EIADMM CSc1cccc(S(=O)(=O)[N-]c2ccc(C)c3ncccc23)c1 ZINC000509254419 1044861253 /nfs/dbraw/zinc/86/12/53/1044861253.db2.gz KZUHFBKPLQJILK-UHFFFAOYSA-N -1 1 344.461 4.066 20 0 EIADMM O=S(=O)([N-]c1cc(C2CCCC2)n[nH]1)c1ccc2ccccc2c1 ZINC000474428097 1044978362 /nfs/dbraw/zinc/97/83/62/1044978362.db2.gz CIDXSNLFJSJBES-UHFFFAOYSA-N -1 1 341.436 4.021 20 0 EIADMM CCN(Cc1c(F)cccc1F)C(=O)c1cc2ccccc2cc1[O-] ZINC000624995881 1045002623 /nfs/dbraw/zinc/00/26/23/1045002623.db2.gz WRKPNKLXHBXOJC-UHFFFAOYSA-N -1 1 341.357 4.486 20 0 EIADMM CCc1cccc(CC)c1[N-]S(=O)(=O)c1cccc(SC)c1 ZINC000509086743 1045091848 /nfs/dbraw/zinc/09/18/48/1045091848.db2.gz YSTZKWCALRMQPY-UHFFFAOYSA-N -1 1 335.494 4.334 20 0 EIADMM CSc1cccc(S(=O)(=O)[N-]c2cccc(Cl)c2C)c1 ZINC000509101957 1045128696 /nfs/dbraw/zinc/12/86/96/1045128696.db2.gz CLQQYQJTKMJBMI-UHFFFAOYSA-N -1 1 327.858 4.171 20 0 EIADMM Cc1nc(-c2cccc(NC(=O)c3c(F)ccc([O-])c3F)c2)cs1 ZINC000347925176 1045171111 /nfs/dbraw/zinc/17/11/11/1045171111.db2.gz GRNBXXMTHCVIFB-UHFFFAOYSA-N -1 1 346.358 4.355 20 0 EIADMM Cc1cc(NC(=O)c2ccc([O-])cc2F)cc(C)c1Br ZINC000235896467 1045344634 /nfs/dbraw/zinc/34/46/34/1045344634.db2.gz DVUVYFDNIBCFRJ-UHFFFAOYSA-N -1 1 338.176 4.163 20 0 EIADMM O=S(=O)([N-]c1cccc(O)c1)c1ccc(C2CCCCC2)cc1 ZINC000026844945 1045499609 /nfs/dbraw/zinc/49/96/09/1045499609.db2.gz PXMNCWCHMQRVEP-UHFFFAOYSA-N -1 1 331.437 4.241 20 0 EIADMM O=C(CCOc1cccc(Cl)c1)Nc1ccc([O-])c(Cl)c1 ZINC000533540649 1045557508 /nfs/dbraw/zinc/55/75/08/1045557508.db2.gz RTWLHCFUWZZLLJ-UHFFFAOYSA-N -1 1 326.179 4.107 20 0 EIADMM CC(C)(C)OC(=O)Nc1ccc(C(=O)Nc2ccc(F)cc2[O-])cc1 ZINC000768257568 1045766670 /nfs/dbraw/zinc/76/66/70/1045766670.db2.gz FOQJDFXHCWMYQC-UHFFFAOYSA-N -1 1 346.358 4.131 20 0 EIADMM O=C(c1c([O-])cccc1Cl)N1CCC[C@H]1Cc1ccc(F)cc1 ZINC000769715157 1046053097 /nfs/dbraw/zinc/05/30/97/1046053097.db2.gz VHCKQSPSLGIDKI-AWEZNQCLSA-N -1 1 333.790 4.032 20 0 EIADMM O=C(c1c([O-])cccc1Cl)N1CCC[C@@H]1c1ccc(F)c(F)c1 ZINC000769832317 1046089806 /nfs/dbraw/zinc/08/98/06/1046089806.db2.gz QCCLBURLBRJXAO-CQSZACIVSA-N -1 1 337.753 4.301 20 0 EIADMM COc1ccc(C2CCN(C(=O)c3c([O-])cccc3Cl)CC2)cc1 ZINC000769935629 1046116588 /nfs/dbraw/zinc/11/65/88/1046116588.db2.gz RYTFJJRMNBXXKD-UHFFFAOYSA-N -1 1 345.826 4.074 20 0 EIADMM [O-]c1cccc(CNCc2cc(Br)ccc2F)c1Cl ZINC000328462204 1046132194 /nfs/dbraw/zinc/13/21/94/1046132194.db2.gz KCSGDSBAYVPYLU-UHFFFAOYSA-N -1 1 344.611 4.237 20 0 EIADMM C[C@@H]1[C@@H](Cc2ccccc2)CCN1C(=O)c1c([O-])cccc1Cl ZINC000746693141 1047028628 /nfs/dbraw/zinc/02/86/28/1047028628.db2.gz BRBQGNWRNYNFAY-UKRRQHHQSA-N -1 1 329.827 4.139 20 0 EIADMM CC(=C([O-])Nc1nc(-c2ccccc2Cl)ns1)c1ccccc1 ZINC000476026989 1047065180 /nfs/dbraw/zinc/06/51/80/1047065180.db2.gz SZMRNERINKSZRD-NSHDSACASA-N -1 1 343.839 4.023 20 0 EIADMM Cc1cnc(C(=O)N2CCC[C@H]2c2cccc3ccccc32)c([O-])c1 ZINC000460186621 1047148982 /nfs/dbraw/zinc/14/89/82/1047148982.db2.gz GJHUWRBYXUNQAQ-SFHVURJKSA-N -1 1 332.403 4.226 20 0 EIADMM COc1cc(C(=O)N[C@@H](C)C(C)(C)c2ccccc2)cc(Cl)c1[O-] ZINC000460188664 1047170543 /nfs/dbraw/zinc/17/05/43/1047170543.db2.gz ULHJZGPEIPTLDG-LBPRGKRZSA-N -1 1 347.842 4.150 20 0 EIADMM COC(=O)c1c[n-]c(SCc2cccc(SC(F)(F)F)c2)n1 ZINC000788504245 1047207441 /nfs/dbraw/zinc/20/74/41/1047207441.db2.gz CWJKKPQZGDSVCR-UHFFFAOYSA-N -1 1 348.371 4.101 20 0 EIADMM CCc1cc2c(CNc3ccc(Cl)c(F)c3)cc(=O)oc2cc1[O-] ZINC000917935701 1047223988 /nfs/dbraw/zinc/22/39/88/1047223988.db2.gz MEJRWJDJNCBSNO-UHFFFAOYSA-N -1 1 347.773 4.466 20 0 EIADMM Cc1onc(-c2cccc(F)c2)c1C(=O)Nc1cc(F)cc(F)c1[O-] ZINC001142546316 1047599975 /nfs/dbraw/zinc/59/99/75/1047599975.db2.gz VTJFBLWUZWLAFX-UHFFFAOYSA-N -1 1 348.280 4.025 20 0 EIADMM O=C(Nc1cc(C2CCCC2)[nH]n1)c1ccc(C(F)(F)F)c([O-])c1 ZINC001136941223 1047960351 /nfs/dbraw/zinc/96/03/51/1047960351.db2.gz KZNJDZWAGVSVQM-UHFFFAOYSA-N -1 1 339.317 4.044 20 0 EIADMM Cc1cc(C[N-]C(=O)C(F)(F)F)cc(N[C@H](C)c2ccccc2)c1 ZINC000825011692 1048009385 /nfs/dbraw/zinc/00/93/85/1048009385.db2.gz TUKGKACFJIWXGU-CYBMUJFWSA-N -1 1 336.357 4.347 20 0 EIADMM CC[C@H]([N-]C(=O)C(F)(F)c1cccc(Cl)c1Cl)c1ncc[nH]1 ZINC000843855886 1048128089 /nfs/dbraw/zinc/12/80/89/1048128089.db2.gz BECRCIPSOGEDHU-JTQLQIEISA-N -1 1 348.180 4.076 20 0 EIADMM O=C(Nc1c([O-])cc(Br)cc1Cl)C(F)=C1CCC1 ZINC000843886358 1048137449 /nfs/dbraw/zinc/13/74/49/1048137449.db2.gz PRWMXJCMDUFMFA-UHFFFAOYSA-N -1 1 334.572 4.154 20 0 EIADMM CCOc1cc(-c2noc(-c3ncoc3C(C)C)n2)cc(Cl)c1[O-] ZINC000809466436 1048362344 /nfs/dbraw/zinc/36/23/44/1048362344.db2.gz QESCIWAYHWCUOU-UHFFFAOYSA-N -1 1 349.774 4.273 20 0 EIADMM CN(Cc1c(F)cccc1Cl)C(=O)c1c([O-])cccc1Cl ZINC000920426932 1048672196 /nfs/dbraw/zinc/67/21/96/1048672196.db2.gz KAHITFDROGKEQO-UHFFFAOYSA-N -1 1 328.170 4.110 20 0 EIADMM CC(C)Oc1cccc([C@@H](C)NC(=O)c2c([O-])cccc2Cl)c1 ZINC000920451415 1048677397 /nfs/dbraw/zinc/67/73/97/1048677397.db2.gz DAMVSMZCAXPVHW-GFCCVEGCSA-N -1 1 333.815 4.324 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N1CC[C@@H](CSc2ccccc2)C1 ZINC000075200037 1048701287 /nfs/dbraw/zinc/70/12/87/1048701287.db2.gz YIMHYNHSFQLKKH-CYBMUJFWSA-N -1 1 347.867 4.300 20 0 EIADMM O=C(NCCc1ccc(C(F)(F)F)cc1)c1ccc(Cl)cc1[O-] ZINC001135425124 1048710255 /nfs/dbraw/zinc/71/02/55/1048710255.db2.gz XZKCWHLCNRQYCG-UHFFFAOYSA-N -1 1 343.732 4.037 20 0 EIADMM [O-]c1cc(F)c(CN2CC[C@H](c3ccccc3)C(F)(F)C2)cc1F ZINC001144663618 1048780265 /nfs/dbraw/zinc/78/02/65/1048780265.db2.gz HRULSJGOFFOHTA-CQSZACIVSA-N -1 1 339.332 4.295 20 0 EIADMM O=c1cc(CN2CC[C@H]2c2ccc(Cl)cc2)c2ccc([O-])cc2o1 ZINC000747620075 1048832595 /nfs/dbraw/zinc/83/25/95/1048832595.db2.gz VADQEKQDRSAWSM-KRWDZBQOSA-N -1 1 341.794 4.099 20 0 EIADMM Cc1ccc(CCC2CCN(C(=O)c3cccc([O-])c3F)CC2)cc1 ZINC001135908800 1048957462 /nfs/dbraw/zinc/95/74/62/1048957462.db2.gz OFVKMVJQAHJLPJ-UHFFFAOYSA-N -1 1 341.426 4.325 20 0 EIADMM C[C@H](c1ccc(F)c(F)c1)N(C)C(=O)c1ncc2ccccc2c1[O-] ZINC001135937401 1048999046 /nfs/dbraw/zinc/99/90/46/1048999046.db2.gz NZWLBVZXNKIQHU-LLVKDONJSA-N -1 1 342.345 4.052 20 0 EIADMM COc1ccc([C@@H]2CCCCCN2C(=O)c2cccc([O-])c2F)cc1 ZINC001136102774 1049085317 /nfs/dbraw/zinc/08/53/17/1049085317.db2.gz GKGSCQJTZXUQHB-KRWDZBQOSA-N -1 1 343.398 4.297 20 0 EIADMM CC(C)(C)O[C@@H](C(=O)Nc1cc([O-])c(F)cc1F)c1ccccc1 ZINC000818033559 1049085426 /nfs/dbraw/zinc/08/54/26/1049085426.db2.gz LZQGSBADUJCBAE-MRXNPFEDSA-N -1 1 335.350 4.165 20 0 EIADMM COc1cc(C)c(C)cc1NC(=O)c1ccc2ccc(O)cc2c1[O-] ZINC001147064709 1049086504 /nfs/dbraw/zinc/08/65/04/1049086504.db2.gz IQPZHTUHQHBXOH-UHFFFAOYSA-N -1 1 337.375 4.129 20 0 EIADMM CC[C@]1(C)CCCN(C(=O)c2cc(-c3ccc(C=O)o3)ccc2[O-])C1 ZINC001147873312 1049233964 /nfs/dbraw/zinc/23/39/64/1049233964.db2.gz FPAIHTPHHPMZJN-HXUWFJFHSA-N -1 1 341.407 4.117 20 0 EIADMM O=C(CCC1CCCCCC1)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC001136190721 1049269325 /nfs/dbraw/zinc/26/93/25/1049269325.db2.gz NNDCTUOHPUDNDA-UHFFFAOYSA-N -1 1 327.428 4.471 20 0 EIADMM CC(=O)Nc1cccc(NC(=O)c2ccc3ccccc3c2[O-])c1C ZINC000078868760 1049295008 /nfs/dbraw/zinc/29/50/08/1049295008.db2.gz APQKLKJUWCCTQC-UHFFFAOYSA-N -1 1 334.375 4.065 20 0 EIADMM CCO[C@@H]1C[C@H](NC(=O)c2cc3ccccc3cc2[O-])C1(CC)CC ZINC001148354794 1049305745 /nfs/dbraw/zinc/30/57/45/1049305745.db2.gz JQPBETNWPCGGES-RBUKOAKNSA-N -1 1 341.451 4.259 20 0 EIADMM O=C(/C=C\c1ccco1)Nc1c([O-])cc(Br)cc1Cl ZINC000819786899 1049377702 /nfs/dbraw/zinc/37/77/02/1049377702.db2.gz GMBAXTSWIWWYDD-ARJAWSKDSA-N -1 1 342.576 4.053 20 0 EIADMM Cc1ccc([C@@H](C)NC(=O)c2cccc(-c3ccccc3)c2[O-])nc1 ZINC001148873009 1049394215 /nfs/dbraw/zinc/39/42/15/1049394215.db2.gz PNJGBGNSDCETGZ-OAHLLOKOSA-N -1 1 332.403 4.254 20 0 EIADMM CSc1ccc([O-])c(C(=O)Nc2cc(Cl)c(N)c(Cl)c2)c1 ZINC001136349413 1049522073 /nfs/dbraw/zinc/52/20/73/1049522073.db2.gz VOZCOZFBZXZOOQ-UHFFFAOYSA-N -1 1 343.235 4.255 20 0 EIADMM O=C(N[C@@H](c1ccccc1)[C@@H]1CCCO1)c1ccc2ccccc2c1[O-] ZINC001136524622 1049715634 /nfs/dbraw/zinc/71/56/34/1049715634.db2.gz IREJJLYPLXWCIE-PMACEKPBSA-N -1 1 347.414 4.196 20 0 EIADMM O=C(Nc1ccc([O-])c(F)c1F)c1ccc(N2CCCCCC2)cc1 ZINC000821980038 1049715731 /nfs/dbraw/zinc/71/57/31/1049715731.db2.gz DBWNQXDVNRTPIZ-UHFFFAOYSA-N -1 1 346.377 4.303 20 0 EIADMM COc1cc(C2(C(=O)Nc3cccc(F)c3[O-])CCCC2)ccc1C ZINC001171632870 1049763494 /nfs/dbraw/zinc/76/34/94/1049763494.db2.gz URLJDIXMNJEWLM-UHFFFAOYSA-N -1 1 343.398 4.299 20 0 EIADMM C[C@H](Oc1ccc2ccccc2c1)C(=O)Nc1cccc(F)c1[O-] ZINC001171637524 1049779244 /nfs/dbraw/zinc/77/92/44/1049779244.db2.gz NCKGELMNBCHHRI-LBPRGKRZSA-N -1 1 325.339 4.091 20 0 EIADMM COc1ccc2oc([C@H](C)NC(=O)c3ccc(F)c([O-])c3)c(C)c2c1 ZINC001136686961 1049829522 /nfs/dbraw/zinc/82/95/22/1049829522.db2.gz VBMQQPJURYGWCZ-NSHDSACASA-N -1 1 343.354 4.086 20 0 EIADMM CC[C@@H](C)[C@H](C)N(C(=O)c1ccc2ccc(O)cc2c1[O-])C1CC1 ZINC001136714623 1049843918 /nfs/dbraw/zinc/84/39/18/1049843918.db2.gz RMYPVGXZOVBJNR-OLZOCXBDSA-N -1 1 327.424 4.290 20 0 EIADMM Cc1c(=O)[n-]n(-c2ccccc2)c1N[C@H]1CSc2ccccc2C1 ZINC001172195178 1049868856 /nfs/dbraw/zinc/86/88/56/1049868856.db2.gz ZQKPWLTUCZXFNY-OAHLLOKOSA-N -1 1 337.448 4.015 20 0 EIADMM C[C@H](Oc1cccc(Cl)c1)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000082194495 1049871794 /nfs/dbraw/zinc/87/17/94/1049871794.db2.gz CONIDFKESARQCW-VIFPVBQESA-N -1 1 326.179 4.105 20 0 EIADMM CCCCC[C@H](NC)c1nc(-c2ccc3[n-]c(=S)sc3c2)no1 ZINC001212281317 1049876206 /nfs/dbraw/zinc/87/62/06/1049876206.db2.gz SENCGCBQWUJUCV-LBPRGKRZSA-N -1 1 348.497 4.476 20 0 EIADMM CCS(=O)(=O)c1ccc([O-])c(Nc2ccc(C(C)(F)F)cc2)c1 ZINC001212675123 1049956972 /nfs/dbraw/zinc/95/69/72/1049956972.db2.gz HEYYPOAYFCOXNA-UHFFFAOYSA-N -1 1 341.379 4.041 20 0 EIADMM Cc1nc([C@@H](C)[N@H+]2CCC[C@H](C(=O)[O-])C2)oc1-c1ccc(Cl)cc1 ZINC000263582062 1050090562 /nfs/dbraw/zinc/09/05/62/1050090562.db2.gz YAYBINXBGRKHAM-OCCSQVGLSA-N -1 1 348.830 4.161 20 0 EIADMM Cc1ccc(OC(C)C)cc1[N-]S(=O)(=O)c1cccc(F)c1C ZINC001185836778 1050168518 /nfs/dbraw/zinc/16/85/18/1050168518.db2.gz WYUXPUZBQLUYKE-UHFFFAOYSA-N -1 1 337.416 4.031 20 0 EIADMM O=C(Nc1cccc(C(F)(F)F)c1[O-])[C@H]1C[C@@H]1c1cccs1 ZINC001177543980 1050249532 /nfs/dbraw/zinc/24/95/32/1050249532.db2.gz FBDSSFDKXALMNI-IUCAKERBSA-N -1 1 327.327 4.215 20 0 EIADMM CC(CNC(=O)c1ccc([O-])cc1F)(c1ccccc1)c1ccccc1 ZINC001186337735 1050302892 /nfs/dbraw/zinc/30/28/92/1050302892.db2.gz RSHIHFCUADONJB-UHFFFAOYSA-N -1 1 349.405 4.267 20 0 EIADMM [O-]c1ccc(-c2noc(CSCc3ccc(F)cc3)n2)c(F)c1 ZINC000618417148 1050371480 /nfs/dbraw/zinc/37/14/80/1050371480.db2.gz AYQYMSVUINGAQN-UHFFFAOYSA-N -1 1 334.347 4.154 20 0 EIADMM O=C(NCc1ccc(C(F)(F)F)cc1)Nc1cc([O-])c(F)cc1F ZINC001186815738 1050425459 /nfs/dbraw/zinc/42/54/59/1050425459.db2.gz IEESZLSMPTVFOR-UHFFFAOYSA-N -1 1 346.255 4.011 20 0 EIADMM [O-]c1cnccc1-c1nc(-c2cc(C(F)(F)F)ccc2Cl)no1 ZINC001212721462 1050434359 /nfs/dbraw/zinc/43/43/59/1050434359.db2.gz RRNPXWOKTNHTGC-UHFFFAOYSA-N -1 1 341.676 4.176 20 0 EIADMM Cc1ncoc1-c1ccc(NC(=O)Cc2ccc([O-])c(Cl)c2)cc1 ZINC001178330107 1050436066 /nfs/dbraw/zinc/43/60/66/1050436066.db2.gz NEZSFBZRXGIRSU-UHFFFAOYSA-N -1 1 342.782 4.190 20 0 EIADMM Cc1nocc1Nc1cccc(C([O-])(C(F)(F)F)C(F)(F)F)c1 ZINC001212724796 1050448156 /nfs/dbraw/zinc/44/81/56/1050448156.db2.gz BHBPXJRZZYAZGL-UHFFFAOYSA-N -1 1 340.223 4.039 20 0 EIADMM Cc1cc(C(=O)N(C)C)ccc1Nc1c(Cl)ccc([O-])c1Cl ZINC001212732368 1050471770 /nfs/dbraw/zinc/47/17/70/1050471770.db2.gz OFRCZMOMYCLEKB-UHFFFAOYSA-N -1 1 339.222 4.453 20 0 EIADMM CC[C@H](C)C[C@H](C)[N-]S(=O)(=O)c1ccc(Cl)c(F)c1Cl ZINC001187372834 1050528884 /nfs/dbraw/zinc/52/88/84/1050528884.db2.gz FENTVBVCVRDLSV-IUCAKERBSA-N -1 1 342.263 4.236 20 0 EIADMM COC(=O)c1cc(Br)c([O-])c(NC=Cc2ccccc2)c1 ZINC001173874134 1050596530 /nfs/dbraw/zinc/59/65/30/1050596530.db2.gz OBIKWAXNIDJHDT-BQYQJAHWSA-N -1 1 348.196 4.024 20 0 EIADMM COc1ccc(F)cc1Nc1ccc(F)c(Br)c1[O-] ZINC001173957633 1050644779 /nfs/dbraw/zinc/64/47/79/1050644779.db2.gz QAXFTYOYUIJNGE-UHFFFAOYSA-N -1 1 330.128 4.185 20 0 EIADMM O=C(N[C@@H]1CCC[C@H](c2ccccc2)CC1)c1cc(F)ccc1[O-] ZINC001179337231 1050676906 /nfs/dbraw/zinc/67/69/06/1050676906.db2.gz ZEJZNHYUGVBTCV-DOTOQJQBSA-N -1 1 327.399 4.378 20 0 EIADMM O=C(Nc1cc(F)c([O-])cc1Cl)C1CC(c2ccc(F)cc2)C1 ZINC001179659830 1050739770 /nfs/dbraw/zinc/73/97/70/1050739770.db2.gz HBXAPIWQQINSQC-UHFFFAOYSA-N -1 1 337.753 4.456 20 0 EIADMM O=C(Nc1cc(F)c([O-])cc1Cl)[C@@H]1SCCc2sccc21 ZINC001179660272 1050740179 /nfs/dbraw/zinc/74/01/79/1050740179.db2.gz NSDCDHONAYNVSL-CYBMUJFWSA-N -1 1 343.832 4.215 20 0 EIADMM COc1ccc(Nc2ccc(F)c(Br)c2[O-])c(F)c1 ZINC001174146781 1050787535 /nfs/dbraw/zinc/78/75/35/1050787535.db2.gz TWKOZCZEWIDEDL-UHFFFAOYSA-N -1 1 330.128 4.185 20 0 EIADMM CC1CCN(C(=O)c2cccc(Nc3ccnc(Cl)c3[O-])c2)CC1 ZINC001174204029 1050839003 /nfs/dbraw/zinc/83/90/03/1050839003.db2.gz NYDRQGRZHIYCSR-UHFFFAOYSA-N -1 1 345.830 4.056 20 0 EIADMM O=C(Nc1ccccc1)c1cccc([N-]c2nnc(-c3ccco3)o2)c1 ZINC001174204595 1050840044 /nfs/dbraw/zinc/84/00/44/1050840044.db2.gz JNSKEPNKODFTKZ-UHFFFAOYSA-N -1 1 346.346 4.326 20 0 EIADMM CCCn1cc(Nc2cc(Br)cc(Cl)c2[O-])cn1 ZINC001174223254 1050852263 /nfs/dbraw/zinc/85/22/63/1050852263.db2.gz WGQFQSRMVKRCQH-UHFFFAOYSA-N -1 1 330.613 4.158 20 0 EIADMM CC(=O)NCc1ccc(Nc2cc(Cl)cc(Cl)c2[O-])cc1 ZINC001174232069 1050857317 /nfs/dbraw/zinc/85/73/17/1050857317.db2.gz WZMVOQGHNXWCAN-UHFFFAOYSA-N -1 1 325.195 4.079 20 0 EIADMM Cc1c(F)cccc1NC(=O)Nc1cccc([O-])c1Br ZINC001189061874 1050897800 /nfs/dbraw/zinc/89/78/00/1050897800.db2.gz WUQJJTWCJVTJFK-UHFFFAOYSA-N -1 1 339.164 4.246 20 0 EIADMM Cc1nc(SCC(=O)c2c(Cl)cccc2Cl)[n-]c(=O)c1C ZINC001189061332 1050898026 /nfs/dbraw/zinc/89/80/26/1050898026.db2.gz OLNUDVPGVKPVKA-UHFFFAOYSA-N -1 1 343.235 4.081 20 0 EIADMM O=c1ccn(-c2ccc(Nc3ccc(C(F)(F)F)cc3F)cc2)[n-]1 ZINC001174400817 1050920263 /nfs/dbraw/zinc/92/02/63/1050920263.db2.gz RJLYQCHIDDWOHN-UHFFFAOYSA-N -1 1 337.276 4.479 20 0 EIADMM CC(=O)c1cccc(S(=O)(=O)[N-]c2c(C)ccc3ccccc32)c1 ZINC001189188935 1050921242 /nfs/dbraw/zinc/92/12/42/1050921242.db2.gz WXHFTMLDSMOTEP-UHFFFAOYSA-N -1 1 339.416 4.152 20 0 EIADMM CC(C)(C)[C@@H]1CCC[C@H]([N-]S(=O)(=O)c2cc(F)ccc2F)CC1 ZINC001189289492 1050948491 /nfs/dbraw/zinc/94/84/91/1050948491.db2.gz OLTXCRUHWSBHGI-OCCSQVGLSA-N -1 1 345.455 4.238 20 0 EIADMM Cc1cc([N-]S(=O)(=O)c2ccc(F)c3ccccc32)ccc1F ZINC001189348387 1050977052 /nfs/dbraw/zinc/97/70/52/1050977052.db2.gz PJOHQSDYRXALEL-UHFFFAOYSA-N -1 1 333.359 4.227 20 0 EIADMM O=c1oc2cc([O-])ccc2cc1Nc1cc(F)ccc1C(F)(F)F ZINC001174484467 1050992501 /nfs/dbraw/zinc/99/25/01/1050992501.db2.gz GSSYKLMIPGJIFJ-UHFFFAOYSA-N -1 1 339.244 4.400 20 0 EIADMM Cc1ccccc1O[C@H](C)C(=O)Nc1cccc(C(F)(F)F)c1[O-] ZINC001180520979 1051015015 /nfs/dbraw/zinc/01/50/15/1051015015.db2.gz BXZOLAFAAZXJMC-LLVKDONJSA-N -1 1 339.313 4.125 20 0 EIADMM [O-]c1c(Cl)cc(Br)cc1Nc1cnc(C2CC2)nc1 ZINC001174618287 1051086469 /nfs/dbraw/zinc/08/64/69/1051086469.db2.gz RUPOBHFLPKTQLS-UHFFFAOYSA-N -1 1 340.608 4.219 20 0 EIADMM O=C(NCc1ccc(Cl)cc1Cl)Nc1cc(Cl)ncc1[O-] ZINC001190070148 1051117766 /nfs/dbraw/zinc/11/77/66/1051117766.db2.gz UYKMFPQGVDPEIG-UHFFFAOYSA-N -1 1 346.601 4.069 20 0 EIADMM O=C(Cc1cc2ccccc2o1)Nc1cccc(C(F)(F)F)c1[O-] ZINC001181101539 1051148842 /nfs/dbraw/zinc/14/88/42/1051148842.db2.gz ZBDOAPXJLBUGHS-UHFFFAOYSA-N -1 1 335.281 4.338 20 0 EIADMM [O-]c1c(Br)ccc(Cl)c1Nc1ccc(O)c(F)c1 ZINC001174740156 1051157994 /nfs/dbraw/zinc/15/79/94/1051157994.db2.gz IWFPWMQOXDCUPE-UHFFFAOYSA-N -1 1 332.556 4.396 20 0 EIADMM Cc1cc(CC(C)C)ncc1[N-]S(=O)(=O)c1ccc(C2CC2)cc1 ZINC001190480890 1051185897 /nfs/dbraw/zinc/18/58/97/1051185897.db2.gz RRLJFLNUJSTNAV-UHFFFAOYSA-N -1 1 344.480 4.267 20 0 EIADMM CCC(C)(C)c1ccc(S(=O)(=O)[N-]c2cc(C)cc(O)c2)cc1 ZINC001190448469 1051189500 /nfs/dbraw/zinc/18/95/00/1051189500.db2.gz RUQCKMVCESNDGF-UHFFFAOYSA-N -1 1 333.453 4.189 20 0 EIADMM COc1ccc(Nc2ccc(F)c(Br)c2[O-])cc1C ZINC001174834730 1051194826 /nfs/dbraw/zinc/19/48/26/1051194826.db2.gz KTGFNIQZWYIKOP-UHFFFAOYSA-N -1 1 326.165 4.354 20 0 EIADMM O=S(=O)([N-]c1ccc(Cl)c(F)c1)c1ccc(C2CC2)cc1 ZINC001190500510 1051196555 /nfs/dbraw/zinc/19/65/55/1051196555.db2.gz QBTMRIMUGIZYDD-UHFFFAOYSA-N -1 1 325.792 4.157 20 0 EIADMM [O-]c1c(Br)ccc(Cl)c1Nc1ccc2c(c1)OCO2 ZINC001174868766 1051224869 /nfs/dbraw/zinc/22/48/69/1051224869.db2.gz GHHOHBSCVNKDBJ-UHFFFAOYSA-N -1 1 342.576 4.280 20 0 EIADMM CCS(=O)(=O)c1ccc([O-])c(Nc2ccc3ccccc3c2)c1 ZINC001174876661 1051227890 /nfs/dbraw/zinc/22/78/90/1051227890.db2.gz MZOGCGXIVOGXAC-UHFFFAOYSA-N -1 1 327.405 4.083 20 0 EIADMM O=C(Nc1cccc(F)c1[O-])Nc1ccccc1OC(F)(F)F ZINC001190684069 1051255787 /nfs/dbraw/zinc/25/57/87/1051255787.db2.gz QJCTXMILFRWQPN-UHFFFAOYSA-N -1 1 330.237 4.074 20 0 EIADMM O=C(Nc1ccccc1OC(F)(F)F)Nc1c(F)cc([O-])cc1F ZINC001190685696 1051257972 /nfs/dbraw/zinc/25/79/72/1051257972.db2.gz GGUZLSQQSQGDPW-UHFFFAOYSA-N -1 1 348.227 4.213 20 0 EIADMM COc1cc(Nc2ccc(F)c(Br)c2[O-])ccc1C ZINC001175017804 1051296531 /nfs/dbraw/zinc/29/65/31/1051296531.db2.gz GWSICDRLSJYPFC-UHFFFAOYSA-N -1 1 326.165 4.354 20 0 EIADMM [O-]c1cc(F)c(Nc2ncc(Br)cc2F)cc1Cl ZINC001250020984 1051304954 /nfs/dbraw/zinc/30/49/54/1051304954.db2.gz VPNSEXKBZYNOQD-UHFFFAOYSA-N -1 1 335.535 4.225 20 0 EIADMM Cc1ccc(Nc2cc(Cl)c([O-])cc2F)c(Br)n1 ZINC001250020742 1051309780 /nfs/dbraw/zinc/30/97/80/1051309780.db2.gz PVFAKJOTAYKWAH-UHFFFAOYSA-N -1 1 331.572 4.394 20 0 EIADMM O=C(c1ccc([O-])cc1F)N(Cc1ccco1)Cc1cccs1 ZINC000154792189 1051336816 /nfs/dbraw/zinc/33/68/16/1051336816.db2.gz ZOFHYACSVKCTNG-UHFFFAOYSA-N -1 1 331.368 4.028 20 0 EIADMM COC(=O)c1cccc(Nc2cc(Cl)c([O-])cc2F)c1Cl ZINC001250026636 1051344099 /nfs/dbraw/zinc/34/40/99/1051344099.db2.gz QWIZLLBJZLVKCF-UHFFFAOYSA-N -1 1 330.142 4.368 20 0 EIADMM COc1cc(C(=O)Nc2ccccc2C(F)F)cc(Cl)c1[O-] ZINC001191146872 1051363597 /nfs/dbraw/zinc/36/35/97/1051363597.db2.gz KSSLARUVSZPQMC-UHFFFAOYSA-N -1 1 327.714 4.244 20 0 EIADMM CCOc1cc(C)c(Nc2cc3ccc([O-])cc3oc2=O)c(C)c1 ZINC001175173734 1051428240 /nfs/dbraw/zinc/42/82/40/1051428240.db2.gz PYKKFWKNIQHRIL-UHFFFAOYSA-N -1 1 325.364 4.258 20 0 EIADMM O=C(Nc1cccc(C(F)(F)F)c1[O-])[C@@H]1C[C@@H]1c1ccccc1F ZINC001182284734 1051465881 /nfs/dbraw/zinc/46/58/81/1051465881.db2.gz FPGZJVHVBQBMMO-GHMZBOCLSA-N -1 1 339.288 4.292 20 0 EIADMM CC(C)c1nnc([N-]c2ccc(C(=O)OCc3ccccc3)cc2)o1 ZINC001175271626 1051510013 /nfs/dbraw/zinc/51/00/13/1051510013.db2.gz YJPJQMFIMAVRFO-UHFFFAOYSA-N -1 1 337.379 4.294 20 0 EIADMM O=C1CCCc2nc([N-]c3c(F)c(F)c(F)c(F)c3F)sc21 ZINC001175383300 1051562965 /nfs/dbraw/zinc/56/29/65/1051562965.db2.gz DUUKYVCTZODCPY-UHFFFAOYSA-N -1 1 334.269 4.101 20 0 EIADMM COc1ccc2cc(S(=O)(=O)[N-]c3cc(C)cc(F)c3)ccc2c1 ZINC001191966260 1051602632 /nfs/dbraw/zinc/60/26/32/1051602632.db2.gz KTBOIEJLSRSWKF-UHFFFAOYSA-N -1 1 345.395 4.097 20 0 EIADMM C[C@H](NC(=O)c1ccc([O-])cc1F)c1ccccc1C(F)(F)F ZINC000162522178 1051684832 /nfs/dbraw/zinc/68/48/32/1051684832.db2.gz FQZAMLVLEXEWBJ-VIFPVBQESA-N -1 1 327.277 4.041 20 0 EIADMM Cc1ccc(CCCO)c(NC(=O)c2ccc(C(C)(C)C)cc2[O-])c1 ZINC001192334945 1051694064 /nfs/dbraw/zinc/69/40/64/1051694064.db2.gz ACKYIGFBNLOLNT-UHFFFAOYSA-N -1 1 341.451 4.175 20 0 EIADMM O=C(NC1CC1)c1ccc(Nc2ccc(Cl)c(Cl)c2[O-])cc1 ZINC001175607840 1051694725 /nfs/dbraw/zinc/69/47/25/1051694725.db2.gz TUCBGRBDUAGSQP-UHFFFAOYSA-N -1 1 337.206 4.335 20 0 EIADMM COC(=O)c1cc(Br)c([O-])c(Nc2cscc2C)c1 ZINC001175766626 1051775281 /nfs/dbraw/zinc/77/52/81/1051775281.db2.gz CWNILLYRRSFVBC-UHFFFAOYSA-N -1 1 342.214 4.055 20 0 EIADMM O=C(Nc1c[n-][nH]c1=O)c1ccccc1-c1ccc(C(F)(F)F)cc1 ZINC001183561441 1051862465 /nfs/dbraw/zinc/86/24/65/1051862465.db2.gz BWVPQTRDGCAAOE-UHFFFAOYSA-N -1 1 347.296 4.053 20 0 EIADMM CCN(CC)C(=O)c1ccc(F)c(Nc2cc([O-])c(F)c(F)c2)c1 ZINC001176069099 1051903312 /nfs/dbraw/zinc/90/33/12/1051903312.db2.gz NRHZYSGUQCDWCN-UHFFFAOYSA-N -1 1 338.329 4.035 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N1CCCSC[C@@H]1c1ccccc1 ZINC001176162549 1051951261 /nfs/dbraw/zinc/95/12/61/1051951261.db2.gz FWBMAGUYDCHXAN-MRXNPFEDSA-N -1 1 347.867 4.366 20 0 EIADMM Cc1ccc(-c2ccccc2)cc1[N-]S(=O)(=O)c1ccccc1N ZINC001193924199 1052028681 /nfs/dbraw/zinc/02/86/81/1052028681.db2.gz NGYXODLUWMQVNM-UHFFFAOYSA-N -1 1 338.432 4.045 20 0 EIADMM O=C(OCc1ncc(-c2cccc(Cl)c2)o1)c1ccc([O-])cc1F ZINC000773570775 1052039835 /nfs/dbraw/zinc/03/98/35/1052039835.db2.gz BUZHPQMBZWZFRX-UHFFFAOYSA-N -1 1 347.729 4.197 20 0 EIADMM O=C(Nc1ccc(Br)cc1[O-])Oc1ccc(Cl)cc1 ZINC001194055509 1052064717 /nfs/dbraw/zinc/06/47/17/1052064717.db2.gz FKXNKSBRMWFRGR-UHFFFAOYSA-N -1 1 342.576 4.419 20 0 EIADMM O=C([O-])C[C@H](NCc1ccc(Oc2ccccc2)o1)c1cccs1 ZINC000671162315 1052072770 /nfs/dbraw/zinc/07/27/70/1052072770.db2.gz UVZFFCRQNWQIMX-HNNXBMFYSA-N -1 1 343.404 4.439 20 0 EIADMM Cc1oc2ccc(NC(=O)c3c(C)nc(C(C)C)[n-]c3=O)cc2c1C ZINC000774775911 1052079585 /nfs/dbraw/zinc/07/95/85/1052079585.db2.gz LCBMPJNUQYAMIG-UHFFFAOYSA-N -1 1 339.395 4.229 20 0 EIADMM CCn1c2ccccc2c2cc(NC(=O)c3cncc([O-])c3)ccc21 ZINC000336885345 1052089101 /nfs/dbraw/zinc/08/91/01/1052089101.db2.gz DGGBIKMSBOIXMI-UHFFFAOYSA-N -1 1 331.375 4.167 20 0 EIADMM O=S(=O)([N-]c1c(O)cccc1F)c1ccc(-c2cccs2)cc1 ZINC001194161392 1052092394 /nfs/dbraw/zinc/09/23/94/1052092394.db2.gz BMDICUWMAYIEQY-UHFFFAOYSA-N -1 1 349.408 4.061 20 0 EIADMM [O-]c1ccc(Cl)c(Nc2cnc(N3CCCCC3)nc2)c1Cl ZINC001176508183 1052101258 /nfs/dbraw/zinc/10/12/58/1052101258.db2.gz MEKBRIRFMIKRGY-UHFFFAOYSA-N -1 1 339.226 4.223 20 0 EIADMM Cc1cc(Br)ccc1NC(=O)Nc1ccc(F)cc1[O-] ZINC001184817988 1052111327 /nfs/dbraw/zinc/11/13/27/1052111327.db2.gz ZGCMLIDKFBOTLP-UHFFFAOYSA-N -1 1 339.164 4.246 20 0 EIADMM COc1ccc(O)cc1Nc1c([O-])c(Br)ccc1Cl ZINC001176581572 1052118412 /nfs/dbraw/zinc/11/84/12/1052118412.db2.gz JSVZYILCFRDQMP-UHFFFAOYSA-N -1 1 344.592 4.266 20 0 EIADMM CCOC(=O)c1c(Cl)cccc1Nc1c(F)cc(F)c([O-])c1F ZINC001176670594 1052157176 /nfs/dbraw/zinc/15/71/76/1052157176.db2.gz HKZDMPWPIJAZHT-UHFFFAOYSA-N -1 1 345.704 4.383 20 0 EIADMM COC(=O)c1c(C)c(C)sc1Nc1c(F)cc(F)c([O-])c1F ZINC001176664354 1052157407 /nfs/dbraw/zinc/15/74/07/1052157407.db2.gz VNCYDVDLWJEVOI-UHFFFAOYSA-N -1 1 331.315 4.018 20 0 EIADMM CC(C)(C)c1cc(Nc2c(F)cc(F)c([O-])c2F)c(C(N)=O)s1 ZINC001176664845 1052157823 /nfs/dbraw/zinc/15/78/23/1052157823.db2.gz VQJPPCNWLLCYCU-UHFFFAOYSA-N -1 1 344.358 4.011 20 0 EIADMM Cc1ccc(Br)nc1Nc1c(F)cc(F)c([O-])c1F ZINC001176669610 1052157924 /nfs/dbraw/zinc/15/79/24/1052157924.db2.gz IZYVCSYXSZABFP-UHFFFAOYSA-N -1 1 333.107 4.019 20 0 EIADMM COc1cc(Br)ccc1Nc1c(F)cc(F)c([O-])c1F ZINC001176671598 1052159281 /nfs/dbraw/zinc/15/92/81/1052159281.db2.gz JCZCVRFYIINRHA-UHFFFAOYSA-N -1 1 348.118 4.324 20 0 EIADMM Cc1cc(C)n(-c2ccc(Nc3c(F)cc(F)c([O-])c3F)cc2)n1 ZINC001176673715 1052161701 /nfs/dbraw/zinc/16/17/01/1052161701.db2.gz XRPUCHPLTPJLMB-UHFFFAOYSA-N -1 1 333.313 4.356 20 0 EIADMM [O-]c1c(F)cc(F)c(Nc2cc(OC(F)(F)F)ccc2O)c1F ZINC001176674864 1052161774 /nfs/dbraw/zinc/16/17/74/1052161774.db2.gz ZAFHVCCYNHVSRK-UHFFFAOYSA-N -1 1 339.191 4.157 20 0 EIADMM Cc1cc(Br)cnc1Nc1c(F)cc(F)c([O-])c1F ZINC001176662589 1052172923 /nfs/dbraw/zinc/17/29/23/1052172923.db2.gz SNUHFIFGGFDMEU-UHFFFAOYSA-N -1 1 333.107 4.019 20 0 EIADMM Cc1cccc(C)c1S(=O)(=O)[N-]c1ccnc(-c2ccccc2)c1 ZINC001194605672 1052178307 /nfs/dbraw/zinc/17/83/07/1052178307.db2.gz QFSHJWMDRYXHAS-UHFFFAOYSA-N -1 1 338.432 4.166 20 0 EIADMM Cc1cccc(C)c1S(=O)(=O)[N-]c1ccccc1-c1ccco1 ZINC001194642421 1052183380 /nfs/dbraw/zinc/18/33/80/1052183380.db2.gz HYJWWHUURGCRDS-UHFFFAOYSA-N -1 1 327.405 4.364 20 0 EIADMM Cc1cccc(C)c1S(=O)(=O)[N-]c1ccccc1-c1ccccn1 ZINC001194639405 1052183562 /nfs/dbraw/zinc/18/35/62/1052183562.db2.gz RIFGCZFNFTWCKJ-UHFFFAOYSA-N -1 1 338.432 4.166 20 0 EIADMM Cc1cccc(C)c1S(=O)(=O)[N-]c1ccc2c(ccnc2Cl)c1 ZINC001194642245 1052184187 /nfs/dbraw/zinc/18/41/87/1052184187.db2.gz BWAUGAJJSQATJB-UHFFFAOYSA-N -1 1 346.839 4.306 20 0 EIADMM Cc1cccc(C)c1S(=O)(=O)[N-]c1ccc2c(Cl)ccnc2c1 ZINC001194641903 1052184300 /nfs/dbraw/zinc/18/43/00/1052184300.db2.gz CBOIPNJSOIQUFK-UHFFFAOYSA-N -1 1 346.839 4.306 20 0 EIADMM CN(CCC1CCCCC1)C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000622344419 1052219408 /nfs/dbraw/zinc/21/94/08/1052219408.db2.gz PHJSMDWWFYCAJH-UHFFFAOYSA-N -1 1 329.362 4.453 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2cc3ccccc3s2)c(Cl)n1 ZINC001185425472 1052235164 /nfs/dbraw/zinc/23/51/64/1052235164.db2.gz RZTBIDCVDZSQHL-UHFFFAOYSA-N -1 1 338.841 4.059 20 0 EIADMM CCC(=O)c1ccc([N-]S(=O)(=O)c2ccc(Cl)c(C)c2)cc1 ZINC001185529700 1052257827 /nfs/dbraw/zinc/25/78/27/1052257827.db2.gz KZIQEDTYIHQQOL-UHFFFAOYSA-N -1 1 337.828 4.042 20 0 EIADMM CC(=O)c1ccc(C)c([N-]S(=O)(=O)c2cccc(C(C)C)c2)c1 ZINC001195156404 1053309502 /nfs/dbraw/zinc/30/95/02/1053309502.db2.gz LFFZFTMHSZPXDN-UHFFFAOYSA-N -1 1 331.437 4.122 20 0 EIADMM Cc1cc(Cl)ncc1NC(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000776490226 1053349567 /nfs/dbraw/zinc/34/95/67/1053349567.db2.gz UMYGQVJVMYNQSZ-UHFFFAOYSA-N -1 1 330.693 4.020 20 0 EIADMM CCOC(=O)NC(=S)[N-]c1cc(Cl)c(Cl)c(Cl)c1 ZINC001195491167 1053422029 /nfs/dbraw/zinc/42/20/29/1053422029.db2.gz UCYNTNLTKCJHFT-UHFFFAOYSA-N -1 1 327.620 4.090 20 0 EIADMM Cc1nc(SCc2c(Cl)cncc2Cl)[n-]c(=O)c1C1CC1 ZINC000865373543 1053486737 /nfs/dbraw/zinc/48/67/37/1053486737.db2.gz ZDSARRAKUOGMQN-UHFFFAOYSA-N -1 1 342.251 4.362 20 0 EIADMM COc1cccc(NC(=S)Nc2cccc(C(F)(F)F)c2[O-])c1 ZINC001196059071 1053565981 /nfs/dbraw/zinc/56/59/81/1053565981.db2.gz VBOONVRSTJZZNV-UHFFFAOYSA-N -1 1 342.342 4.229 20 0 EIADMM O=C(NCc1ccccc1OC(F)F)c1cc2ccccc2cc1[O-] ZINC000012825670 1053633257 /nfs/dbraw/zinc/63/32/57/1053633257.db2.gz VCYTWAUKFVIZIL-UHFFFAOYSA-N -1 1 343.329 4.077 20 0 EIADMM COc1cc(C)c(S(=O)(=O)[N-]c2cccc3sccc32)c(C)c1 ZINC001196887400 1053788988 /nfs/dbraw/zinc/78/89/88/1053788988.db2.gz DMVSGXQLIXMLFB-UHFFFAOYSA-N -1 1 347.461 4.328 20 0 EIADMM Cc1ccnc(S(=O)(=O)[N-]c2ccc(C(C)(C)C)cc2Cl)c1 ZINC001198004501 1054043845 /nfs/dbraw/zinc/04/38/45/1054043845.db2.gz JYPAHWSGRPMESB-UHFFFAOYSA-N -1 1 338.860 4.142 20 0 EIADMM [O-]c1c(F)cc(NC(=S)Nc2cccc(C(F)(F)F)c2)cc1F ZINC001198059769 1054054071 /nfs/dbraw/zinc/05/40/71/1054054071.db2.gz PVDUPHSGKAIBIM-UHFFFAOYSA-N -1 1 348.296 4.498 20 0 EIADMM Cc1cc(NC(=O)c2ccccc2[O-])ccc1NC(=O)OC(C)(C)C ZINC000856370907 1054063145 /nfs/dbraw/zinc/06/31/45/1054063145.db2.gz UMWRWCSKOHBTGG-UHFFFAOYSA-N -1 1 342.395 4.300 20 0 EIADMM O=S(=O)([N-]c1ccccc1F)c1ccccc1Oc1ccccc1 ZINC001198432439 1054145220 /nfs/dbraw/zinc/14/52/20/1054145220.db2.gz IIMMQYAFALXZDB-UHFFFAOYSA-N -1 1 343.379 4.419 20 0 EIADMM O=C([N-]c1cc(F)ccc1SCC(F)F)c1cc(C2CC2)on1 ZINC000172370188 1054233031 /nfs/dbraw/zinc/23/30/31/1054233031.db2.gz HRJDPMVDRVNGKE-UHFFFAOYSA-N -1 1 342.342 4.301 20 0 EIADMM CC(C)(C)c1ccc2c(c1)CCN2C(=O)c1c(F)ccc([O-])c1F ZINC000857443556 1054244751 /nfs/dbraw/zinc/24/47/51/1054244751.db2.gz GPOYYQDIGWJXBG-UHFFFAOYSA-N -1 1 331.362 4.171 20 0 EIADMM O=C([N-][C@H](C1CCCCC1)C(F)(F)F)C(F)(F)c1ccccc1 ZINC000857462536 1054253319 /nfs/dbraw/zinc/25/33/19/1054253319.db2.gz IMJZMRCQSOBVLE-CYBMUJFWSA-N -1 1 335.316 4.406 20 0 EIADMM CC(C)CC1CCN(C(=O)c2ccc(C(F)(F)F)cc2[O-])CC1 ZINC000857469460 1054258574 /nfs/dbraw/zinc/25/85/74/1054258574.db2.gz RZRRHAHPNQHORZ-UHFFFAOYSA-N -1 1 329.362 4.309 20 0 EIADMM [O-]c1c(NC(=S)NC2CCCCCC2)cccc1C(F)(F)F ZINC001199972370 1054509063 /nfs/dbraw/zinc/50/90/63/1054509063.db2.gz UBZVRGGHURFWBI-UHFFFAOYSA-N -1 1 332.391 4.420 20 0 EIADMM O=S(=O)(Cc1ccccc1Cl)[N-]c1ccccc1C(F)(F)F ZINC000059291666 1054645297 /nfs/dbraw/zinc/64/52/97/1054645297.db2.gz XPKKMBAIYAEGMI-UHFFFAOYSA-N -1 1 349.761 4.301 20 0 EIADMM CC(C)c1nnc([N-]C(=O)c2csc(-c3ccccc3F)n2)s1 ZINC000063709026 1054826923 /nfs/dbraw/zinc/82/69/23/1054826923.db2.gz CPJPLMPTXUKISF-UHFFFAOYSA-N -1 1 348.428 4.176 20 0 EIADMM [O-]c1cc(Nc2cncc(OCc3ccccc3)c2)cc(F)c1F ZINC001201625903 1054867855 /nfs/dbraw/zinc/86/78/55/1054867855.db2.gz NYTLMWBBMWOGMY-UHFFFAOYSA-N -1 1 328.318 4.388 20 0 EIADMM O=C(NCc1ccc([O-])c(Cl)c1)N(Cc1cccc(F)c1)C1CC1 ZINC000876394708 1054894233 /nfs/dbraw/zinc/89/42/33/1054894233.db2.gz MPKYYODISKZLOF-UHFFFAOYSA-N -1 1 348.805 4.059 20 0 EIADMM Cc1ccccc1[C@@H](C)N(C)C(=O)NCc1ccc([O-])c(Cl)c1 ZINC000876394659 1054894380 /nfs/dbraw/zinc/89/43/80/1054894380.db2.gz LYZICJDRKABDEQ-CYBMUJFWSA-N -1 1 332.831 4.257 20 0 EIADMM O=C(Nc1ccccc1Br)Nc1c(F)cc([O-])cc1F ZINC001201980382 1054957054 /nfs/dbraw/zinc/95/70/54/1054957054.db2.gz XFCXKSLVZOBLDT-UHFFFAOYSA-N -1 1 343.127 4.077 20 0 EIADMM COc1cccc(NC(=O)Nc2cc(Cl)c(Cl)cc2[O-])c1 ZINC001202277136 1055121507 /nfs/dbraw/zinc/12/15/07/1055121507.db2.gz OHFSOUCOKJSOSL-UHFFFAOYSA-N -1 1 327.167 4.352 20 0 EIADMM COc1ccc(NC(=O)Nc2cccc(C(F)(F)F)c2[O-])cc1 ZINC001202395732 1055170762 /nfs/dbraw/zinc/17/07/62/1055170762.db2.gz JLDQRVCOJVVUAS-UHFFFAOYSA-N -1 1 326.274 4.064 20 0 EIADMM O=C(Nc1cc(Cl)ccc1O)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684877442 1055310777 /nfs/dbraw/zinc/31/07/77/1055310777.db2.gz PUMHTGFYOCXLKF-UHFFFAOYSA-N -1 1 331.677 4.022 20 0 EIADMM CSc1ccc([O-])c(-c2nc(C(C)(C)c3cc(C)ccn3)no2)c1 ZINC000624710392 1055598168 /nfs/dbraw/zinc/59/81/68/1055598168.db2.gz NWDWXLSDZBPGHZ-UHFFFAOYSA-N -1 1 341.436 4.193 20 0 EIADMM C[C@@H](c1cc(Cl)ccc1Cl)N1CCC2(C[C@@H]2C(=O)[O-])CC1 ZINC000405363107 1056384527 /nfs/dbraw/zinc/38/45/27/1056384527.db2.gz RDHKOLISWRBMNM-GXFFZTMASA-N -1 1 328.239 4.241 20 0 EIADMM CCCCC[C@H](C)CC(=O)N1CCC(C(=O)c2ccc([O-])cc2)CC1 ZINC000743295860 1058914598 /nfs/dbraw/zinc/91/45/98/1058914598.db2.gz RZTPCNGZJMNJJJ-INIZCTEOSA-N -1 1 345.483 4.420 20 0 EIADMM CC(C)(C)OC(=O)Nc1ccc(C(=O)Nc2c([O-])cccc2F)cc1 ZINC000743417675 1058993941 /nfs/dbraw/zinc/99/39/41/1058993941.db2.gz ZXXDPQWQCACRJU-UHFFFAOYSA-N -1 1 346.358 4.131 20 0 EIADMM CSc1ccc(C)c(C(=O)OCCc2cc(C(C)=O)ccc2[O-])c1 ZINC000744641587 1059600808 /nfs/dbraw/zinc/60/08/08/1059600808.db2.gz DPZZMIAIRAPQIC-UHFFFAOYSA-N -1 1 344.432 4.025 20 0 EIADMM CCCCCC[C@H](C)C(=O)OCc1cc(=O)oc2cc([O-])ccc12 ZINC000745255524 1059797136 /nfs/dbraw/zinc/79/71/36/1059797136.db2.gz JEYXKZYZYXIDPS-ZDUSSCGKSA-N -1 1 332.396 4.148 20 0 EIADMM CCOc1cc(Nc2cc3ccc([O-])cc3oc2=O)ccc1Cl ZINC001212578844 1060262502 /nfs/dbraw/zinc/26/25/02/1060262502.db2.gz CLPIAGPFTQEGOX-UHFFFAOYSA-N -1 1 331.755 4.294 20 0 EIADMM CSc1nc2ccc(NC(=O)c3ccc([O-])c(F)c3)cc2s1 ZINC000767247543 1061170738 /nfs/dbraw/zinc/17/07/38/1061170738.db2.gz SXCHWMQIABELDW-UHFFFAOYSA-N -1 1 334.397 4.115 20 0 EIADMM O=S(=O)([N-]c1ccc(Cl)cc1Cl)c1cc(F)ccc1F ZINC000020627006 212156862 /nfs/dbraw/zinc/15/68/62/212156862.db2.gz KZYRLBNHNKYFNX-UHFFFAOYSA-N -1 1 338.162 4.072 20 0 EIADMM COC(=O)c1cnc(S[C@@H](c2ccccc2)c2ccc(F)cc2)[n-]1 ZINC000193535417 1032158180 /nfs/dbraw/zinc/15/81/80/1032158180.db2.gz NDNJOAZQOJAEOA-INIZCTEOSA-N -1 1 342.395 4.217 20 0 EIADMM COC(=O)c1c[n-]c(S[C@@H](c2ccccc2)c2ccc(F)cc2)n1 ZINC000193535417 1032158189 /nfs/dbraw/zinc/15/81/89/1032158189.db2.gz NDNJOAZQOJAEOA-INIZCTEOSA-N -1 1 342.395 4.217 20 0 EIADMM O=C(Nc1ccc(Cl)cc1[O-])c1cc(-c2cccc(F)c2)no1 ZINC000532837152 1032343879 /nfs/dbraw/zinc/34/38/79/1032343879.db2.gz LSBQUXPFNOKEQE-UHFFFAOYSA-N -1 1 332.718 4.092 20 0 EIADMM C[C@@H]1C[C@@H](C(=O)Nc2cc(Cl)c([O-])c3ccccc23)CCC1=O ZINC000529540231 1032429089 /nfs/dbraw/zinc/42/90/89/1032429089.db2.gz VSUFXDQPYKNVNL-MNOVXSKESA-N -1 1 331.799 4.143 20 0 EIADMM C[C@H]1CC[C@@H](CCC(=O)Nc2cc(Cl)c([O-])c3ccccc23)O1 ZINC000529538529 1032443732 /nfs/dbraw/zinc/44/37/32/1032443732.db2.gz CSAGCNDPAQOOLC-RYUDHWBXSA-N -1 1 333.815 4.485 20 0 EIADMM C[C@H]1CC(=O)CC[C@H]1C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000529539432 1032444758 /nfs/dbraw/zinc/44/47/58/1032444758.db2.gz SFHBYBDVDWIKAR-CMPLNLGQSA-N -1 1 331.799 4.143 20 0 EIADMM O=C(COc1ccc(Cl)cc1Cl)Nc1ccc([O-])c(Cl)c1 ZINC000533081439 1032480795 /nfs/dbraw/zinc/48/07/95/1032480795.db2.gz FMWUTRJSAHCGFF-UHFFFAOYSA-N -1 1 346.597 4.370 20 0 EIADMM O=C([O-])[C@H](NCc1ccc(Cl)c(Cl)c1)c1cc(F)ccc1F ZINC000683173663 1019099937 /nfs/dbraw/zinc/09/99/37/1019099937.db2.gz NNZBUSPXFGZKEP-CQSZACIVSA-N -1 1 346.160 4.187 20 0 EIADMM CCSCc1cccc([N-]S(=O)(=O)c2ccc(F)c(C)c2)c1 ZINC000610193698 1019208258 /nfs/dbraw/zinc/20/82/58/1019208258.db2.gz DPDGFOYXENBDFH-UHFFFAOYSA-N -1 1 339.457 4.188 20 0 EIADMM Cc1ccc(-c2nc(CN3CCC(CCC(=O)[O-])CC3)cs2)cc1 ZINC000324240143 1019751819 /nfs/dbraw/zinc/75/18/19/1019751819.db2.gz AVIBGFMNXYNAIN-UHFFFAOYSA-N -1 1 344.480 4.195 20 0 EIADMM CC(C)(CNC(=O)c1cc(F)ccc1[O-])c1cccc(Cl)c1F ZINC001625818908 1019865815 /nfs/dbraw/zinc/86/58/15/1019865815.db2.gz ZCASRHOQQCJQCY-UHFFFAOYSA-N -1 1 339.769 4.031 20 0 EIADMM CSCc1cccc([N-]S(=O)(=O)c2cc(C)c(F)c(C)c2)c1 ZINC000610237715 1019867212 /nfs/dbraw/zinc/86/72/12/1019867212.db2.gz BCSRSALUBIYKQI-UHFFFAOYSA-N -1 1 339.457 4.106 20 0 EIADMM O=C([O-])C[C@@H](NCc1c(Cl)oc2ccccc21)c1ccsc1 ZINC000426695957 1032887337 /nfs/dbraw/zinc/88/73/37/1032887337.db2.gz PQQJDQMSZKRENV-CYBMUJFWSA-N -1 1 335.812 4.453 20 0 EIADMM O=C([O-])CCCCC(=O)Nc1ccc2nc(C3CCCCC3)[nH]c2c1 ZINC000655554731 1020294910 /nfs/dbraw/zinc/29/49/10/1020294910.db2.gz JCUIEHPIFMPVIV-UHFFFAOYSA-N -1 1 343.427 4.194 20 0 EIADMM C[S@@](=O)(=NC(=O)c1cc2sccc2c([O-])c1)C1CCCCC1 ZINC000926023182 1020769677 /nfs/dbraw/zinc/76/96/77/1020769677.db2.gz AMECPRCNCAGKKU-QFIPXVFZSA-N -1 1 337.466 4.178 20 0 EIADMM CCOc1cc(-c2noc([C@@H](C)c3ccco3)n2)cc(Cl)c1[O-] ZINC000683589328 1020943718 /nfs/dbraw/zinc/94/37/18/1020943718.db2.gz MEIRJNUBSIKBAN-VIFPVBQESA-N -1 1 334.759 4.239 20 0 EIADMM CCOc1ccc(F)c([N-]C(=O)c2oc3c(c2C)C(=O)CCC3)c1F ZINC000340428180 1021011110 /nfs/dbraw/zinc/01/11/10/1021011110.db2.gz RXUPWSLNHSEHIW-UHFFFAOYSA-N -1 1 349.333 4.036 20 0 EIADMM CC[C@H](C)c1cccc(NC(=O)c2cc(C(=O)OC(C)(C)C)n[n-]2)c1 ZINC001167320483 1021087632 /nfs/dbraw/zinc/08/76/32/1021087632.db2.gz BXFGZLSUDMKIJM-LBPRGKRZSA-N -1 1 343.427 4.131 20 0 EIADMM Cc1noc(-c2ccccc2)c1[N-]C(=O)c1cc(F)c(F)cc1F ZINC000122725161 1021117701 /nfs/dbraw/zinc/11/77/01/1021117701.db2.gz ZWRSWNGBTPDHLQ-UHFFFAOYSA-N -1 1 332.281 4.320 20 0 EIADMM COC(=O)c1ncc(Cl)cc1Nc1cc(Cl)c([O-])c(Cl)c1 ZINC001210926190 1021865944 /nfs/dbraw/zinc/86/59/44/1021865944.db2.gz BKBLJDPIWVUCMC-UHFFFAOYSA-N -1 1 347.585 4.278 20 0 EIADMM COC(=O)c1cnc(Cl)cc1Nc1cc(Cl)c([O-])c(Cl)c1 ZINC001210927795 1021868554 /nfs/dbraw/zinc/86/85/54/1021868554.db2.gz ZOKTZZYBULTHQW-UHFFFAOYSA-N -1 1 347.585 4.278 20 0 EIADMM Nc1cc(C(F)(F)F)ncc1Nc1cc(Cl)c([O-])c(Cl)c1 ZINC001210927702 1021868844 /nfs/dbraw/zinc/86/88/44/1021868844.db2.gz XRDBXSZKAJZZCE-UHFFFAOYSA-N -1 1 338.116 4.439 20 0 EIADMM CC[C@@H](Cc1ccccc1)NC(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC001143500554 1022016352 /nfs/dbraw/zinc/01/63/52/1022016352.db2.gz VIAHBOUCOVGKOF-AWEZNQCLSA-N -1 1 337.341 4.162 20 0 EIADMM Cc1c(=O)[n-]c(S[C@@H]2C[C@H](C)CCC2=O)nc1-c1ccccc1 ZINC000580517259 1022142817 /nfs/dbraw/zinc/14/28/17/1022142817.db2.gz NBKUAEADLMWOCE-IAQYHMDHSA-N -1 1 328.437 4.007 20 0 EIADMM Cc1cnc(SCCCSc2ccccc2Cl)[n-]c1=O ZINC000568532852 1022328124 /nfs/dbraw/zinc/32/81/24/1022328124.db2.gz FRWYUARWOLYYNG-UHFFFAOYSA-N -1 1 326.874 4.419 20 0 EIADMM CCS[C@@H]1CC[C@H](N(C)C(=O)c2cc3ccccc3cc2[O-])C1 ZINC000175393048 1022349500 /nfs/dbraw/zinc/34/95/00/1022349500.db2.gz FCBINFWCJJBVKL-JKSUJKDBSA-N -1 1 329.465 4.292 20 0 EIADMM CCS[C@H]1CC[C@H](N(C)C(=O)c2ccc3ccccc3c2[O-])C1 ZINC000175391904 1022349726 /nfs/dbraw/zinc/34/97/26/1022349726.db2.gz LRLHXMRXPDLBFY-GJZGRUSLSA-N -1 1 329.465 4.292 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1CCS[C@@H]2CCCC[C@H]21 ZINC000175404452 1022355653 /nfs/dbraw/zinc/35/56/53/1022355653.db2.gz SULBZELOPPAWMO-IAGOWNOFSA-N -1 1 327.449 4.046 20 0 EIADMM CCOc1cc(C(=O)NCCC(C)(C)C2CC2)cc(Cl)c1[O-] ZINC000647515855 1022396798 /nfs/dbraw/zinc/39/67/98/1022396798.db2.gz TZOVSXLDNDTTBQ-UHFFFAOYSA-N -1 1 325.836 4.000 20 0 EIADMM CCOc1cc(C(=O)Nc2ccc3c(c2)CCCO3)cc(Cl)c1[O-] ZINC000186758539 1022741076 /nfs/dbraw/zinc/74/10/76/1022741076.db2.gz BMNRFGLCQPWWIB-UHFFFAOYSA-N -1 1 347.798 4.022 20 0 EIADMM CCOc1cc(C(=O)N2[C@H](C)C[C@H]3CCCC[C@@H]32)cc(Cl)c1[O-] ZINC000186816220 1022748478 /nfs/dbraw/zinc/74/84/78/1022748478.db2.gz BYTHZKBAGAOGIN-JMSVASOKSA-N -1 1 337.847 4.238 20 0 EIADMM COc1cccc(CC(=O)Nc2cc(Cl)c([O-])c3ccccc23)c1 ZINC001167440887 1022768280 /nfs/dbraw/zinc/76/82/80/1022768280.db2.gz WPAQWGFGXCGJKG-UHFFFAOYSA-N -1 1 341.794 4.389 20 0 EIADMM C=Cc1ccc(S(=O)(=O)[N-]c2cccc(COCC3CC3)c2)cc1 ZINC000414381070 1022816636 /nfs/dbraw/zinc/81/66/36/1022816636.db2.gz MAPKMJAOFHLTQJ-UHFFFAOYSA-N -1 1 343.448 4.057 20 0 EIADMM CCNc1ccc(Cl)cc1C(=O)Nc1cc([O-])c(F)cc1F ZINC001625896024 1023049348 /nfs/dbraw/zinc/04/93/48/1023049348.db2.gz DQIFVLWUWWDBQM-UHFFFAOYSA-N -1 1 326.730 4.008 20 0 EIADMM Cc1cccc(S(=O)(=O)[N-]c2ccc(COC(C)(C)C)cc2)c1 ZINC000084461133 1023050904 /nfs/dbraw/zinc/05/09/04/1023050904.db2.gz MCHRETKCUOZUSX-UHFFFAOYSA-N -1 1 333.453 4.111 20 0 EIADMM O=C(Nc1ccccc1-c1nc2ccccc2[nH]1)c1ccc([O-])cc1F ZINC000181965615 1023281963 /nfs/dbraw/zinc/28/19/63/1023281963.db2.gz KKBKQFZPQZAQOV-UHFFFAOYSA-N -1 1 347.349 4.327 20 0 EIADMM C[C@@H](c1ncc(-c2ccc(Cl)cc2)o1)[N@H+]1CC[C@H](C(=O)[O-])[C@H](C)C1 ZINC000659801021 1023283010 /nfs/dbraw/zinc/28/30/10/1023283010.db2.gz FVDQBMROCQMWRP-XUJVJEKNSA-N -1 1 348.830 4.099 20 0 EIADMM C[C@H]1CC[N@@H+](CCSc2cc(Cl)ccc2Cl)C[C@H]1C(=O)[O-] ZINC000584779976 1023311877 /nfs/dbraw/zinc/31/18/77/1023311877.db2.gz ZISHGQYQBOTYBS-CMPLNLGQSA-N -1 1 348.295 4.128 20 0 EIADMM CC(C)c1cc(C(=O)Nc2ccc([O-])c(Cl)c2)nn1C(C)(C)C ZINC000182868353 1023334098 /nfs/dbraw/zinc/33/40/98/1023334098.db2.gz QQCKCJUFZNVCAC-UHFFFAOYSA-N -1 1 335.835 4.373 20 0 EIADMM Cc1oc([C@@H](C)N2CC[C@H](C(F)(F)F)C(C)(C)C2)cc1C(=O)[O-] ZINC000581553827 1023356777 /nfs/dbraw/zinc/35/67/77/1023356777.db2.gz HRSKIOCDVKRFNF-RNCFNFMXSA-N -1 1 333.350 4.258 20 0 EIADMM C[C@@H](Oc1cc(Cl)cc(Cl)c1)C(=O)Nc1c([O-])cccc1F ZINC000605439944 1023411859 /nfs/dbraw/zinc/41/18/59/1023411859.db2.gz YTLGMNBTUGKZMT-MRVPVSSYSA-N -1 1 344.169 4.244 20 0 EIADMM CN(Cc1cccc(C(C)(C)C)c1)Cc1nc(=O)c2sccc2[n-]1 ZINC000660291822 1023437506 /nfs/dbraw/zinc/43/75/06/1023437506.db2.gz BQEHSHFZWADUDE-UHFFFAOYSA-N -1 1 341.480 4.326 20 0 EIADMM O=C(CCSc1nc2ccccc2s1)Nc1c([O-])cccc1F ZINC000092551477 1023466243 /nfs/dbraw/zinc/46/62/43/1023466243.db2.gz HRZQRVMVZIHXHB-UHFFFAOYSA-N -1 1 348.424 4.262 20 0 EIADMM CCC(=O)c1cccc(S(=O)(=O)[N-]c2ccc(F)c(C3CC3)c2)c1 ZINC000499502354 1023509146 /nfs/dbraw/zinc/50/91/46/1023509146.db2.gz BYACKHPNMHTZRK-UHFFFAOYSA-N -1 1 347.411 4.097 20 0 EIADMM CC(C)Oc1ccccc1[C@@H](C)NCc1nc(=O)c2sccc2[n-]1 ZINC000581870667 1023785411 /nfs/dbraw/zinc/78/54/11/1023785411.db2.gz XZUUGPXMDBTQQB-GFCCVEGCSA-N -1 1 343.452 4.035 20 0 EIADMM Cc1cccc(OC(F)F)c1NC(=O)Cc1ccc([O-])c(Cl)c1 ZINC001143402546 1023844976 /nfs/dbraw/zinc/84/49/76/1023844976.db2.gz QWXIVEVAJZZASF-UHFFFAOYSA-N -1 1 341.741 4.137 20 0 EIADMM Cc1cc(C)c(C)c(S(=O)(=O)[N-]c2cccc3cnccc32)c1C ZINC000107210977 1024085352 /nfs/dbraw/zinc/08/53/52/1024085352.db2.gz DQGHEBHKNSKCQA-UHFFFAOYSA-N -1 1 340.448 4.269 20 0 EIADMM O=C([N-]c1cc(-c2ccccc2)on1)c1c(F)c(F)cc(F)c1F ZINC000088390565 1024091194 /nfs/dbraw/zinc/09/11/94/1024091194.db2.gz SGJUZIQATAOORY-UHFFFAOYSA-N -1 1 336.244 4.150 20 0 EIADMM COc1cccc(-c2cc(C(=O)[N-]c3cc(F)c(F)cc3F)on2)c1 ZINC001126024662 1024200425 /nfs/dbraw/zinc/20/04/25/1024200425.db2.gz FPYWVJXAFFOYNJ-UHFFFAOYSA-N -1 1 348.280 4.020 20 0 EIADMM CCC(=O)c1cccc(S(=O)(=O)[N-]c2ccc(Cl)cc2C)c1 ZINC000132610933 1024814085 /nfs/dbraw/zinc/81/40/85/1024814085.db2.gz KCJMRWRZNUGQLZ-UHFFFAOYSA-N -1 1 337.828 4.042 20 0 EIADMM CCN(Cc1cnc(-c2ccc(C(C)C)cc2)s1)[C@@H](C)C(=O)[O-] ZINC000662214584 1024965763 /nfs/dbraw/zinc/96/57/63/1024965763.db2.gz GCORFVGMBQCCJN-ZDUSSCGKSA-N -1 1 332.469 4.229 20 0 EIADMM CCOc1cc(C(=O)N(C)c2ccccc2OCC)cc(Cl)c1[O-] ZINC000186945864 1025137375 /nfs/dbraw/zinc/13/73/75/1025137375.db2.gz JROMZFHPMGLLLS-UHFFFAOYSA-N -1 1 349.814 4.120 20 0 EIADMM C[C@@H]1CO[C@H](c2ccccc2)CN1C(=O)c1cc2ccccc2cc1[O-] ZINC000110315566 1033266635 /nfs/dbraw/zinc/26/66/35/1033266635.db2.gz QJJPDAQSPBNJRQ-VFNWGFHPSA-N -1 1 347.414 4.148 20 0 EIADMM CCc1noc(C)c1[N-]C(=O)c1cc(-c2ccccc2Cl)on1 ZINC000535892731 1025217254 /nfs/dbraw/zinc/21/72/54/1025217254.db2.gz RVHWNVAUGFLCPM-UHFFFAOYSA-N -1 1 331.759 4.106 20 0 EIADMM C[C@@H]1CO[C@@H](c2ccccc2)CN1C(=O)c1ccc2ccccc2c1[O-] ZINC000110314680 1033267686 /nfs/dbraw/zinc/26/76/86/1033267686.db2.gz CWQIURZJSPOPPV-FOIQADDNSA-N -1 1 347.414 4.148 20 0 EIADMM Cc1c(=O)[n-]c(SCc2cc(C3CC3)no2)nc1-c1ccccc1 ZINC000657257401 1025424055 /nfs/dbraw/zinc/42/40/55/1025424055.db2.gz QMHJHVVLXKVHJA-UHFFFAOYSA-N -1 1 339.420 4.315 20 0 EIADMM Cc1ccsc1CCCC(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC000440120158 1025656290 /nfs/dbraw/zinc/65/62/90/1025656290.db2.gz PTJLUNOOQLAICZ-UHFFFAOYSA-N -1 1 341.436 4.114 20 0 EIADMM CCCCOc1cccc(CNC(=O)c2ccc(Cl)cc2[O-])c1 ZINC001625929619 1025856440 /nfs/dbraw/zinc/85/64/40/1025856440.db2.gz PZKKOZZEJCMHJC-UHFFFAOYSA-N -1 1 333.815 4.155 20 0 EIADMM Cc1cccc(C(C)C)c1[N-]S(=O)(=O)c1cc(F)cc(F)c1 ZINC000016130545 1025877447 /nfs/dbraw/zinc/87/74/47/1025877447.db2.gz JXUWUMCPFUNZII-UHFFFAOYSA-N -1 1 325.380 4.197 20 0 EIADMM CCOc1ccc2cc(C(=O)Nc3ccc([O-])c(Cl)c3)[nH]c2c1 ZINC000111666519 1026314812 /nfs/dbraw/zinc/31/48/12/1026314812.db2.gz HPACWHWMTNUQAI-UHFFFAOYSA-N -1 1 330.771 4.178 20 0 EIADMM CCc1ccc(-c2ccc(CN[C@@H](Cc3ccccc3)C(=O)[O-])o2)cc1 ZINC000426695331 1026482523 /nfs/dbraw/zinc/48/25/23/1026482523.db2.gz IVZNFQCILIOBPM-FQEVSTJZSA-N -1 1 349.430 4.295 20 0 EIADMM Cc1cccc([C@H](NCc2cc3ccccc3s2)C(=O)[O-])c1C ZINC000426719341 1026502316 /nfs/dbraw/zinc/50/23/16/1026502316.db2.gz FVUJSPPYADGIOD-SFHVURJKSA-N -1 1 325.433 4.434 20 0 EIADMM O=C([O-])[C@H](NCc1ccc(Cl)cc1F)c1cccc(Cl)c1 ZINC000426732626 1026514000 /nfs/dbraw/zinc/51/40/00/1026514000.db2.gz URJZQTXTZJUKDK-CQSZACIVSA-N -1 1 328.170 4.048 20 0 EIADMM Cc1cc(C)cc([C@@H](NCc2cc3ccccc3s2)C(=O)[O-])c1 ZINC000426748285 1026532534 /nfs/dbraw/zinc/53/25/34/1026532534.db2.gz WDKWOLNYSYTSAZ-GOSISDBHSA-N -1 1 325.433 4.434 20 0 EIADMM Cc1ccc([C@H](CC(=O)[O-])NCc2cccc(OC3CCCC3)c2)o1 ZINC000426766193 1026533431 /nfs/dbraw/zinc/53/34/31/1026533431.db2.gz XSHCLHGSSJSXEM-SFHVURJKSA-N -1 1 343.423 4.215 20 0 EIADMM O=C([O-])[C@@H](NCc1ccccc1Cl)c1ccc(Cl)c(F)c1 ZINC000426762868 1026547195 /nfs/dbraw/zinc/54/71/95/1026547195.db2.gz ODALWKFCNRCRQL-AWEZNQCLSA-N -1 1 328.170 4.048 20 0 EIADMM Cc1ccc([C@H](CC(=O)[O-])NCc2cc(F)cc(C(F)(F)F)c2)o1 ZINC000426785127 1026558425 /nfs/dbraw/zinc/55/84/25/1026558425.db2.gz VSUVNJXIBQLRFN-ZDUSSCGKSA-N -1 1 345.292 4.052 20 0 EIADMM C[C@H](NCc1cccc([O-])c1Cl)c1ccc(Br)cn1 ZINC000645177825 1026572104 /nfs/dbraw/zinc/57/21/04/1026572104.db2.gz SNMLDLVVXPHFRQ-VIFPVBQESA-N -1 1 341.636 4.054 20 0 EIADMM O=C(c1ccc(C(F)(F)F)c([O-])c1)N1CC[C@H](c2ccccc2)C1 ZINC000684871436 1026636734 /nfs/dbraw/zinc/63/67/34/1026636734.db2.gz AHLHSXKTYWSKFZ-AWEZNQCLSA-N -1 1 335.325 4.041 20 0 EIADMM O=C(c1ccc(C(F)(F)F)c([O-])c1)N1CCC2(C1)CCCCC2 ZINC000684875016 1026648040 /nfs/dbraw/zinc/64/80/40/1026648040.db2.gz BJUDGBPULKRPIR-UHFFFAOYSA-N -1 1 327.346 4.207 20 0 EIADMM O=C(NCCc1cc2ccccc2o1)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684875248 1026648756 /nfs/dbraw/zinc/64/87/56/1026648756.db2.gz DYFBHAGKPBJEPK-UHFFFAOYSA-N -1 1 349.308 4.130 20 0 EIADMM C[C@H]1CN(C(=O)c2ccc(C(F)(F)F)c([O-])c2)[C@H]1c1ccccc1 ZINC000684876075 1026652785 /nfs/dbraw/zinc/65/27/85/1026652785.db2.gz PKOKXQWDUNQZTF-MEDUHNTESA-N -1 1 335.325 4.244 20 0 EIADMM CC(C)(C)c1ccccc1S(=O)(=O)[N-]c1ccc2cc[nH]c2c1 ZINC000432648964 1026673301 /nfs/dbraw/zinc/67/33/01/1026673301.db2.gz LNFRSUJQGUYSAD-UHFFFAOYSA-N -1 1 328.437 4.266 20 0 EIADMM COC(=O)c1c[n-]c(S[C@@H]2CCc3c2cc(Cl)cc3Cl)n1 ZINC000432664068 1026687489 /nfs/dbraw/zinc/68/74/89/1026687489.db2.gz DHASPCBWMYGRPA-GFCCVEGCSA-N -1 1 343.235 4.283 20 0 EIADMM COC(=O)c1c[n-]c(S[C@@H](C)c2ccc(Cl)c(Cl)c2)n1 ZINC000432669900 1026697221 /nfs/dbraw/zinc/69/72/21/1026697221.db2.gz ZJLUWZAWLWVAGT-ZETCQYMHSA-N -1 1 331.224 4.356 20 0 EIADMM C[C@@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)c1ncccc1[O-] ZINC000427242851 1026784858 /nfs/dbraw/zinc/78/48/58/1026784858.db2.gz PMEGGIXQVGTOBM-HNNXBMFYSA-N -1 1 332.403 4.287 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2cccc(-c3ncco3)c2C)cc1C ZINC000427332790 1026821179 /nfs/dbraw/zinc/82/11/79/1026821179.db2.gz XHYIIRTVHDOIDE-UHFFFAOYSA-N -1 1 342.420 4.068 20 0 EIADMM CCc1ccccc1S(=O)(=O)[N-]c1cccc(-c2ncco2)c1C ZINC000427353702 1026830871 /nfs/dbraw/zinc/83/08/71/1026830871.db2.gz ZNMPMGJFYVTGLT-UHFFFAOYSA-N -1 1 342.420 4.013 20 0 EIADMM CN(CC1(c2ccccc2)CC1)C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000444375781 1027365320 /nfs/dbraw/zinc/36/53/20/1027365320.db2.gz IWFZEXASCUCFGD-UHFFFAOYSA-N -1 1 349.352 4.215 20 0 EIADMM Cc1cnc(C(=O)N2CCCC[C@H]2c2cccc(Cl)c2)c([O-])c1 ZINC000444665920 1027947108 /nfs/dbraw/zinc/94/71/08/1027947108.db2.gz REPYDGNHEZWTID-HNNXBMFYSA-N -1 1 330.815 4.116 20 0 EIADMM COc1cc(C(=O)N2CC(C)(C)c3ccc(F)cc32)cc(Cl)c1[O-] ZINC000652767825 1028014697 /nfs/dbraw/zinc/01/46/97/1028014697.db2.gz NSYZSOQXMURFIS-UHFFFAOYSA-N -1 1 349.789 4.131 20 0 EIADMM CN(Cc1csc2ccccc12)C(=O)c1c(F)ccc([O-])c1F ZINC000343075347 1028096714 /nfs/dbraw/zinc/09/67/14/1028096714.db2.gz ZTJZOJFRDMEBLX-UHFFFAOYSA-N -1 1 333.359 4.157 20 0 EIADMM CCOc1cc(C(=O)Nc2ccsc2Cl)cc(Cl)c1[O-] ZINC000189495737 1028151001 /nfs/dbraw/zinc/15/10/01/1028151001.db2.gz XRZYUYAIQAHVOA-UHFFFAOYSA-N -1 1 332.208 4.412 20 0 EIADMM O=C(CSc1nnc(-c2ccc(Cl)cc2)o1)c1ccc([O-])cc1 ZINC000016062934 1028204095 /nfs/dbraw/zinc/20/40/95/1028204095.db2.gz WGXHBZDYKIMQCJ-UHFFFAOYSA-N -1 1 346.795 4.071 20 0 EIADMM CC[C@@H](C)[C@@H](C)[N-]S(=O)(=O)c1c(Cl)cccc1C(F)(F)F ZINC000523567147 1028218010 /nfs/dbraw/zinc/21/80/10/1028218010.db2.gz RWISACNKLDSGKL-RKDXNWHRSA-N -1 1 343.798 4.072 20 0 EIADMM CCN(Cc1ccc(-c2ccc(C(F)(F)F)cc2)o1)[C@H](C)C(=O)[O-] ZINC000262257546 1028311698 /nfs/dbraw/zinc/31/16/98/1028311698.db2.gz QKKUCXYTIQNZSX-LLVKDONJSA-N -1 1 341.329 4.260 20 0 EIADMM C[C@@H](CC(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)c1cccc(F)c1 ZINC000523851416 1028421331 /nfs/dbraw/zinc/42/13/31/1028421331.db2.gz PDAZTODAGGXEEM-LBPRGKRZSA-N -1 1 339.370 4.054 20 0 EIADMM CCOc1cc(-c2noc(CCc3ccc(C)o3)n2)cc(Cl)c1[O-] ZINC000445405010 1028517596 /nfs/dbraw/zinc/51/75/96/1028517596.db2.gz DOQLYTRGVKOGPF-UHFFFAOYSA-N -1 1 348.786 4.181 20 0 EIADMM CCOc1cc(-c2noc([C@H]3Cc4ccccc43)n2)cc(Cl)c1[O-] ZINC000445432515 1028530309 /nfs/dbraw/zinc/53/03/09/1028530309.db2.gz TVVFOXBCXZNTGF-ZDUSSCGKSA-N -1 1 342.782 4.182 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cc(-c4cccs4)[nH]n3)n2)c(Cl)c1 ZINC000445449835 1028536977 /nfs/dbraw/zinc/53/69/77/1028536977.db2.gz ZWDAJMFACGWKBP-UHFFFAOYSA-N -1 1 344.783 4.214 20 0 EIADMM [O-]c1ccc(-c2noc([C@@H]3C[C@]34CCc3ccccc34)n2)c(Cl)c1 ZINC000445445798 1028574201 /nfs/dbraw/zinc/57/42/01/1028574201.db2.gz KIWYQCGHUHCOJI-KXBFYZLASA-N -1 1 338.794 4.467 20 0 EIADMM [O-]c1ccc(-c2noc(C3=Cc4cc(Cl)ccc4OC3)n2)c(F)c1 ZINC000445465336 1028585478 /nfs/dbraw/zinc/58/54/78/1028585478.db2.gz XZJNZAZUSJQAIO-UHFFFAOYSA-N -1 1 344.729 4.168 20 0 EIADMM Cc1ccc(-c2noc(-c3cc(F)ccc3[O-])n2)cc1N1CCCC1 ZINC000583361128 1028586290 /nfs/dbraw/zinc/58/62/90/1028586290.db2.gz ALVUPSVUPQJHFT-UHFFFAOYSA-N -1 1 339.370 4.157 20 0 EIADMM O=C(CCc1nc(-c2ccc([O-])c(F)c2)no1)c1ccc(Cl)cc1 ZINC000445472731 1028601993 /nfs/dbraw/zinc/60/19/93/1028601993.db2.gz LSZIESFWHVHTQD-UHFFFAOYSA-N -1 1 346.745 4.050 20 0 EIADMM [O-]c1ccc(-c2noc(/C=C/c3ccccc3OC(F)F)n2)cc1F ZINC000445471564 1028602042 /nfs/dbraw/zinc/60/20/42/1028602042.db2.gz HKOCNLUQFCUZHX-SOFGYWHQSA-N -1 1 348.280 4.353 20 0 EIADMM [O-]c1ccc(-c2noc(Cc3c[nH]c4cc(F)ccc34)n2)c(Cl)c1 ZINC000445452209 1028604070 /nfs/dbraw/zinc/60/40/70/1028604070.db2.gz AWJOIDYXOFITGU-UHFFFAOYSA-N -1 1 343.745 4.307 20 0 EIADMM [O-]c1ccc(-c2noc([C@H]3CCSc4ccccc43)n2)c(F)c1 ZINC000445454697 1028608091 /nfs/dbraw/zinc/60/80/91/1028608091.db2.gz ABMTVCDLVYTWAS-LBPRGKRZSA-N -1 1 328.368 4.209 20 0 EIADMM Cc1cccc2c(CCc3nc(-c4ccc([O-])cc4F)no3)c[nH]c21 ZINC000445454997 1028610594 /nfs/dbraw/zinc/61/05/94/1028610594.db2.gz NTMCBTNIVYWLIE-UHFFFAOYSA-N -1 1 337.354 4.156 20 0 EIADMM Cc1ccc(-c2nc(-c3nc(-c4ccc([O-])cc4F)no3)cs2)o1 ZINC000445461637 1028619624 /nfs/dbraw/zinc/61/96/24/1028619624.db2.gz BBZRHRRCNUTIMJ-UHFFFAOYSA-N -1 1 343.339 4.273 20 0 EIADMM Cc1ccc(CSCc2nc(-c3ccc([O-])c(F)c3)no2)cc1 ZINC000445476946 1028624971 /nfs/dbraw/zinc/62/49/71/1028624971.db2.gz KJLUYZCWPKCLLE-UHFFFAOYSA-N -1 1 330.384 4.323 20 0 EIADMM COc1ccccc1/C(C)=C\c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445481005 1028630564 /nfs/dbraw/zinc/63/05/64/1028630564.db2.gz NDWARPBHVTZLFB-LUAWRHEFSA-N -1 1 326.327 4.150 20 0 EIADMM CC[C@@H](Oc1ccccc1C)c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445485325 1028635852 /nfs/dbraw/zinc/63/58/52/1028635852.db2.gz ZELCSXCSNZVTLV-OAHLLOKOSA-N -1 1 328.343 4.420 20 0 EIADMM [O-]c1ccc(-c2noc(C3(c4cccc(F)c4)CCC3)n2)cc1F ZINC000445475319 1028644383 /nfs/dbraw/zinc/64/43/83/1028644383.db2.gz TUBRRDQBNDHKGB-UHFFFAOYSA-N -1 1 328.318 4.190 20 0 EIADMM Cc1ccc(-c2cc(-c3nc(-c4ccc([O-])c(F)c4)no3)on2)cc1 ZINC000445476898 1028648199 /nfs/dbraw/zinc/64/81/99/1028648199.db2.gz JPKYIMRPWICYLJ-UHFFFAOYSA-N -1 1 337.310 4.212 20 0 EIADMM Cc1cc(Nc2c([O-])c(Br)ccc2Cl)ccc1CO ZINC001211592406 1028995352 /nfs/dbraw/zinc/99/53/52/1028995352.db2.gz XUFYYRNSERKGRE-UHFFFAOYSA-N -1 1 342.620 4.352 20 0 EIADMM O=c1[nH]c(-c2cc([O-])cc(Cl)c2)nc2cc(C(F)(F)F)ccc12 ZINC000487518693 1029013240 /nfs/dbraw/zinc/01/32/40/1029013240.db2.gz XEJVFHPHCRLHDR-UHFFFAOYSA-N -1 1 340.688 4.380 20 0 EIADMM Cc1ccc(-c2csc(NC(=O)c3c(F)ccc([O-])c3F)n2)cc1 ZINC000536104107 1029051219 /nfs/dbraw/zinc/05/12/19/1029051219.db2.gz ZMKKOQRIGOVJHB-UHFFFAOYSA-N -1 1 346.358 4.355 20 0 EIADMM CC(C)C1(C)CCN(C(=O)c2ccc(Br)c([O-])c2)CC1 ZINC000428427497 1029055487 /nfs/dbraw/zinc/05/54/87/1029055487.db2.gz QOOICWNPLCHAOH-UHFFFAOYSA-N -1 1 340.261 4.053 20 0 EIADMM CCC(CC)c1nnc([N-]C(=O)c2cc(F)c(F)c(F)c2F)s1 ZINC000028701382 1029281243 /nfs/dbraw/zinc/28/12/43/1029281243.db2.gz LWWYTJSQOZYHPD-UHFFFAOYSA-N -1 1 347.337 4.250 20 0 EIADMM Cc1ccc(F)cc1S(=O)(=O)[N-]c1ccc(CC(F)(F)F)cc1 ZINC000525009511 1029384124 /nfs/dbraw/zinc/38/41/24/1029384124.db2.gz FIDQHOAHOQHWTJ-UHFFFAOYSA-N -1 1 347.333 4.040 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N1CC=C(c2ccc(F)cc2)CC1 ZINC000193256013 1029594567 /nfs/dbraw/zinc/59/45/67/1029594567.db2.gz OYABRBZNVAYUGP-UHFFFAOYSA-N -1 1 331.774 4.114 20 0 EIADMM CCCC1CCC(NC(=O)c2cc(Cl)c([O-])c(OC)c2)CC1 ZINC000443342050 1029607067 /nfs/dbraw/zinc/60/70/67/1029607067.db2.gz JKGMYTPTNQINLW-UHFFFAOYSA-N -1 1 325.836 4.143 20 0 EIADMM CC(C)[C@@H]1CN([C@@H](C(=O)[O-])c2ccc(Cl)cc2Cl)CCS1 ZINC000565107293 1029651570 /nfs/dbraw/zinc/65/15/70/1029651570.db2.gz UWKJFFZYGVIZLD-UONOGXRCSA-N -1 1 348.295 4.193 20 0 EIADMM O=C([O-])c1csc(CN2CCCC[C@@H]2CCCc2ccccc2)n1 ZINC000584236905 1029685160 /nfs/dbraw/zinc/68/51/60/1029685160.db2.gz CHAXBEUVXLBKSF-MRXNPFEDSA-N -1 1 344.480 4.219 20 0 EIADMM Cc1nc(-c2ccc(N3CCC[C@@H](CC(C)C)C3)nc2)[n-]c(=O)c1C ZINC000301651880 1029780851 /nfs/dbraw/zinc/78/08/51/1029780851.db2.gz SRZZFKCUHGVWED-INIZCTEOSA-N -1 1 340.471 4.124 20 0 EIADMM O=C([N-]c1c(F)cccc1F)c1c(F)ccc(Br)c1F ZINC000447178655 1029908877 /nfs/dbraw/zinc/90/88/77/1029908877.db2.gz ZZVQRPHIEIROOW-UHFFFAOYSA-N -1 1 348.093 4.258 20 0 EIADMM Cc1cccc([C@@H]2CCCN2C(=O)c2ccc3ccccc3c2[O-])n1 ZINC000092759309 1029944991 /nfs/dbraw/zinc/94/49/91/1029944991.db2.gz XDHISMOBMBBJMS-IBGZPJMESA-N -1 1 332.403 4.226 20 0 EIADMM O=S(=O)([N-]c1ccc2ncccc2c1)c1cccc2ccccc21 ZINC000145591948 1030085070 /nfs/dbraw/zinc/08/50/70/1030085070.db2.gz OKRMGFARPBCKIO-UHFFFAOYSA-N -1 1 334.400 4.189 20 0 EIADMM Cc1ccc(C(F)(F)F)cc1[N-]S(=O)(=O)c1ccc(Cl)cc1 ZINC000207987178 1030130492 /nfs/dbraw/zinc/13/04/92/1030130492.db2.gz MOBYPJHHLBJXMU-UHFFFAOYSA-N -1 1 349.761 4.468 20 0 EIADMM [O-]c1ccc(-c2noc(-c3ccc(C(F)(F)F)s3)n2)c(F)c1 ZINC000685365838 1030236548 /nfs/dbraw/zinc/23/65/48/1030236548.db2.gz RKYYEEUKGXYKDN-UHFFFAOYSA-N -1 1 330.262 4.329 20 0 EIADMM [O-]c1ccc(-c2noc(-c3ccccc3OC3CCC3)n2)cc1F ZINC000685366101 1030237112 /nfs/dbraw/zinc/23/71/12/1030237112.db2.gz PWGYSVHXTVNBHQ-UHFFFAOYSA-N -1 1 326.327 4.180 20 0 EIADMM O=C(Nc1ccc(-c2cc[nH]n2)cc1)Nc1ccc([O-])c(Cl)c1 ZINC000192216639 1030693670 /nfs/dbraw/zinc/69/36/70/1030693670.db2.gz SVBDZLVLSZVWMG-UHFFFAOYSA-N -1 1 328.759 4.080 20 0 EIADMM Cc1noc(-c2ccccc2)c1[N-]C(=O)c1ccoc1Br ZINC000192481136 1030696822 /nfs/dbraw/zinc/69/68/22/1030696822.db2.gz DWRHQRXSOUYJML-UHFFFAOYSA-N -1 1 347.168 4.258 20 0 EIADMM CCC[C@@H]1CCCC[C@@H]1NC(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC000527487391 1030701630 /nfs/dbraw/zinc/70/16/30/1030701630.db2.gz PRCHMHPUZDNHSX-RISCZKNCSA-N -1 1 325.836 4.143 20 0 EIADMM Cc1cc(C)c([N-]S(=O)(=O)c2c(F)cccc2F)c(Cl)c1 ZINC000612038041 1030825315 /nfs/dbraw/zinc/82/53/15/1030825315.db2.gz SDAQGXYPVLEODI-UHFFFAOYSA-N -1 1 331.771 4.036 20 0 EIADMM CC[C@@H]1CCC[N@@H+](Cc2ccc(C(=O)[O-])cc2Br)CC1 ZINC000226732178 1031103094 /nfs/dbraw/zinc/10/30/94/1031103094.db2.gz CDQKITOCCFFFRA-GFCCVEGCSA-N -1 1 340.261 4.159 20 0 EIADMM C[C@@H]1[C@H](CC(F)(F)F)C[C@H](C)N1C(=O)c1ccc(Cl)cc1[O-] ZINC000452660411 1031230628 /nfs/dbraw/zinc/23/06/28/1031230628.db2.gz KIZAOCPVKWCCEM-AEJSXWLSSA-N -1 1 335.753 4.237 20 0 EIADMM O=C(Nc1ccc(F)cc1[O-])c1cc(Cl)ccc1Br ZINC000532620926 1031433316 /nfs/dbraw/zinc/43/33/16/1031433316.db2.gz ITQXLDSAHFMPAZ-UHFFFAOYSA-N -1 1 344.567 4.200 20 0 EIADMM CCOC(=O)c1cnc(C(C)=Cc2ccc(C3CCC3)cc2)[n-]c1=O ZINC000453016822 1031490193 /nfs/dbraw/zinc/49/01/93/1031490193.db2.gz BQUXPFNNUGOADK-QBFSEMIESA-N -1 1 338.407 4.187 20 0 EIADMM CCCCc1nnc([N-]C(=O)c2nc(-c3cccs3)oc2C)s1 ZINC000047075710 1033556922 /nfs/dbraw/zinc/55/69/22/1033556922.db2.gz VRTXPNSHIDYQOF-UHFFFAOYSA-N -1 1 348.453 4.158 20 0 EIADMM [O-]c1cccc(CN[C@H](c2nccs2)c2ccccc2)c1Cl ZINC000645151782 1033849146 /nfs/dbraw/zinc/84/91/46/1033849146.db2.gz JFKQVDXNAZPUOK-INIZCTEOSA-N -1 1 330.840 4.381 20 0 EIADMM Cc1cccc(O)c1[N-]S(=O)(=O)c1c(C)c(C)c(C)c(C)c1C ZINC000433831936 1034949405 /nfs/dbraw/zinc/94/94/05/1034949405.db2.gz GQTCTWYSMDOICB-UHFFFAOYSA-N -1 1 333.453 4.044 20 0 EIADMM COc1ccc(-c2csc3[n-]c(-c4coc(C)n4)nc(=O)c23)cc1 ZINC000345201514 1035145231 /nfs/dbraw/zinc/14/52/31/1035145231.db2.gz JZPORFRUICLVOB-UHFFFAOYSA-N -1 1 339.376 4.036 20 0 EIADMM Cc1oc2ccccc2c1C(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC000345262148 1035182485 /nfs/dbraw/zinc/18/24/85/1035182485.db2.gz MTLXQZUUCQXJBB-UHFFFAOYSA-N -1 1 333.347 4.089 20 0 EIADMM CCc1oc(CN[C@@H](c2ccc(OC)cc2)C2CCC2)cc1C(=O)[O-] ZINC000905750506 1035875545 /nfs/dbraw/zinc/87/55/45/1035875545.db2.gz KZMMFIVVKFVCSI-LJQANCHMSA-N -1 1 343.423 4.180 20 0 EIADMM CC(C)Sc1ccc([C@H](C)NCc2ccc(C(=O)[O-])cn2)cc1 ZINC000905724920 1035875931 /nfs/dbraw/zinc/87/59/31/1035875931.db2.gz PLYPTMJNUIQFLR-ZDUSSCGKSA-N -1 1 330.453 4.131 20 0 EIADMM COc1cc([C@H](C)NCc2cc(C(=O)[O-])oc2C)cc2ccccc21 ZINC000905798668 1035895977 /nfs/dbraw/zinc/89/59/77/1035895977.db2.gz IVQGJQMRQRCIMB-LBPRGKRZSA-N -1 1 339.391 4.299 20 0 EIADMM Cc1csc(-c2cccc([N-]S(=O)(=O)c3cccc(C)c3)c2)n1 ZINC000588077675 1036205504 /nfs/dbraw/zinc/20/55/04/1036205504.db2.gz IREMKSBPEADYDI-UHFFFAOYSA-N -1 1 344.461 4.228 20 0 EIADMM COc1ccc([N-]S(=O)(=O)c2ccccc2-c2ccccc2)cc1 ZINC000485803775 1036284173 /nfs/dbraw/zinc/28/41/73/1036284173.db2.gz YKJNUWLVWZPLGP-UHFFFAOYSA-N -1 1 339.416 4.163 20 0 EIADMM COc1c(Cl)cc([N-]S(=O)(=O)c2ccccc2C)cc1Cl ZINC000589435172 1036798261 /nfs/dbraw/zinc/79/82/61/1036798261.db2.gz MQQRMUNTRSIZGK-UHFFFAOYSA-N -1 1 346.235 4.111 20 0 EIADMM CCCOc1cccc([N-]S(=O)(=O)c2ccc(C(F)F)cc2)c1 ZINC000572876073 1036845222 /nfs/dbraw/zinc/84/52/22/1036845222.db2.gz OEJZURQKTLLTSQ-UHFFFAOYSA-N -1 1 341.379 4.214 20 0 EIADMM CCOc1cc(C(=O)N2CC[C@@H](C3CCCC3)C2)cc(Cl)c1[O-] ZINC000421951007 1036866657 /nfs/dbraw/zinc/86/66/57/1036866657.db2.gz PBQDOJPNNDTYIP-CYBMUJFWSA-N -1 1 337.847 4.097 20 0 EIADMM Cc1c(NC(=O)Nc2ccc([O-])c(Cl)c2)cnn1CCC(C)C ZINC000486903665 1036889666 /nfs/dbraw/zinc/88/96/66/1036889666.db2.gz FCKJWLRYZIJNFL-UHFFFAOYSA-N -1 1 336.823 4.241 20 0 EIADMM C[C@H](CC1CCCC1)C(=O)Nc1cccc([O-])c1Br ZINC000908714020 1036925629 /nfs/dbraw/zinc/92/56/29/1036925629.db2.gz ZBDJMEMJLQAYMK-SNVBAGLBSA-N -1 1 326.234 4.310 20 0 EIADMM O=C([O-])C[C@@H](NCc1ccc(Cl)cc1Cl)c1cccs1 ZINC000037087934 1036996230 /nfs/dbraw/zinc/99/62/30/1036996230.db2.gz UYTJKOKAZZGUFV-GFCCVEGCSA-N -1 1 330.236 4.361 20 0 EIADMM CC(C)C[C@@H](C)n1nccc1NC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000487190779 1037040601 /nfs/dbraw/zinc/04/06/01/1037040601.db2.gz BDDJKVHHDGUNPY-LLVKDONJSA-N -1 1 336.823 4.493 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)Nc1cc(Cl)c(Cl)cn1 ZINC000487227044 1037059687 /nfs/dbraw/zinc/05/96/87/1037059687.db2.gz YNGFETQTWRXJHT-UHFFFAOYSA-N -1 1 332.574 4.391 20 0 EIADMM CCCOc1ccccc1[N-]S(=O)(=O)Cc1cccc(Cl)c1 ZINC000573109403 1037340467 /nfs/dbraw/zinc/34/04/67/1037340467.db2.gz HCTYGBBMDLHQRA-UHFFFAOYSA-N -1 1 339.844 4.071 20 0 EIADMM CCOc1ccc([C@@H]2CCCN2Cc2cc(C)c(C(=O)[O-])o2)cc1 ZINC000573259343 1037457667 /nfs/dbraw/zinc/45/76/67/1037457667.db2.gz SSWHVJLDQQTJGH-KRWDZBQOSA-N -1 1 329.396 4.022 20 0 EIADMM O=C(CCc1ccc(Cl)cc1Cl)Nc1c([O-])cccc1F ZINC000605437969 1037786271 /nfs/dbraw/zinc/78/62/71/1037786271.db2.gz QSEWFGHHQVMKDW-UHFFFAOYSA-N -1 1 328.170 4.409 20 0 EIADMM CCc1cccc(CC)c1S(=O)(=O)[N-]c1cccc([C@H](C)OC)c1 ZINC000605496042 1037823979 /nfs/dbraw/zinc/82/39/79/1037823979.db2.gz WPOQCYFMVSGMRH-AWEZNQCLSA-N -1 1 347.480 4.320 20 0 EIADMM O=S(=O)([N-]CCCC1CC1)c1c(Cl)cc(Cl)cc1Cl ZINC000605589309 1037832472 /nfs/dbraw/zinc/83/24/72/1037832472.db2.gz RZYPVDAYRJHREY-UHFFFAOYSA-N -1 1 342.675 4.115 20 0 EIADMM CCC(C)(C)c1ccc(CNC(=O)c2c(F)ccc([O-])c2F)cc1 ZINC000574082822 1037919080 /nfs/dbraw/zinc/91/90/80/1037919080.db2.gz YSCIIGPUIIGNSA-UHFFFAOYSA-N -1 1 333.378 4.288 20 0 EIADMM Cc1ccccc1S(=O)(=O)[N-]c1ccc(COC2CCCC2)cc1 ZINC000606828052 1038266388 /nfs/dbraw/zinc/26/63/88/1038266388.db2.gz IYXZTURRPQPXHC-UHFFFAOYSA-N -1 1 345.464 4.255 20 0 EIADMM Cc1nc2cc([N-]S(=O)(=O)c3ccccc3C(C)(C)C)ccc2o1 ZINC000460441843 1038800983 /nfs/dbraw/zinc/80/09/83/1038800983.db2.gz YYIQQEYSAYCXKC-UHFFFAOYSA-N -1 1 344.436 4.235 20 0 EIADMM CCc1ccc(-c2ccc(CN3CCC[C@@H](C)[C@H]3C(=O)[O-])o2)cc1 ZINC000424424459 1038844701 /nfs/dbraw/zinc/84/47/01/1038844701.db2.gz WSLQPEGQGYYONA-KUHUBIRLSA-N -1 1 327.424 4.194 20 0 EIADMM C[C@H]1CCCN(Cc2ccc(Cl)c(C(F)(F)F)c2)[C@H]1C(=O)[O-] ZINC000424413225 1038850412 /nfs/dbraw/zinc/85/04/12/1038850412.db2.gz FIOIPHQRILXNEW-TVQRCGJNSA-N -1 1 335.753 4.044 20 0 EIADMM C[C@H]1CCCN(Cc2ccc(-c3ccccc3Cl)o2)[C@@H]1C(=O)[O-] ZINC000424414253 1038851606 /nfs/dbraw/zinc/85/16/06/1038851606.db2.gz GZDWSIVSBDPZGF-SJCJKPOMSA-N -1 1 333.815 4.285 20 0 EIADMM CCCCCOc1ccc(S(=O)(=O)[N-]c2ccsc2)cc1 ZINC000462107162 1038908438 /nfs/dbraw/zinc/90/84/38/1038908438.db2.gz XWITXUNCVCYIOX-UHFFFAOYSA-N -1 1 325.455 4.118 20 0 EIADMM CC(C)(C)c1nc2cc(NC(=O)c3c(F)ccc([O-])c3F)ccc2o1 ZINC000539371501 1039015395 /nfs/dbraw/zinc/01/53/95/1039015395.db2.gz XMISBLBJNLJLAE-UHFFFAOYSA-N -1 1 346.333 4.361 20 0 EIADMM CCSc1cccc([N-]S(=O)(=O)c2cccc3ncccc32)c1 ZINC000505318121 1039214392 /nfs/dbraw/zinc/21/43/92/1039214392.db2.gz SQURJFRFCIDUOP-UHFFFAOYSA-N -1 1 344.461 4.148 20 0 EIADMM Cc1cccc([C@H]2CCCN2C(=O)c2cc3ccccc3cc2[O-])n1 ZINC000092759290 1039584179 /nfs/dbraw/zinc/58/41/79/1039584179.db2.gz BSOPFFARHXAJCZ-LJQANCHMSA-N -1 1 332.403 4.226 20 0 EIADMM CC(C)c1cccc(O[C@@H](C)C(=O)Nc2ccc([O-])c(F)c2F)c1 ZINC000456792180 1039607703 /nfs/dbraw/zinc/60/77/03/1039607703.db2.gz HAOJJDPGKAYZRV-NSHDSACASA-N -1 1 335.350 4.200 20 0 EIADMM CCC(F)(F)C(C)(C)CNC(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC000628880225 1039825268 /nfs/dbraw/zinc/82/52/68/1039825268.db2.gz MUNFVYSMPQOOAE-UHFFFAOYSA-N -1 1 339.304 4.212 20 0 EIADMM COc1cc(C(=O)N(C(C)C)C2CC(C)(C)C2)cc(Cl)c1[O-] ZINC000457075493 1039827725 /nfs/dbraw/zinc/82/77/25/1039827725.db2.gz OXDCMXYPYWDOOF-UHFFFAOYSA-N -1 1 325.836 4.093 20 0 EIADMM O=C([O-])c1cc(Cl)ccc1CN1CCCC[C@H]1c1cccnc1 ZINC001142657261 1039850927 /nfs/dbraw/zinc/85/09/27/1039850927.db2.gz SKJBFZDROOIEHU-KRWDZBQOSA-N -1 1 330.815 4.160 20 0 EIADMM CC[C@H](CC(F)F)C(=O)Nc1cc(C)cc(Br)c1[O-] ZINC000457696104 1040226321 /nfs/dbraw/zinc/22/63/21/1040226321.db2.gz RPGLIWHGVOBWDD-MRVPVSSYSA-N -1 1 336.176 4.083 20 0 EIADMM Cc1cc(Br)c([O-])c(NC(=O)CCc2ccccc2)c1 ZINC000482642221 1040405359 /nfs/dbraw/zinc/40/53/59/1040405359.db2.gz SGEBLMKAHSKKNW-UHFFFAOYSA-N -1 1 334.213 4.034 20 0 EIADMM Cc1coc2ccc([N-]S(=O)(=O)c3cccc4ncccc43)cc12 ZINC000479550909 1040455357 /nfs/dbraw/zinc/45/53/57/1040455357.db2.gz CYMIMFBBYIYITM-UHFFFAOYSA-N -1 1 338.388 4.090 20 0 EIADMM C[C@H](c1ccc(C(=O)[O-])o1)N(C)Cc1cccc(OC(F)(F)F)c1 ZINC000568068169 1040490497 /nfs/dbraw/zinc/49/04/97/1040490497.db2.gz GHBJADQKIVMCOL-SNVBAGLBSA-N -1 1 343.301 4.069 20 0 EIADMM C[C@H](C(=O)N=c1cc(-c2cccs2)[n-][nH]1)c1cc2ccccc2o1 ZINC000483224817 1040765734 /nfs/dbraw/zinc/76/57/34/1040765734.db2.gz ZDQYUYIJKYIGCK-NSHDSACASA-N -1 1 337.404 4.049 20 0 EIADMM Cc1ccc(F)cc1S(=O)(=O)[N-]c1cccc(C(C)(F)F)c1 ZINC000436154627 1040911104 /nfs/dbraw/zinc/91/11/04/1040911104.db2.gz RUPUDIAQZVGKMS-UHFFFAOYSA-N -1 1 329.343 4.047 20 0 EIADMM CCc1cc(=O)[n-]c(SCC(=O)c2ccc([C@@H](C)CC)cc2)n1 ZINC000436194840 1040965943 /nfs/dbraw/zinc/96/59/43/1040965943.db2.gz AWHPCIPUGCJCSV-LBPRGKRZSA-N -1 1 330.453 4.233 20 0 EIADMM CCCn1ccc2ccc([N-]S(=O)(=O)c3cccc(C)c3)cc21 ZINC000460827575 1040968542 /nfs/dbraw/zinc/96/85/42/1040968542.db2.gz GOBJUVQIJHWAFH-UHFFFAOYSA-N -1 1 328.437 4.161 20 0 EIADMM CO[C@H](C)c1cccc([N-]S(=O)(=O)c2cccc(C(C)C)c2)c1 ZINC000460831870 1040990181 /nfs/dbraw/zinc/99/01/81/1040990181.db2.gz XCMKZEHXHFAGJJ-CQSZACIVSA-N -1 1 333.453 4.318 20 0 EIADMM CCOc1cc(C(=O)Nc2ccc3cc[nH]c3c2)cc(Cl)c1[O-] ZINC000194806663 1041209189 /nfs/dbraw/zinc/20/91/89/1041209189.db2.gz LULAXVTXIMDJSX-UHFFFAOYSA-N -1 1 330.771 4.178 20 0 EIADMM C/C(=C\c1ccc(Cl)cc1)CN[C@H](C)c1ncc(C(=O)[O-])s1 ZINC000904021612 1041264909 /nfs/dbraw/zinc/26/49/09/1041264909.db2.gz ZFOMOSNYIXKLOC-PFEDMVJOSA-N -1 1 336.844 4.249 20 0 EIADMM Cc1cc(N(C)C)cc(C)c1NC(=O)c1cc2ccccc2cc1[O-] ZINC000436519755 1041303274 /nfs/dbraw/zinc/30/32/74/1041303274.db2.gz AYPOBLHDFPFXAN-UHFFFAOYSA-N -1 1 334.419 4.481 20 0 EIADMM CC(C)(C)c1coc(CNC[C@H](CC(=O)[O-])C2CCCCCC2)n1 ZINC000904026181 1041303734 /nfs/dbraw/zinc/30/37/34/1041303734.db2.gz CPZXNFAQJXSPTF-HNNXBMFYSA-N -1 1 336.476 4.123 20 0 EIADMM O=C(N=c1cc(-c2cccs2)[n-][nH]1)c1ccc(Cl)cc1Cl ZINC000515986577 1041315042 /nfs/dbraw/zinc/31/50/42/1041315042.db2.gz UXAOKMMPJLCBMV-UHFFFAOYSA-N -1 1 338.219 4.119 20 0 EIADMM C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1ccc2ccccc2c1[O-] ZINC000436548276 1041326422 /nfs/dbraw/zinc/32/64/22/1041326422.db2.gz QFFKADNVULYHJK-ABAIWWIYSA-N -1 1 337.341 4.348 20 0 EIADMM Cc1ccccc1C1CCN(C(=O)c2ccc(Cl)cc2[O-])CC1 ZINC000436553365 1041327493 /nfs/dbraw/zinc/32/74/93/1041327493.db2.gz BLNHDLZKQOLHKW-UHFFFAOYSA-N -1 1 329.827 4.374 20 0 EIADMM Cc1cc(N2CCCCCC2)ccc1NC(=O)c1ccc(O)cc1[O-] ZINC000436555739 1041328860 /nfs/dbraw/zinc/32/88/60/1041328860.db2.gz NTINEUZNWOEUTQ-UHFFFAOYSA-N -1 1 340.423 4.039 20 0 EIADMM CC[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)c1cc(F)ccc1[O-] ZINC000436539261 1041333514 /nfs/dbraw/zinc/33/35/14/1041333514.db2.gz NBEDYERCYPTCIO-AEFFLSMTSA-N -1 1 327.399 4.330 20 0 EIADMM COc1ccc(C(=O)N2CC3(CCCC3)c3c2cccc3F)c([O-])c1 ZINC000436541982 1041336425 /nfs/dbraw/zinc/33/64/25/1041336425.db2.gz BKFGMPNZOMKIPD-UHFFFAOYSA-N -1 1 341.382 4.012 20 0 EIADMM O=C(c1cc(F)ccc1[O-])N(CCC(F)(F)F)Cc1ccccc1 ZINC000436575437 1041337584 /nfs/dbraw/zinc/33/75/84/1041337584.db2.gz MUZSSKPSPQWKQS-UHFFFAOYSA-N -1 1 341.304 4.126 20 0 EIADMM CC(=O)Nc1ccc(NC(=O)c2ccc(C(C)C)cc2[O-])c(Cl)c1 ZINC000436560522 1041341686 /nfs/dbraw/zinc/34/16/86/1041341686.db2.gz DJPSYMNQQUYIIH-UHFFFAOYSA-N -1 1 346.814 4.380 20 0 EIADMM C[C@H]1[C@@H](Cc2ccccc2)CCN1C(=O)c1ccc(Cl)cc1[O-] ZINC000436576272 1041341742 /nfs/dbraw/zinc/34/17/42/1041341742.db2.gz PBFUWOACWFWKHO-DZGCQCFKSA-N -1 1 329.827 4.139 20 0 EIADMM CC[C@H](NC(=O)c1ccc2ccccc2c1[O-])c1nc(C)cs1 ZINC000436564833 1041343610 /nfs/dbraw/zinc/34/36/10/1041343610.db2.gz HVXWXXVVKDNOSQ-HNNXBMFYSA-N -1 1 326.421 4.191 20 0 EIADMM O=C(Nc1ccccc1SC1CCCC1)C(=O)c1ccc([O-])cc1 ZINC000436563858 1041344619 /nfs/dbraw/zinc/34/46/19/1041344619.db2.gz FMFBYGRIGXLTOD-UHFFFAOYSA-N -1 1 341.432 4.248 20 0 EIADMM COc1ccc(C(=O)Nc2ccc(OC3CCCC3)c(F)c2)c([O-])c1 ZINC000436565949 1041346913 /nfs/dbraw/zinc/34/69/13/1041346913.db2.gz OHBLXZIFCNDQLL-UHFFFAOYSA-N -1 1 345.370 4.114 20 0 EIADMM CC[C@H](NC(=O)c1cc2ccccc2cc1[O-])c1nc(C)cs1 ZINC000436566895 1041347071 /nfs/dbraw/zinc/34/70/71/1041347071.db2.gz NDOCYNMWSWIEGQ-HNNXBMFYSA-N -1 1 326.421 4.191 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1CC[C@@H](Cc2ccccc2)C1 ZINC000436592705 1041352762 /nfs/dbraw/zinc/35/27/62/1041352762.db2.gz XZQALJFGSVTDBC-KRWDZBQOSA-N -1 1 331.415 4.250 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1CC[C@H](c2ccc(F)cc2)C1 ZINC000436582993 1041360977 /nfs/dbraw/zinc/36/09/77/1041360977.db2.gz FPHYSLCZDBSJPB-INIZCTEOSA-N -1 1 335.378 4.314 20 0 EIADMM Cc1c(CSC(C)C)cccc1NC(=O)c1ccc(O)cc1[O-] ZINC000436618483 1041365705 /nfs/dbraw/zinc/36/57/05/1041365705.db2.gz LWGPTYQPQFKHGA-UHFFFAOYSA-N -1 1 331.437 4.300 20 0 EIADMM COc1cc(-c2nc([C@@H]3C[C@H]3c3ccccc3)no2)cc(Cl)c1[O-] ZINC000436617857 1041375484 /nfs/dbraw/zinc/37/54/84/1041375484.db2.gz PDPLQNIWROZAGP-QWHCGFSZSA-N -1 1 342.782 4.375 20 0 EIADMM Cc1ccccc1[C@H]1CCN(C(=O)c2ccc3ccccc3c2[O-])C1 ZINC000436625752 1041377109 /nfs/dbraw/zinc/37/71/09/1041377109.db2.gz PIJPDKIMECXWGS-KRWDZBQOSA-N -1 1 331.415 4.484 20 0 EIADMM CCC(C)(C)OCc1cccc(NC(=O)c2ccc(O)cc2[O-])c1C ZINC000436626698 1041377652 /nfs/dbraw/zinc/37/76/52/1041377652.db2.gz QGCRRDRASWCXPR-UHFFFAOYSA-N -1 1 343.423 4.364 20 0 EIADMM CN(CCC1CCCCC1)C(=O)c1ccc(Br)cc1[O-] ZINC000436629697 1041379341 /nfs/dbraw/zinc/37/93/41/1041379341.db2.gz JYKSDCKVJDWIJO-UHFFFAOYSA-N -1 1 340.261 4.197 20 0 EIADMM O=S(=O)([N-]c1ccsc1Cl)c1ccc(C(F)(F)F)s1 ZINC000461342554 1041402118 /nfs/dbraw/zinc/40/21/18/1041402118.db2.gz IQBQJODQRYJIGB-UHFFFAOYSA-N -1 1 347.792 4.283 20 0 EIADMM Cc1nc2ccc(-c3noc(-c4ccc([O-])cc4F)n3)cc2s1 ZINC000436687274 1041422895 /nfs/dbraw/zinc/42/28/95/1041422895.db2.gz IGLTVVLKVJTGBH-UHFFFAOYSA-N -1 1 327.340 4.166 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N1CCC(Cc2cccc(F)c2)CC1 ZINC000436710602 1041436706 /nfs/dbraw/zinc/43/67/06/1041436706.db2.gz WKSBFJQKBFYOMT-UHFFFAOYSA-N -1 1 347.817 4.280 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N1CCCn2c(cc3ccccc32)C1 ZINC000436741778 1041450551 /nfs/dbraw/zinc/45/05/51/1041450551.db2.gz TUPBDUWZEQQXFF-UHFFFAOYSA-N -1 1 340.810 4.046 20 0 EIADMM CN(Cc1ccc(F)cc1F)C(=O)c1ccc2ccccc2c1[O-] ZINC000436757469 1041455610 /nfs/dbraw/zinc/45/56/10/1041455610.db2.gz WAAPBUXSZXEXQV-UHFFFAOYSA-N -1 1 327.330 4.096 20 0 EIADMM Cn1cccc1[C@@H]1CCCCCN1C(=O)c1ccc(Cl)cc1[O-] ZINC000436758658 1041456210 /nfs/dbraw/zinc/45/62/10/1041456210.db2.gz ZNOJJCFPNITSSB-INIZCTEOSA-N -1 1 332.831 4.142 20 0 EIADMM C[C@H]1[C@@H](c2ccccc2)CCN1C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436751756 1041463213 /nfs/dbraw/zinc/46/32/13/1041463213.db2.gz NQYLHULBDOOYOP-WFASDCNBSA-N -1 1 349.352 4.429 20 0 EIADMM C[C@H]1C[C@@H](c2ccccc2)CCN1C(=O)c1ccc(Cl)cc1[O-] ZINC000436751216 1041463260 /nfs/dbraw/zinc/46/32/60/1041463260.db2.gz QRRRBBGRVQTYDD-ZFWWWQNUSA-N -1 1 329.827 4.454 20 0 EIADMM CC(C)c1nn(C)cc1-c1noc(-c2ccc3ccccc3c2[O-])n1 ZINC000436773931 1041468824 /nfs/dbraw/zinc/46/88/24/1041468824.db2.gz LDGZWKHMZIFGOT-UHFFFAOYSA-N -1 1 334.379 4.119 20 0 EIADMM CC(C)C(=O)Nc1cccc(NC(=O)c2ccc(C(C)C)cc2[O-])c1 ZINC000436769076 1041476188 /nfs/dbraw/zinc/47/61/88/1041476188.db2.gz KPSRALRZNXQQKB-UHFFFAOYSA-N -1 1 340.423 4.362 20 0 EIADMM O=C([O-])[C@@H]1CN(Cc2c(Cl)ccc(Cl)c2Cl)C[C@H]1C1CC1 ZINC000904431007 1041477386 /nfs/dbraw/zinc/47/73/86/1041477386.db2.gz VWYWBUXWDTZHEN-VHSXEESVSA-N -1 1 348.657 4.189 20 0 EIADMM C[C@H](c1ccc(F)cc1)N(C)C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436796223 1041485010 /nfs/dbraw/zinc/48/50/10/1041485010.db2.gz VBXPFEYHVLGFCK-SNVBAGLBSA-N -1 1 341.304 4.383 20 0 EIADMM CC(C)c1ccc(C(=O)N2CC[C@H](C)c3cccc(O)c32)c([O-])c1 ZINC000436819061 1041487084 /nfs/dbraw/zinc/48/70/84/1041487084.db2.gz MLGVTVQDTYYBND-ZDUSSCGKSA-N -1 1 325.408 4.375 20 0 EIADMM CN(Cc1cccc2[nH]ccc21)C(=O)c1cc2ccccc2cc1[O-] ZINC000436813187 1041493468 /nfs/dbraw/zinc/49/34/68/1041493468.db2.gz DBYNCJVPHNIJEM-UHFFFAOYSA-N -1 1 330.387 4.299 20 0 EIADMM C[C@@H](CCCC(F)(F)F)NC(=O)c1ccc2ccccc2c1[O-] ZINC000436812618 1041493759 /nfs/dbraw/zinc/49/37/59/1041493759.db2.gz BHPTZFVFVAVERX-NSHDSACASA-N -1 1 325.330 4.396 20 0 EIADMM CSc1ccc([O-])c(-c2nc(CCCc3ccccc3)no2)c1 ZINC000904459331 1041494547 /nfs/dbraw/zinc/49/45/47/1041494547.db2.gz CWPNAALLYYQMOD-UHFFFAOYSA-N -1 1 326.421 4.339 20 0 EIADMM CSc1ccc(C)c([N-]S(=O)(=O)c2ccc(Cl)cc2)c1 ZINC000540498859 1041500579 /nfs/dbraw/zinc/50/05/79/1041500579.db2.gz PLMJDIGMLNPZEB-UHFFFAOYSA-N -1 1 327.858 4.171 20 0 EIADMM O=C(Nc1ncc(-c2cccnc2)s1)c1ccc2ccccc2c1[O-] ZINC000436839531 1041509331 /nfs/dbraw/zinc/50/93/31/1041509331.db2.gz PYRCSJTZSLJLRD-UHFFFAOYSA-N -1 1 347.399 4.316 20 0 EIADMM CCc1ccc(C(=O)N2CCc3c2cccc3C(F)(F)F)c([O-])c1 ZINC000436839365 1041510367 /nfs/dbraw/zinc/51/03/67/1041510367.db2.gz LRWOTWBYAMWCGK-UHFFFAOYSA-N -1 1 335.325 4.176 20 0 EIADMM [O-]c1ccc(-c2noc([C@@H]3C[C@@H]3c3ccc(F)cc3F)n2)c(F)c1 ZINC000436875242 1041531677 /nfs/dbraw/zinc/53/16/77/1041531677.db2.gz UEHWAVIIJKWJGC-CHWSQXEVSA-N -1 1 332.281 4.131 20 0 EIADMM Cc1nc2ccc(-c3nc(-c4ccc([O-])c(F)c4)no3)cc2s1 ZINC000436872405 1041531762 /nfs/dbraw/zinc/53/17/62/1041531762.db2.gz KOMQJGRVSMLWEP-UHFFFAOYSA-N -1 1 327.340 4.166 20 0 EIADMM COc1c2ccccc2[nH]c1-c1nc(-c2ccc([O-])cc2Cl)no1 ZINC000436872623 1041531905 /nfs/dbraw/zinc/53/19/05/1041531905.db2.gz NCUPDFUTKRKPMR-UHFFFAOYSA-N -1 1 341.754 4.253 20 0 EIADMM CCOc1cc(-c2noc(C[C@H]3C=CCCC3)n2)cc(Cl)c1[O-] ZINC000436874670 1041532489 /nfs/dbraw/zinc/53/24/89/1041532489.db2.gz AXWYJBGBDMAMAO-NSHDSACASA-N -1 1 334.803 4.393 20 0 EIADMM C[C@H](c1cn(C)c2ccccc12)c1nc(-c2ccc([O-])cc2F)no1 ZINC000436874822 1041533132 /nfs/dbraw/zinc/53/31/32/1041533132.db2.gz RTSGYRLVFHEOML-LLVKDONJSA-N -1 1 337.354 4.225 20 0 EIADMM O=C(NC1(Cc2ccc(Cl)cc2)CCC1)c1ccc([O-])cc1F ZINC000436857753 1041534040 /nfs/dbraw/zinc/53/40/40/1041534040.db2.gz XERMTRWRTXLBDC-UHFFFAOYSA-N -1 1 333.790 4.080 20 0 EIADMM CCOc1cc(-c2noc(/C=C/c3ccn(C)c3)n2)cc(Cl)c1[O-] ZINC000436878942 1041538093 /nfs/dbraw/zinc/53/80/93/1041538093.db2.gz LEEXKTBJQZGZID-SNAWJCMRSA-N -1 1 345.786 4.003 20 0 EIADMM Cc1ccc2ncc(-c3noc(-c4ccc5ccccc5c4[O-])n3)n2c1 ZINC000436882132 1041538989 /nfs/dbraw/zinc/53/89/89/1041538989.db2.gz QQQPDEIGWFXWAN-UHFFFAOYSA-N -1 1 342.358 4.219 20 0 EIADMM Cc1nc(-c2noc(-c3cc(Oc4ccccc4)ccc3[O-])n2)co1 ZINC000436885018 1041540770 /nfs/dbraw/zinc/54/07/70/1041540770.db2.gz MHVKVXISKMSJDB-UHFFFAOYSA-N -1 1 335.319 4.198 20 0 EIADMM Cn1ccc(-c2noc(-c3cc(Oc4ccccc4)ccc3[O-])n2)c1 ZINC000436888978 1041543837 /nfs/dbraw/zinc/54/38/37/1041543837.db2.gz WQRWYVNVGAIHDI-UHFFFAOYSA-N -1 1 333.347 4.240 20 0 EIADMM [O-]c1ccc(Oc2ccccc2)cc1-c1nc(Cc2ccccn2)no1 ZINC000436892823 1041545107 /nfs/dbraw/zinc/54/51/07/1041545107.db2.gz NLJJHYDIFIOLFZ-UHFFFAOYSA-N -1 1 345.358 4.220 20 0 EIADMM COc1ccc(S(=O)(=O)[N-]c2cccc(C(C)C)c2)cc1Cl ZINC000032588517 1041563641 /nfs/dbraw/zinc/56/36/41/1041563641.db2.gz VGXCTPPZCGTODK-UHFFFAOYSA-N -1 1 339.844 4.273 20 0 EIADMM COc1ccc(-c2nc(-c3ccc(C(C)(F)F)cc3)no2)c([O-])c1 ZINC000436957008 1041574975 /nfs/dbraw/zinc/57/49/75/1041574975.db2.gz VFZCCYHGCBVVBG-UHFFFAOYSA-N -1 1 332.306 4.230 20 0 EIADMM CC[C@@H](C)Oc1cccc(NC(=O)c2cc(Cl)c([O-])c(OC)c2)c1 ZINC000436993181 1041583867 /nfs/dbraw/zinc/58/38/67/1041583867.db2.gz ZHMBIHKXSDBQCH-LLVKDONJSA-N -1 1 349.814 4.484 20 0 EIADMM COc1ccc(C(=O)N2C[C@@H](c3ccccc3)c3ccccc32)c([O-])c1 ZINC000437001677 1041588212 /nfs/dbraw/zinc/58/82/12/1041588212.db2.gz KZICCINQTFHXSM-IBGZPJMESA-N -1 1 345.398 4.193 20 0 EIADMM CCNc1cc(C)ccc1NC(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC000436999219 1041593913 /nfs/dbraw/zinc/59/39/13/1041593913.db2.gz MEKFNSVUNXHCSP-UHFFFAOYSA-N -1 1 334.803 4.047 20 0 EIADMM CSc1ccc(S(=O)(=O)[N-]c2ccc(F)cc2)cc1Cl ZINC000463517349 1041612211 /nfs/dbraw/zinc/61/22/11/1041612211.db2.gz YKAHQTRQJAELKV-UHFFFAOYSA-N -1 1 331.821 4.002 20 0 EIADMM O=C([N-]c1nncs1)c1csc(-c2cccc3ccccc32)n1 ZINC000540875147 1041712846 /nfs/dbraw/zinc/71/28/46/1041712846.db2.gz KFHSOWVPWFYXAM-UHFFFAOYSA-N -1 1 338.417 4.067 20 0 EIADMM CO[C@H](C)c1cccc([N-]S(=O)(=O)c2ccc(C3CC3)cc2)c1 ZINC000517216912 1041909458 /nfs/dbraw/zinc/90/94/58/1041909458.db2.gz OMGJLEPTFHSNAI-CYBMUJFWSA-N -1 1 331.437 4.072 20 0 EIADMM O=S(=O)([N-]c1ccsc1)c1ccc(OCc2ccccc2)cc1 ZINC000438779327 1042345409 /nfs/dbraw/zinc/34/54/09/1042345409.db2.gz OCRCSWCXVPPLJM-UHFFFAOYSA-N -1 1 345.445 4.128 20 0 EIADMM CC(C)C(=O)c1ccc(S(=O)(=O)[N-]c2ccc(C(C)C)cc2)cc1 ZINC000438792955 1042351534 /nfs/dbraw/zinc/35/15/34/1042351534.db2.gz OLDOVMOPFOSEGZ-UHFFFAOYSA-N -1 1 345.464 4.450 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2ccc(F)cc2C(F)(F)F)c(C)c1 ZINC000303196691 1042355409 /nfs/dbraw/zinc/35/54/09/1042355409.db2.gz NFRSTMUDIQWODJ-UHFFFAOYSA-N -1 1 347.333 4.262 20 0 EIADMM CC(C)c1ccoc1-c1noc(-c2[n-]cnc2C(=O)c2ccccc2)n1 ZINC000426218965 1042403783 /nfs/dbraw/zinc/40/37/83/1042403783.db2.gz ZCFOAURWZPRARW-UHFFFAOYSA-N -1 1 348.362 4.074 20 0 EIADMM C[C@@H]1C[C@H](c2ccc(F)cc2)CN1C(=O)c1cc(Cl)ccc1[O-] ZINC000303893848 1042526432 /nfs/dbraw/zinc/52/64/32/1042526432.db2.gz SBXDBSALTBGJAI-YPMHNXCESA-N -1 1 333.790 4.203 20 0 EIADMM O=S(=O)([N-]c1ccc(F)c(F)c1F)c1csc2ccccc21 ZINC000506586224 1042641517 /nfs/dbraw/zinc/64/15/17/1042641517.db2.gz ZMVSXZRBCXXLNV-UHFFFAOYSA-N -1 1 343.351 4.119 20 0 EIADMM Cc1noc(C2CC2)c1[N-]C(=O)c1coc(-c2ccccc2Cl)n1 ZINC000346025436 1042856398 /nfs/dbraw/zinc/85/63/98/1042856398.db2.gz NYJKSOUPZWRDEM-UHFFFAOYSA-N -1 1 343.770 4.421 20 0 EIADMM O=S(=O)([N-]c1ccccc1CCC(F)(F)F)c1ccc(F)cc1 ZINC000089103069 1042937441 /nfs/dbraw/zinc/93/74/41/1042937441.db2.gz POWTVNQRUVCMOJ-UHFFFAOYSA-N -1 1 347.333 4.121 20 0 EIADMM CC(C)c1ccc(S(=O)(=O)[N-]c2ccc3ncccc3c2)cc1 ZINC000536457792 1043025032 /nfs/dbraw/zinc/02/50/32/1043025032.db2.gz BDTZRHZZWVNVMU-UHFFFAOYSA-N -1 1 326.421 4.159 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)C1(c2ccc(F)cc2F)CCC1 ZINC000182869563 1043035334 /nfs/dbraw/zinc/03/53/34/1043035334.db2.gz PYFBMNGNWUQOAD-UHFFFAOYSA-N -1 1 337.753 4.384 20 0 EIADMM O=C(Nc1ccc2nc(C(F)F)sc2c1)c1ccc([O-])c(F)c1 ZINC000672299838 1043081635 /nfs/dbraw/zinc/08/16/35/1043081635.db2.gz CXGARQJUFUQXFT-UHFFFAOYSA-N -1 1 338.310 4.331 20 0 EIADMM Cc1ccc(CS(=O)(=O)[N-]c2ccccc2C(F)(F)F)cc1F ZINC000184199908 1043084835 /nfs/dbraw/zinc/08/48/35/1043084835.db2.gz CUTROUMRMMNEAG-UHFFFAOYSA-N -1 1 347.333 4.095 20 0 EIADMM C[C@H](Cc1nc2ccccc2s1)NC(=O)c1c([O-])cccc1Cl ZINC000729526621 1043089139 /nfs/dbraw/zinc/08/91/39/1043089139.db2.gz AHVJXEIRFJLKOI-SNVBAGLBSA-N -1 1 346.839 4.016 20 0 EIADMM O=S(=O)([N-]c1cccc(SC(F)F)c1)c1cccc(Cl)c1 ZINC000727362600 1043208789 /nfs/dbraw/zinc/20/87/89/1043208789.db2.gz DJJYSFVQAHAIQY-UHFFFAOYSA-N -1 1 349.811 4.456 20 0 EIADMM Cc1cnc(C(=O)N2CCCCC[C@H]2/C=C/c2cccs2)c([O-])c1 ZINC000427912192 1043259382 /nfs/dbraw/zinc/25/93/82/1043259382.db2.gz GCVYPZGDYZCUQM-HVHJFMEUSA-N -1 1 342.464 4.255 20 0 EIADMM C[C@@H](C(=O)N=c1cc(-c2cccs2)[n-][nH]1)c1ccc(Cl)s1 ZINC000428028275 1043302606 /nfs/dbraw/zinc/30/26/06/1043302606.db2.gz ROYBMICDZBTYHM-MRVPVSSYSA-N -1 1 337.857 4.017 20 0 EIADMM [O-]c1cccnc1-c1nc(-c2ccc(C(F)(F)F)cc2Cl)no1 ZINC001212480769 1043437698 /nfs/dbraw/zinc/43/76/98/1043437698.db2.gz HQIWMDJXSQUHGQ-UHFFFAOYSA-N -1 1 341.676 4.176 20 0 EIADMM CC(=O)c1ccc(S(=O)(=O)[N-]c2ccccc2CCC(C)C)cc1 ZINC000520913980 1043442290 /nfs/dbraw/zinc/44/22/90/1043442290.db2.gz ANKOEXWEKCAHBS-UHFFFAOYSA-N -1 1 345.464 4.279 20 0 EIADMM Cc1ccc(F)cc1[N-]S(=O)(=O)c1ccc(CC(F)(F)F)cc1 ZINC000189227142 1043494393 /nfs/dbraw/zinc/49/43/93/1043494393.db2.gz RZDNYVULHYLUIT-UHFFFAOYSA-N -1 1 347.333 4.040 20 0 EIADMM C[C@@H](OC(=O)c1ccc(Cl)c(Cl)c1[O-])C(=O)c1ccccc1 ZINC000730360921 1043503445 /nfs/dbraw/zinc/50/34/45/1043503445.db2.gz SLAKFMFTTUSSMJ-SECBINFHSA-N -1 1 339.174 4.127 20 0 EIADMM O=C(OCc1cccnc1Cl)c1ccc(Cl)c(Cl)c1[O-] ZINC000730360282 1043503808 /nfs/dbraw/zinc/50/38/08/1043503808.db2.gz DTURKCLSSQTXQX-UHFFFAOYSA-N -1 1 332.570 4.104 20 0 EIADMM CC(C)[C@H]1N(C(=O)Cc2ccc([O-])c(Cl)c2)CC12CCCCC2 ZINC001626104893 1043834426 /nfs/dbraw/zinc/83/44/26/1043834426.db2.gz AOPZDIBCXZGXFK-GOSISDBHSA-N -1 1 335.875 4.405 20 0 EIADMM CCCCCCOCc1cccc(NC(=O)c2cncc([O-])c2)c1 ZINC000732277204 1043892783 /nfs/dbraw/zinc/89/27/83/1043892783.db2.gz FSOVSMNLSLWYCE-UHFFFAOYSA-N -1 1 328.412 4.136 20 0 EIADMM COc1cc(C(=O)N[C@H]2CCC[C@H]2c2ccccc2)cc(Cl)c1[O-] ZINC000442963979 1043923774 /nfs/dbraw/zinc/92/37/74/1043923774.db2.gz FTKARBUMNKCYBY-HOCLYGCPSA-N -1 1 345.826 4.120 20 0 EIADMM COc1cc(C(=O)Nc2cc(C)ccc2Cl)cc(Cl)c1[O-] ZINC000443054321 1043991229 /nfs/dbraw/zinc/99/12/29/1043991229.db2.gz CQDDUWJVUPYKFM-UHFFFAOYSA-N -1 1 326.179 4.268 20 0 EIADMM CCOc1cc(C(=O)N(C)[C@H]2CCc3ccccc32)cc(Cl)c1[O-] ZINC000193273438 1044028961 /nfs/dbraw/zinc/02/89/61/1044028961.db2.gz SLRSPILKWNRZDC-INIZCTEOSA-N -1 1 345.826 4.204 20 0 EIADMM CCc1ccccc1-c1noc(-c2cc(Cl)c([O-])c(OC)c2)n1 ZINC000443196479 1044083254 /nfs/dbraw/zinc/08/32/54/1044083254.db2.gz LHKMTNJWEVRBEQ-UHFFFAOYSA-N -1 1 330.771 4.334 20 0 EIADMM COc1cc(-c2nc(-c3ccc4cc[nH]c4c3)no2)cc(Cl)c1[O-] ZINC000443202374 1044090223 /nfs/dbraw/zinc/09/02/23/1044090223.db2.gz ZZDAFQDGDUKEBN-UHFFFAOYSA-N -1 1 341.754 4.253 20 0 EIADMM COc1cc(C(=O)Nc2ccc3occ(C)c3c2)cc(Cl)c1[O-] ZINC000443209066 1044100015 /nfs/dbraw/zinc/10/00/15/1044100015.db2.gz QPHIWNAHJJMUSX-UHFFFAOYSA-N -1 1 331.755 4.361 20 0 EIADMM CC(C)[C@@H]1CCCN(C(=O)c2cc(Br)ccc2[O-])CC1 ZINC000227003777 1044333096 /nfs/dbraw/zinc/33/30/96/1044333096.db2.gz HTFYRBPJEGKRKF-GFCCVEGCSA-N -1 1 340.261 4.053 20 0 EIADMM O=C(Nc1c([O-])cccc1F)c1cc(-c2ccccc2Cl)on1 ZINC000608366699 1044370837 /nfs/dbraw/zinc/37/08/37/1044370837.db2.gz WDBODEWFKYMKBA-UHFFFAOYSA-N -1 1 332.718 4.092 20 0 EIADMM CN(C(=O)c1ccc(NC(=O)OC(C)(C)C)cc1[O-])c1ccccc1 ZINC000093900223 1044424776 /nfs/dbraw/zinc/42/47/76/1044424776.db2.gz UPAXMOCRIWOTOH-UHFFFAOYSA-N -1 1 342.395 4.016 20 0 EIADMM O=C([N-]c1nc(-c2ccsc2)ns1)c1cc2cc(F)ccc2o1 ZINC000117659411 1044504284 /nfs/dbraw/zinc/50/42/84/1044504284.db2.gz OCAYZDLQPXQVCQ-UHFFFAOYSA-N -1 1 345.380 4.404 20 0 EIADMM O=S(=O)([N-]c1cc(F)ccc1Cl)c1cccc2c1N=S=N2 ZINC000261388784 1044704914 /nfs/dbraw/zinc/70/49/14/1044704914.db2.gz FUKRRDZDRMUVDH-UHFFFAOYSA-N -1 1 343.792 4.006 20 0 EIADMM CCCCCc1nnc([N-]C(=O)c2coc(C3CCCC3)n2)s1 ZINC000509030283 1044966639 /nfs/dbraw/zinc/96/66/39/1044966639.db2.gz BPXTXPQHICHMBT-UHFFFAOYSA-N -1 1 334.445 4.169 20 0 EIADMM CSc1cccc(S(=O)(=O)[N-]c2ccc(F)c(Cl)c2)c1 ZINC000509099698 1045122298 /nfs/dbraw/zinc/12/22/98/1045122298.db2.gz ONTXOLBBSPRTKC-UHFFFAOYSA-N -1 1 331.821 4.002 20 0 EIADMM O=C(NCC1(c2cccc(Cl)c2)CC1)c1c([O-])cccc1Cl ZINC000740128237 1045181702 /nfs/dbraw/zinc/18/17/02/1045181702.db2.gz MIYHSSVIVJQUDK-UHFFFAOYSA-N -1 1 336.218 4.161 20 0 EIADMM CC(C)Oc1cc(O)ccc1NC(=O)c1ccc(C(C)C)cc1[O-] ZINC000762700655 1045336879 /nfs/dbraw/zinc/33/68/79/1045336879.db2.gz DATZIYMAZWHUCC-UHFFFAOYSA-N -1 1 329.396 4.261 20 0 EIADMM Cc1cccc([C@@H](C)C(=O)[N-]OCc2ccc(C(F)(F)F)cc2)c1 ZINC000746937430 1045552923 /nfs/dbraw/zinc/55/29/23/1045552923.db2.gz BPRWEIXLZSCOSA-CYBMUJFWSA-N -1 1 337.341 4.365 20 0 EIADMM CCOc1cc(/C=C/c2nc(Cl)ncc2C)cc(Cl)c1[O-] ZINC000791435290 1045740804 /nfs/dbraw/zinc/74/08/04/1045740804.db2.gz RRGOFTXMFOIFNQ-SNAWJCMRSA-N -1 1 325.195 4.367 20 0 EIADMM Cc1cnc(Cl)nc1/C=C/c1ccc([O-])c(Br)c1 ZINC000791434814 1045741604 /nfs/dbraw/zinc/74/16/04/1045741604.db2.gz MXTMTDKTRPRAFR-DUXPYHPUSA-N -1 1 325.593 4.077 20 0 EIADMM CC(C)(C)OC(=O)Nc1ccc(OC(=O)c2ccc([O-])c(F)c2)cc1 ZINC000768190175 1045749609 /nfs/dbraw/zinc/74/96/09/1045749609.db2.gz FLMKZCFWPISBPY-UHFFFAOYSA-N -1 1 347.342 4.098 20 0 EIADMM O=C([N-][C@@H](c1ccccc1)C(F)(F)F)C(F)(F)Cc1ccccc1 ZINC000793152977 1046158107 /nfs/dbraw/zinc/15/81/07/1046158107.db2.gz MYZYDRROKAIHFN-AWEZNQCLSA-N -1 1 343.295 4.284 20 0 EIADMM Cc1ccccc1[C@@H]1CN(Cc2cccc([O-])c2Cl)[C@H](C)CO1 ZINC000508708465 1046351034 /nfs/dbraw/zinc/35/10/34/1046351034.db2.gz AUJUOJMCOPSAPZ-KDOFPFPSSA-N -1 1 331.843 4.316 20 0 EIADMM CCC(=O)c1cccc(S(=O)(=O)[N-]c2cccc(Cl)c2C)c1 ZINC000126126274 1046440409 /nfs/dbraw/zinc/44/04/09/1046440409.db2.gz SRPGHCRGBDBVMO-UHFFFAOYSA-N -1 1 337.828 4.042 20 0 EIADMM C[C@H](CC1CC1)[N-]S(=O)(=O)c1c(Cl)cc(Cl)cc1Cl ZINC000497243907 1046486009 /nfs/dbraw/zinc/48/60/09/1046486009.db2.gz AEUFBOPLVOHLDJ-SSDOTTSWSA-N -1 1 342.675 4.114 20 0 EIADMM CCC(=O)c1cccc(S(=O)(=O)[N-]c2cc(SC)ccc2C)c1 ZINC000537194892 1047014521 /nfs/dbraw/zinc/01/45/21/1047014521.db2.gz NWRCXWNNBXTBRD-UHFFFAOYSA-N -1 1 349.477 4.110 20 0 EIADMM CC(C)(CNC(=O)c1c(F)ccc([O-])c1F)c1cccc(Cl)c1 ZINC000537258694 1047063966 /nfs/dbraw/zinc/06/39/66/1047063966.db2.gz FBIJZEDATQOGPH-UHFFFAOYSA-N -1 1 339.769 4.031 20 0 EIADMM CC(C)N(Cc1ccc(Cl)c(Cl)c1)C(=O)c1ncccc1[O-] ZINC000460208140 1047165914 /nfs/dbraw/zinc/16/59/14/1047165914.db2.gz XOLTYNXWCZGLBJ-UHFFFAOYSA-N -1 1 339.222 4.145 20 0 EIADMM Cc1cc(SC(C)(C)C)ccc1NC(=O)C(=O)c1ccc([O-])cc1 ZINC000806742105 1047359694 /nfs/dbraw/zinc/35/96/94/1047359694.db2.gz YKFQQXJCAZASFM-UHFFFAOYSA-N -1 1 343.448 4.413 20 0 EIADMM O=C([N-]c1nnc(C2CCCCC2)s1)c1cc(F)c(F)cc1F ZINC000746801291 1047401489 /nfs/dbraw/zinc/40/14/89/1047401489.db2.gz RJIFJKAZHLHLAZ-UHFFFAOYSA-N -1 1 341.358 4.255 20 0 EIADMM O=C(c1c([O-])cccc1Cl)N1CCC(F)(c2ccccc2)CC1 ZINC000790092891 1047519078 /nfs/dbraw/zinc/51/90/78/1047519078.db2.gz XKPNIGTZGMCQJQ-UHFFFAOYSA-N -1 1 333.790 4.147 20 0 EIADMM CC(C)c1ccc(Cl)c(S(=O)(=O)[N-]c2ccccc2F)c1 ZINC000556351861 1047698904 /nfs/dbraw/zinc/69/89/04/1047698904.db2.gz ICICNLDBZVYSSH-UHFFFAOYSA-N -1 1 327.808 4.403 20 0 EIADMM Cc1cccc(S(=O)(=O)[N-]c2ccc(SC(F)F)cc2)c1 ZINC000033707673 1047792783 /nfs/dbraw/zinc/79/27/83/1047792783.db2.gz WHBKQJLRUYHTHC-UHFFFAOYSA-N -1 1 329.393 4.111 20 0 EIADMM Cc1ccccc1S(=O)(=O)[N-]c1cccc(COC(C)(C)C)c1C ZINC000476422325 1047803194 /nfs/dbraw/zinc/80/31/94/1047803194.db2.gz JQRVHJZQUNQJKM-UHFFFAOYSA-N -1 1 347.480 4.419 20 0 EIADMM Cc1ccc([C@H](C)CNC(=O)c2ccc(C(F)(F)F)c([O-])c2)cc1 ZINC001136845373 1047848477 /nfs/dbraw/zinc/84/84/77/1047848477.db2.gz LZPADZHWYIVIQW-GFCCVEGCSA-N -1 1 337.341 4.253 20 0 EIADMM Cc1ccccc1-c1ccccc1C(=O)Nc1n[n-]c(C(F)(F)F)n1 ZINC001134128218 1047865771 /nfs/dbraw/zinc/86/57/71/1047865771.db2.gz LUALKEHVRHSAMQ-UHFFFAOYSA-N -1 1 346.312 4.051 20 0 EIADMM O=C([N-]c1c(F)cc(F)cc1F)c1nc(-c2ccccc2)cs1 ZINC000072505800 1047922848 /nfs/dbraw/zinc/92/28/48/1047922848.db2.gz NYQOKJJPNZCGDY-UHFFFAOYSA-N -1 1 334.322 4.480 20 0 EIADMM O=C([N-]c1c(F)cc(F)cc1F)c1csc(-c2ccccc2)n1 ZINC000072505706 1047924224 /nfs/dbraw/zinc/92/42/24/1047924224.db2.gz AUPLWOYAARKCDL-UHFFFAOYSA-N -1 1 334.322 4.480 20 0 EIADMM CC(C)(C)Oc1ccccc1CNC(=O)c1c([O-])cccc1Cl ZINC001137031100 1048086579 /nfs/dbraw/zinc/08/65/79/1048086579.db2.gz BMUGDYQAXKNAJT-UHFFFAOYSA-N -1 1 333.815 4.153 20 0 EIADMM CC/C(C)=C(/C)C(=O)Nc1c([O-])cc(Br)cc1Cl ZINC000843887460 1048136009 /nfs/dbraw/zinc/13/60/09/1048136009.db2.gz WTGWZFDBJOKRQG-FPLPWBNLSA-N -1 1 332.625 4.493 20 0 EIADMM O=C(N[C@@H]1CCO[C@@H](c2ccccc2)C1)c1cc2ccccc2cc1[O-] ZINC000132017432 1048181587 /nfs/dbraw/zinc/18/15/87/1048181587.db2.gz GBELBFYNXFRNKL-WIYYLYMNSA-N -1 1 347.414 4.196 20 0 EIADMM [O-]c1cccc(CNc2ccc(O[C@H]3CCCC[C@H]3O)cc2)c1Cl ZINC000815128730 1048341916 /nfs/dbraw/zinc/34/19/16/1048341916.db2.gz LHISCJVPKZSFPI-AEFFLSMTSA-N -1 1 347.842 4.340 20 0 EIADMM CC[C@@H](C(=O)[O-])N(C)Cc1ccc(-c2cccc(C(F)(F)F)c2)o1 ZINC000844935981 1048554143 /nfs/dbraw/zinc/55/41/43/1048554143.db2.gz GSMARUQTNVGNME-AWEZNQCLSA-N -1 1 341.329 4.260 20 0 EIADMM O=c1cc(CSCc2c(F)cccc2F)c2ccc([O-])cc2o1 ZINC000809988006 1048589687 /nfs/dbraw/zinc/58/96/87/1048589687.db2.gz URIFDGHKGMWFCG-UHFFFAOYSA-N -1 1 334.343 4.210 20 0 EIADMM Cc1csc(Nc2cccc(NC(=O)c3ccccc3[O-])c2)n1 ZINC000920270809 1048617946 /nfs/dbraw/zinc/61/79/46/1048617946.db2.gz ADQALWBHZVNTIO-UHFFFAOYSA-N -1 1 325.393 4.153 20 0 EIADMM O=C(NCCc1ccc2ccccc2c1)c1c([O-])cccc1Cl ZINC000920447732 1048676342 /nfs/dbraw/zinc/67/63/42/1048676342.db2.gz URFKZZTYBWNKCY-UHFFFAOYSA-N -1 1 325.795 4.171 20 0 EIADMM O=C(N[C@H]1CCSc2c(F)cccc21)c1c([O-])cccc1Cl ZINC000920431493 1048679393 /nfs/dbraw/zinc/67/93/93/1048679393.db2.gz GZMKRHCQNSGZBM-LBPRGKRZSA-N -1 1 337.803 4.152 20 0 EIADMM [O-]c1cc(F)c(CN(Cc2ccccc2)Cc2ccccn2)c(F)c1 ZINC001144541131 1048720428 /nfs/dbraw/zinc/72/04/28/1048720428.db2.gz BMMMCQQBFMUBAZ-UHFFFAOYSA-N -1 1 340.373 4.268 20 0 EIADMM C[C@H](NC(=O)c1cc(F)ccc1[O-])c1cccc(C(F)(F)F)c1 ZINC001135478941 1048755021 /nfs/dbraw/zinc/75/50/21/1048755021.db2.gz VAABTOXNAZFSGE-VIFPVBQESA-N -1 1 327.277 4.041 20 0 EIADMM [O-]c1cc(F)c(CN2CCc3ccc(C(F)(F)F)cc3C2)cc1F ZINC001144667183 1048787093 /nfs/dbraw/zinc/78/70/93/1048787093.db2.gz VACMAYWXQVPYST-UHFFFAOYSA-N -1 1 343.295 4.248 20 0 EIADMM [O-]c1cc(F)c(CN2CCC[C@@H]2c2c(F)cccc2F)cc1F ZINC001144659489 1048794039 /nfs/dbraw/zinc/79/40/39/1048794039.db2.gz KMWGGDKYOSMNDC-OAHLLOKOSA-N -1 1 325.305 4.286 20 0 EIADMM [O-]c1cc(F)c(CN2CCc3cc(C(F)(F)F)ccc3C2)cc1F ZINC001144659456 1048794660 /nfs/dbraw/zinc/79/46/60/1048794660.db2.gz JNXHTVKOPIFSEK-UHFFFAOYSA-N -1 1 343.295 4.248 20 0 EIADMM CC(C)COc1ccc(C(C)(C)NC(=O)c2cccc([O-])c2F)cc1 ZINC001144693006 1048798409 /nfs/dbraw/zinc/79/84/09/1048798409.db2.gz VZKPDKNERCRXSV-UHFFFAOYSA-N -1 1 345.414 4.231 20 0 EIADMM O=C(Nc1cccc2ncccc21)c1ccc2ccc(O)cc2c1[O-] ZINC001135730568 1048877366 /nfs/dbraw/zinc/87/73/66/1048877366.db2.gz YITAQABYMYUPCR-UHFFFAOYSA-N -1 1 330.343 4.052 20 0 EIADMM COc1nc(C(=O)[N-]c2ccccc2SCc2ccccc2)co1 ZINC001135918487 1048972659 /nfs/dbraw/zinc/97/26/59/1048972659.db2.gz UOSBVJNNBAWWTF-UHFFFAOYSA-N -1 1 340.404 4.228 20 0 EIADMM O=C(c1c([O-])cccc1Cl)N1CC2(CCC2)[C@H]1c1ccccc1 ZINC000817564786 1049002836 /nfs/dbraw/zinc/00/28/36/1049002836.db2.gz DBSQKMKHELJAFW-QGZVFWFLSA-N -1 1 327.811 4.413 20 0 EIADMM O=C(Nc1ccc(OC2CCCCC2)cc1)c1ccc(F)c([O-])c1 ZINC001146747915 1049053957 /nfs/dbraw/zinc/05/39/57/1049053957.db2.gz DQPALAYAKGHDFB-UHFFFAOYSA-N -1 1 329.371 4.495 20 0 EIADMM CCOc1cc(C(=O)N[C@@](C)(CC)c2ccccc2)cc(Cl)c1[O-] ZINC001146926545 1049072749 /nfs/dbraw/zinc/07/27/49/1049072749.db2.gz NCBRREPXYATTAZ-IBGZPJMESA-N -1 1 347.842 4.500 20 0 EIADMM O=C(c1ccc2ccc(O)cc2c1[O-])N1CCCC2(CCCC2)CC1 ZINC001147111888 1049092584 /nfs/dbraw/zinc/09/25/84/1049092584.db2.gz SERVHBYBMDPMDM-UHFFFAOYSA-N -1 1 339.435 4.438 20 0 EIADMM CC[C@H](NC(=O)c1ccc(Cl)cc1[O-])c1ccc(F)cc1F ZINC001147228036 1049117759 /nfs/dbraw/zinc/11/77/59/1049117759.db2.gz YFERCFNVJRUWSD-AWEZNQCLSA-N -1 1 325.742 4.205 20 0 EIADMM O=C(N[C@@H]1CCC[C@H]1Cc1ccccc1)c1cc(Cl)ccc1[O-] ZINC001147496503 1049167624 /nfs/dbraw/zinc/16/76/24/1049167624.db2.gz ZFXONCNBJULPNB-WMLDXEAASA-N -1 1 329.827 4.187 20 0 EIADMM Cc1cccc(-c2ccc(CNC(=O)c3ccc([O-])cc3F)cc2)c1 ZINC001147593916 1049189558 /nfs/dbraw/zinc/18/95/58/1049189558.db2.gz ORVCCYUNRJYWTI-UHFFFAOYSA-N -1 1 335.378 4.437 20 0 EIADMM O=C(N[C@H]1CCSc2c(F)cccc21)c1cc(Cl)ccc1[O-] ZINC001136193466 1049265414 /nfs/dbraw/zinc/26/54/14/1049265414.db2.gz VMQHWIVCVJPUFP-ZDUSSCGKSA-N -1 1 337.803 4.152 20 0 EIADMM COc1c(C)ccc(NC(=O)c2ccc(C(F)(F)F)cc2[O-])c1C ZINC001136203699 1049281431 /nfs/dbraw/zinc/28/14/31/1049281431.db2.gz NIJBJTAUWJNYSQ-UHFFFAOYSA-N -1 1 339.313 4.289 20 0 EIADMM CC[C@H](C)c1ccc(S(=O)(=O)[N-]c2ccnc(Cl)c2C)cc1 ZINC000811836127 1049285142 /nfs/dbraw/zinc/28/51/42/1049285142.db2.gz DZACKFKZHOSZKF-NSHDSACASA-N -1 1 338.860 4.358 20 0 EIADMM CSc1cc(C)nc(SC)c1[N-]C(=O)c1ccc(C(C)=O)cc1 ZINC001148296308 1049290907 /nfs/dbraw/zinc/29/09/07/1049290907.db2.gz NJQVMKIZBYDAMA-UHFFFAOYSA-N -1 1 346.477 4.289 20 0 EIADMM O=C(Nc1cccc(C(F)(F)F)c1[O-])c1ccc(-c2ncc[nH]2)cc1 ZINC001148717985 1049358579 /nfs/dbraw/zinc/35/85/79/1049358579.db2.gz DQDGLKUETBSGAO-UHFFFAOYSA-N -1 1 347.296 4.053 20 0 EIADMM CSc1ccc([O-])c(C(=O)Nc2cc(F)ccc2NC(C)C)c1 ZINC001148832437 1049379558 /nfs/dbraw/zinc/37/95/58/1049379558.db2.gz LLWVHWBPMAOVMR-UHFFFAOYSA-N -1 1 334.416 4.326 20 0 EIADMM Cc1nc2c(cccc2NC(=O)c2ccc(C(F)(F)F)cc2[O-])o1 ZINC001148800534 1049382174 /nfs/dbraw/zinc/38/21/74/1049382174.db2.gz FWAZAMRLBXPZSR-UHFFFAOYSA-N -1 1 336.269 4.113 20 0 EIADMM O=C(Nc1ccccc1-c1ncc[nH]1)c1ccc(C(F)(F)F)cc1[O-] ZINC001148800503 1049382769 /nfs/dbraw/zinc/38/27/69/1049382769.db2.gz FACKKGYECVRUNA-UHFFFAOYSA-N -1 1 347.296 4.053 20 0 EIADMM Cn1cnc2ccc(NC(=O)c3cccc(-c4ccccc4)c3[O-])cc21 ZINC001148870029 1049392279 /nfs/dbraw/zinc/39/22/79/1049392279.db2.gz OTKXOGCSGUZSHG-UHFFFAOYSA-N -1 1 343.386 4.198 20 0 EIADMM Cc1sc(NC(=O)c2cccc([O-])c2F)nc1-c1ccc(F)cc1 ZINC001136351440 1049526108 /nfs/dbraw/zinc/52/61/08/1049526108.db2.gz OSKXJUHVOAHCQP-UHFFFAOYSA-N -1 1 346.358 4.355 20 0 EIADMM O=C(NCC1(c2ccccc2Cl)CC1)c1c([O-])cccc1Cl ZINC001138043886 1049555443 /nfs/dbraw/zinc/55/54/43/1049555443.db2.gz CTJDBBZIQRJSLI-UHFFFAOYSA-N -1 1 336.218 4.161 20 0 EIADMM O=S(=O)([N-]c1ccc2nc(C3CC3)oc2c1)c1ccc(Cl)cc1 ZINC000080311374 1049577119 /nfs/dbraw/zinc/57/71/19/1049577119.db2.gz YXIFIIPFSHJQFP-UHFFFAOYSA-N -1 1 348.811 4.159 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2csnc2-c2ccccc2)c(F)c1 ZINC000821124376 1049600893 /nfs/dbraw/zinc/60/08/93/1049600893.db2.gz VRNDGIBBWYUVRT-UHFFFAOYSA-N -1 1 348.424 4.058 20 0 EIADMM C[C@H](NC(=O)c1c([O-])cccc1Cl)c1cccc(OC(F)F)c1 ZINC000149279827 1049640229 /nfs/dbraw/zinc/64/02/29/1049640229.db2.gz DQBLFUVPDHPCPO-VIFPVBQESA-N -1 1 341.741 4.138 20 0 EIADMM CC(C)CN(Cc1ccccc1F)C(=O)c1cc(Cl)ccc1[O-] ZINC001136449682 1049644759 /nfs/dbraw/zinc/64/47/59/1049644759.db2.gz QLZWUONZWXCYGD-UHFFFAOYSA-N -1 1 335.806 4.483 20 0 EIADMM CC[C@H](C)N(CCc1ccccc1F)C(=O)c1cccc([O-])c1F ZINC001136451328 1049646445 /nfs/dbraw/zinc/64/64/45/1049646445.db2.gz UEGZNZYMVMFCBG-ZDUSSCGKSA-N -1 1 333.378 4.154 20 0 EIADMM O=C([O-])c1cc(NCc2cc(Cl)cc(Cl)c2O)ccc1F ZINC000037088631 1049658734 /nfs/dbraw/zinc/65/87/34/1049658734.db2.gz XCEOSOUTXGLDFZ-UHFFFAOYSA-N -1 1 330.142 4.148 20 0 EIADMM CCOc1ccc(CN(C(=O)c2ccc(Cl)cc2[O-])C(C)C)cc1 ZINC001136468392 1049659201 /nfs/dbraw/zinc/65/92/01/1049659201.db2.gz MZEJVKKFHSHOQE-UHFFFAOYSA-N -1 1 347.842 4.495 20 0 EIADMM O=C(Nc1cccc(F)c1[O-])c1cc(Cl)ccc1OC(F)F ZINC001171632864 1049763702 /nfs/dbraw/zinc/76/37/02/1049763702.db2.gz UGOQCKVKZPNGET-UHFFFAOYSA-N -1 1 331.677 4.038 20 0 EIADMM O=C([N-]c1c(F)cc(Cl)cc1F)c1cccc(Cl)c1[N+](=O)[O-] ZINC000180334663 1049882466 /nfs/dbraw/zinc/88/24/66/1049882466.db2.gz UEBGZGZNXQPPIF-UHFFFAOYSA-N -1 1 347.104 4.432 20 0 EIADMM CSc1cccc(C)c1[N-]C(=O)c1nc(Br)cs1 ZINC000189012171 1049989501 /nfs/dbraw/zinc/98/95/01/1049989501.db2.gz NMEUJVGUFATIMK-UHFFFAOYSA-N -1 1 343.271 4.188 20 0 EIADMM CC(C)Oc1cccc(Nc2cc3ccc([O-])cc3oc2=O)c1F ZINC001212319617 1050036872 /nfs/dbraw/zinc/03/68/72/1050036872.db2.gz NPYUJLZSLYPMSX-UHFFFAOYSA-N -1 1 329.327 4.169 20 0 EIADMM FC(F)(F)c1cnc(-c2nc(-c3cccc(Cl)c3Cl)no2)[n-]1 ZINC001212689680 1050230127 /nfs/dbraw/zinc/23/01/27/1050230127.db2.gz LYEFANWYTFBZOD-UHFFFAOYSA-N -1 1 349.099 4.452 20 0 EIADMM FC(F)(F)c1c[n-]c(-c2nc(-c3cccc(Cl)c3Cl)no2)n1 ZINC001212689680 1050230145 /nfs/dbraw/zinc/23/01/45/1050230145.db2.gz LYEFANWYTFBZOD-UHFFFAOYSA-N -1 1 349.099 4.452 20 0 EIADMM Cc1c(NC(=O)c2ccc([O-])cc2F)snc1-c1ccccc1 ZINC001186318296 1050284642 /nfs/dbraw/zinc/28/46/42/1050284642.db2.gz GMLGJMOFQCNAJP-UHFFFAOYSA-N -1 1 328.368 4.216 20 0 EIADMM O=C(NCc1cccc(-c2ccc(F)cc2)c1)c1ccc([O-])cc1F ZINC001186339832 1050302244 /nfs/dbraw/zinc/30/22/44/1050302244.db2.gz QDQBRWPIIMXBAU-UHFFFAOYSA-N -1 1 339.341 4.267 20 0 EIADMM CCN(C)c1ccc([N-]S(=O)(=O)c2csc3ccccc32)cc1 ZINC001186509245 1050346946 /nfs/dbraw/zinc/34/69/46/1050346946.db2.gz VXJIAYHFVRWRBZ-UHFFFAOYSA-N -1 1 346.477 4.158 20 0 EIADMM Cc1c2cc(C)ccc2oc1C(=O)Nc1cc(=O)n(-c2ccccc2)[n-]1 ZINC001150771889 1050392405 /nfs/dbraw/zinc/39/24/05/1050392405.db2.gz UMVSUYVJZPYDME-UHFFFAOYSA-N -1 1 347.374 4.193 20 0 EIADMM C[C@@H](NC(=O)c1ccc2ccccc2c1[O-])c1c(F)cccc1F ZINC001178389190 1050451360 /nfs/dbraw/zinc/45/13/60/1050451360.db2.gz WPZXPDWQFLDWOJ-LLVKDONJSA-N -1 1 327.330 4.315 20 0 EIADMM Cc1cccc([N-]S(=O)(=O)c2cc3c(s2)CCCC3)c1Cl ZINC001187214625 1050510295 /nfs/dbraw/zinc/51/02/95/1050510295.db2.gz BOMVBNZXJMBEJN-UHFFFAOYSA-N -1 1 341.885 4.390 20 0 EIADMM CCS(=O)(=O)c1ccc([O-])c(Nc2cccc3ccccc32)c1 ZINC001173796711 1050576982 /nfs/dbraw/zinc/57/69/82/1050576982.db2.gz QXRAGVPZXWIJRZ-UHFFFAOYSA-N -1 1 327.405 4.083 20 0 EIADMM [O-]C(c1ccc(Nc2cccnc2)cc1)(C(F)(F)F)C(F)(F)F ZINC001173856033 1050589234 /nfs/dbraw/zinc/58/92/34/1050589234.db2.gz PMNTWOMRETXIDP-UHFFFAOYSA-N -1 1 336.235 4.137 20 0 EIADMM Cc1cc(CO)cc(Nc2c([O-])c(Br)ccc2Cl)c1 ZINC001212759346 1050609022 /nfs/dbraw/zinc/60/90/22/1050609022.db2.gz KNJNFQUHHGGGKV-UHFFFAOYSA-N -1 1 342.620 4.352 20 0 EIADMM COc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2[O-])c(C)c1C ZINC001188082151 1050694539 /nfs/dbraw/zinc/69/45/39/1050694539.db2.gz ZKUQLFYQXDQSID-UHFFFAOYSA-N -1 1 339.313 4.289 20 0 EIADMM O=S(=O)([N-]c1cc(Cl)ccc1Oc1ccccc1)C1CCC1 ZINC001188097579 1050697965 /nfs/dbraw/zinc/69/79/65/1050697965.db2.gz PFGYEECAQLGLCX-UHFFFAOYSA-N -1 1 337.828 4.427 20 0 EIADMM COCc1cccc(Nc2ccc(F)c(Br)c2[O-])c1 ZINC001174096119 1050725086 /nfs/dbraw/zinc/72/50/86/1050725086.db2.gz WKURLNHIRZGXSR-UHFFFAOYSA-N -1 1 326.165 4.184 20 0 EIADMM O=C(Nc1ccc(-c2cccc(O)c2)cc1)c1ncc(C(F)(F)F)[n-]1 ZINC001188288626 1050732018 /nfs/dbraw/zinc/73/20/18/1050732018.db2.gz GSXZHSUZMYKXTB-UHFFFAOYSA-N -1 1 347.296 4.053 20 0 EIADMM O=C(Nc1ccc(-c2cccc(O)c2)cc1)c1nc(C(F)(F)F)c[n-]1 ZINC001188288626 1050732038 /nfs/dbraw/zinc/73/20/38/1050732038.db2.gz GSXZHSUZMYKXTB-UHFFFAOYSA-N -1 1 347.296 4.053 20 0 EIADMM O=C(NC1CCCCC1)c1ccc(Nc2c([O-])cc(F)cc2F)cc1 ZINC001174083450 1050759304 /nfs/dbraw/zinc/75/93/04/1050759304.db2.gz DDNIQQMRCSRWMS-UHFFFAOYSA-N -1 1 346.377 4.477 20 0 EIADMM CCCCNC(=O)c1cccc(Nc2cc([O-])c(Cl)cc2F)c1 ZINC001174189327 1050826174 /nfs/dbraw/zinc/82/61/74/1050826174.db2.gz AJLUYOBZCNWUSE-UHFFFAOYSA-N -1 1 336.794 4.458 20 0 EIADMM Cc1nc(SC[C@H]2CCC[C@H](c3ccccc3)O2)[n-]c(=O)c1C ZINC001189061717 1050897388 /nfs/dbraw/zinc/89/73/88/1050897388.db2.gz RZBUAAYSLCWJGH-HZPDHXFCSA-N -1 1 330.453 4.202 20 0 EIADMM CC(=O)c1cccc(S(=O)(=O)[N-]c2cccc3ccc(C)cc32)c1 ZINC001189235742 1050933922 /nfs/dbraw/zinc/93/39/22/1050933922.db2.gz RXGMJUVXKJDFGD-UHFFFAOYSA-N -1 1 339.416 4.152 20 0 EIADMM COC(=O)c1ccc(Nc2ccc(Cl)c(Cl)c2[O-])cc1OC ZINC001174431019 1050965211 /nfs/dbraw/zinc/96/52/11/1050965211.db2.gz OLKNDYSMOWVJLA-UHFFFAOYSA-N -1 1 342.178 4.238 20 0 EIADMM [O-]c1c(Br)c(F)ccc1Nc1cccc(-c2cc[nH]n2)c1 ZINC001174509240 1051041089 /nfs/dbraw/zinc/04/10/89/1051041089.db2.gz KCHTZPNMCJCDMC-UHFFFAOYSA-N -1 1 348.175 4.428 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2cc(F)cc(C(F)(F)F)c2)c(C)c1 ZINC001189948810 1051088621 /nfs/dbraw/zinc/08/86/21/1051088621.db2.gz NHEYDKYRJXVVLY-UHFFFAOYSA-N -1 1 347.333 4.262 20 0 EIADMM [O-]c1c(Cl)cc(Br)cc1Nc1cc(F)ccc1O ZINC001174632105 1051094159 /nfs/dbraw/zinc/09/41/59/1051094159.db2.gz SEASYIPOCFFHHF-UHFFFAOYSA-N -1 1 332.556 4.396 20 0 EIADMM Cc1noc(-c2ccccc2)c1NC(=O)Nc1c([O-])cccc1F ZINC001190364214 1051152746 /nfs/dbraw/zinc/15/27/46/1051152746.db2.gz IQEOVJCWUZHLMH-UHFFFAOYSA-N -1 1 327.315 4.139 20 0 EIADMM Cc1ccc(NC(=O)c2cccc([O-])c2F)cc1C(=O)c1ccccc1 ZINC001174780616 1051173096 /nfs/dbraw/zinc/17/30/96/1051173096.db2.gz JLGKGSLRKBVDGZ-UHFFFAOYSA-N -1 1 349.361 4.323 20 0 EIADMM COc1cc(C(=O)Nc2cccc([C@@H](C)OC)c2)cc(Cl)c1[O-] ZINC000153733245 1051218649 /nfs/dbraw/zinc/21/86/49/1051218649.db2.gz OAAQYYLPZFSTCG-SNVBAGLBSA-N -1 1 335.787 4.014 20 0 EIADMM CCCCc1ccc(Nc2cc(S(=O)(=O)CC)ccc2[O-])cc1 ZINC001175030796 1051322831 /nfs/dbraw/zinc/32/28/31/1051322831.db2.gz IPXZGNHJWFSHHP-UHFFFAOYSA-N -1 1 333.453 4.272 20 0 EIADMM COc1cc(C(=O)Nc2cccc3c(C)c(C)[nH]c32)cc(Cl)c1[O-] ZINC001191147948 1051364832 /nfs/dbraw/zinc/36/48/32/1051364832.db2.gz CLMALQAGSRYZFA-UHFFFAOYSA-N -1 1 344.798 4.405 20 0 EIADMM CCCCc1ccc(S(=O)(=O)[N-]c2ccc3oc(C)nc3c2)cc1 ZINC001191248480 1051410988 /nfs/dbraw/zinc/41/09/88/1051410988.db2.gz CWRMWSGCTPDPPS-UHFFFAOYSA-N -1 1 344.436 4.280 20 0 EIADMM Cc1noc(-c2ccccc2)c1[N-]C(=O)c1ccnc(Cl)c1F ZINC000773986523 1051417058 /nfs/dbraw/zinc/41/70/58/1051417058.db2.gz BFBLMDXMYPWNGI-UHFFFAOYSA-N -1 1 331.734 4.090 20 0 EIADMM CC(=O)c1ccc(Nc2ccc(F)c(Br)c2[O-])cc1F ZINC001175235381 1051463622 /nfs/dbraw/zinc/46/36/22/1051463622.db2.gz KCSKFXKWEQIYPV-UHFFFAOYSA-N -1 1 342.139 4.379 20 0 EIADMM O=C(Nc1cccc(C(F)(F)F)c1[O-])[C@@H]1C[C@H]1c1ccccc1F ZINC001182284755 1051467365 /nfs/dbraw/zinc/46/73/65/1051467365.db2.gz FPGZJVHVBQBMMO-WDEREUQCSA-N -1 1 339.288 4.292 20 0 EIADMM C[C@@H]1CCC[C@H](C)N1C(=O)c1ccccc1C(=O)c1ccc([O-])cc1 ZINC001191487707 1051467528 /nfs/dbraw/zinc/46/75/28/1051467528.db2.gz JNBBGKWNJJYTJW-GASCZTMLSA-N -1 1 337.419 4.026 20 0 EIADMM O=C(Nc1cc(F)cc(C(F)(F)F)c1)Nc1cccc(F)c1[O-] ZINC001191585359 1051481497 /nfs/dbraw/zinc/48/14/97/1051481497.db2.gz BJDZZEAZYZQUDK-UHFFFAOYSA-N -1 1 332.228 4.333 20 0 EIADMM COc1cccc(C(=O)C(F)(F)F)c1Nc1c(F)ccc([O-])c1F ZINC001175271070 1051509176 /nfs/dbraw/zinc/50/91/76/1051509176.db2.gz QNABABCUGZBYFW-UHFFFAOYSA-N -1 1 347.239 4.168 20 0 EIADMM C[C@H](NC(=O)c1cc2ccccc2cc1[O-])c1cc2cnccc2o1 ZINC001175437550 1051592198 /nfs/dbraw/zinc/59/21/98/1051592198.db2.gz LLRUUAYKNPCLTF-LBPRGKRZSA-N -1 1 332.359 4.178 20 0 EIADMM Cc1ccc2[nH]ncc2c1Nc1c(Cl)c(F)[n-]c(=O)c1Cl ZINC001175523802 1051650270 /nfs/dbraw/zinc/65/02/70/1051650270.db2.gz NDPAZXLWJNHRCE-UHFFFAOYSA-N -1 1 327.146 4.161 20 0 EIADMM CC(C)(C)c1ccc(C(=O)Nc2cnc(Cl)nc2Cl)c([O-])c1 ZINC001192314981 1051689319 /nfs/dbraw/zinc/68/93/19/1051689319.db2.gz WILWUTMBFKCNBZ-UHFFFAOYSA-N -1 1 340.210 4.039 20 0 EIADMM O=C(c1c(F)ccc([O-])c1F)N(Cc1ccccn1)C1CCCCC1 ZINC001192535826 1051763004 /nfs/dbraw/zinc/76/30/04/1051763004.db2.gz LBSXDUSMJGXIIF-UHFFFAOYSA-N -1 1 346.377 4.041 20 0 EIADMM C[C@]12CC3CC(NC(=O)c4c(F)ccc([O-])c4F)(C1)C[C@@](C)(C3)C2 ZINC001192540673 1051764979 /nfs/dbraw/zinc/76/49/79/1051764979.db2.gz ZYPDKDVWXVFBHE-PDPGNDQDSA-N -1 1 335.394 4.149 20 0 EIADMM CCCO[C@H](C(=O)Nc1ccc(F)cc1[O-])c1ccc(F)cc1C ZINC001183054419 1051777894 /nfs/dbraw/zinc/77/78/94/1051777894.db2.gz LNLDNCDBOMQSDU-KRWDZBQOSA-N -1 1 335.350 4.085 20 0 EIADMM O=C([N-]c1nnco1)c1cc(-c2ccccc2)c(C(F)(F)F)s1 ZINC001192735871 1051800872 /nfs/dbraw/zinc/80/08/72/1051800872.db2.gz RQJYWRHQGMBYGH-UHFFFAOYSA-N -1 1 339.298 4.069 20 0 EIADMM Cc1cccc2c(=O)[nH]c(C(Cl)=Cc3ccc([O-])c(Cl)c3)nc12 ZINC000072042093 1051914220 /nfs/dbraw/zinc/91/42/20/1051914220.db2.gz ZYOYXFYERXKNQY-JYRVWZFOSA-N -1 1 347.201 4.327 20 0 EIADMM COc1ccc(-c2nc(C3(c4ccc(F)cc4)CCC3)no2)c([O-])c1 ZINC000621809707 1051963979 /nfs/dbraw/zinc/96/39/79/1051963979.db2.gz IVMMMCCFKSEWKS-UHFFFAOYSA-N -1 1 340.354 4.060 20 0 EIADMM [O-]c1c(Cl)nccc1Nc1ccc(OCc2ccccc2)nc1 ZINC001176305452 1052010492 /nfs/dbraw/zinc/01/04/92/1052010492.db2.gz DRDJKWMAEVBCKU-UHFFFAOYSA-N -1 1 327.771 4.158 20 0 EIADMM Cc1c(=O)[n-]c(SCc2cc(F)ccc2F)nc1-c1ccccc1 ZINC000163939163 1052012020 /nfs/dbraw/zinc/01/20/20/1052012020.db2.gz AWTMQWXMFOZFQA-UHFFFAOYSA-N -1 1 344.386 4.316 20 0 EIADMM [O-]c1c(F)c(F)ccc1Nc1ccc(OCc2ccccc2)nc1 ZINC001176306503 1052012650 /nfs/dbraw/zinc/01/26/50/1052012650.db2.gz UYTMJGMVTZMBTH-UHFFFAOYSA-N -1 1 328.318 4.388 20 0 EIADMM COc1cc(C)cc([N-]S(=O)(=O)c2ccc(C)c3ccccc32)c1 ZINC001193863842 1052019100 /nfs/dbraw/zinc/01/91/00/1052019100.db2.gz KJJPBSQGJCUAFN-UHFFFAOYSA-N -1 1 341.432 4.266 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2ccccc2N)c(-c2ccccc2)c1 ZINC001193935317 1052023119 /nfs/dbraw/zinc/02/31/19/1052023119.db2.gz YQVIWOQHHSFLGX-UHFFFAOYSA-N -1 1 338.432 4.045 20 0 EIADMM CCCOC(=O)Nc1cc(Br)c(C(F)(F)F)cc1[O-] ZINC001194130186 1052079512 /nfs/dbraw/zinc/07/95/12/1052079512.db2.gz DTANNCFBFRZFFY-UHFFFAOYSA-N -1 1 342.111 4.132 20 0 EIADMM O=c1ccn(-c2ccc(Nc3cccc(OC(F)(F)F)c3)cc2)[n-]1 ZINC001176539966 1052117258 /nfs/dbraw/zinc/11/72/58/1052117258.db2.gz MMGJEFHZTPTEFU-UHFFFAOYSA-N -1 1 335.285 4.220 20 0 EIADMM O=C(OCc1csc(Nc2ccccc2)n1)c1ccc([O-])cc1F ZINC000773582202 1052121181 /nfs/dbraw/zinc/12/11/81/1052121181.db2.gz NOSPFIRKRMPDFB-UHFFFAOYSA-N -1 1 344.367 4.088 20 0 EIADMM CCN(CC)C(=O)c1cccc(NCc2cccc([O-])c2Cl)c1 ZINC000336894738 1052139511 /nfs/dbraw/zinc/13/95/11/1052139511.db2.gz MCPIXORNMBZVJG-UHFFFAOYSA-N -1 1 332.831 4.140 20 0 EIADMM COc1ccc(Br)cc1Nc1c(F)cc(F)c([O-])c1F ZINC001176670115 1052157547 /nfs/dbraw/zinc/15/75/47/1052157547.db2.gz RUUDUOGGFJZLKX-UHFFFAOYSA-N -1 1 348.118 4.324 20 0 EIADMM Nc1ccc(OC(F)(F)F)cc1Nc1c(F)cc(F)c([O-])c1F ZINC001176670377 1052157887 /nfs/dbraw/zinc/15/78/87/1052157887.db2.gz FWNVPYNCVNBZIQ-UHFFFAOYSA-N -1 1 338.207 4.034 20 0 EIADMM Cc1cc(Br)nc(Nc2c(F)cc(F)c([O-])c2F)c1 ZINC001176663718 1052158020 /nfs/dbraw/zinc/15/80/20/1052158020.db2.gz HERXASHOBPEYOZ-UHFFFAOYSA-N -1 1 333.107 4.019 20 0 EIADMM CCOc1ccc(OCC)c(Nc2c(F)cc(F)c([O-])c2F)c1 ZINC001176669354 1052158214 /nfs/dbraw/zinc/15/82/14/1052158214.db2.gz HQJRWJUGTUPUIQ-UHFFFAOYSA-N -1 1 327.302 4.351 20 0 EIADMM [O-]c1c(F)cc(F)c(Nc2cnc3c(ccc(F)c3F)c2)c1F ZINC001176663653 1052158322 /nfs/dbraw/zinc/15/83/22/1052158322.db2.gz KVAJRPKWUJONGA-UHFFFAOYSA-N -1 1 326.224 4.380 20 0 EIADMM CC(C)(C)NC(=O)c1ccccc1Nc1c(F)cc(F)c([O-])c1F ZINC001176672113 1052159564 /nfs/dbraw/zinc/15/95/64/1052159564.db2.gz UBTNJVDYKUGOLN-UHFFFAOYSA-N -1 1 338.329 4.081 20 0 EIADMM Cc1cccc(C)c1S(=O)(=O)[N-]c1cc(Cl)nc2ccccc12 ZINC001194609959 1052169191 /nfs/dbraw/zinc/16/91/91/1052169191.db2.gz RVZHTHDOJMASIT-UHFFFAOYSA-N -1 1 346.839 4.306 20 0 EIADMM CCS(=O)(=O)c1ccc([O-])c(Nc2ccc(Cl)cc2Cl)c1 ZINC001176653054 1052169609 /nfs/dbraw/zinc/16/96/09/1052169609.db2.gz MGXQIRSNCVLEIX-UHFFFAOYSA-N -1 1 346.235 4.236 20 0 EIADMM Cc1cccc(C)c1S(=O)(=O)[N-]c1ccccc1N1CCCCC1 ZINC001194633607 1052181398 /nfs/dbraw/zinc/18/13/98/1052181398.db2.gz BAMSTVHJOAUELF-UHFFFAOYSA-N -1 1 344.480 4.095 20 0 EIADMM Cc1cccc(C)c1S(=O)(=O)[N-]c1cccc2ncc(Cl)cc12 ZINC001194645220 1052185855 /nfs/dbraw/zinc/18/58/55/1052185855.db2.gz ZYIDBKPLJDLTQX-UHFFFAOYSA-N -1 1 346.839 4.306 20 0 EIADMM COc1ccc([N-]S(=O)(=O)c2ccsc2)cc1-c1ccccc1 ZINC001185383657 1052226794 /nfs/dbraw/zinc/22/67/94/1052226794.db2.gz DQJMYJLZNKKNDZ-UHFFFAOYSA-N -1 1 345.445 4.225 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2ccc(C)c3ncccc23)ccc1Cl ZINC001185524854 1052256419 /nfs/dbraw/zinc/25/64/19/1052256419.db2.gz NXEXIARDMBEJOY-UHFFFAOYSA-N -1 1 346.839 4.306 20 0 EIADMM CC(C)[C@H](CC(F)(F)F)NC(=O)c1cc2ccccc2cc1[O-] ZINC000622543224 1052321056 /nfs/dbraw/zinc/32/10/56/1052321056.db2.gz DJHYEVBDXGLAOF-AWEZNQCLSA-N -1 1 325.330 4.252 20 0 EIADMM CC(C)(C)C[C@@H]1CCN(C(=O)c2ccc(C(F)(F)F)cc2[O-])C1 ZINC000622673482 1052383782 /nfs/dbraw/zinc/38/37/82/1052383782.db2.gz OVFPIOPKDVBBGA-NSHDSACASA-N -1 1 329.362 4.309 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1ccc(Br)c(F)c1 ZINC000082193116 1052544886 /nfs/dbraw/zinc/54/48/86/1052544886.db2.gz LNJKVRXUSBXCDM-UHFFFAOYSA-N -1 1 344.567 4.200 20 0 EIADMM CC(C)c1cccc(S(=O)(=O)[N-]c2nn(C(C)C)cc2Cl)c1 ZINC000901712117 1052677284 /nfs/dbraw/zinc/67/72/84/1052677284.db2.gz BYSPKRAVMZHQMH-UHFFFAOYSA-N -1 1 341.864 4.042 20 0 EIADMM COc1cc(/C=C/c2ncc(Br)s2)cc(Cl)c1[O-] ZINC000193050393 1053023064 /nfs/dbraw/zinc/02/30/64/1053023064.db2.gz LDTBZJNNZCTUCK-NSCUHMNNSA-N -1 1 346.633 4.444 20 0 EIADMM O=C(Nc1ccccc1Cc1ccccc1)c1c[n-]c(C(F)(F)F)n1 ZINC001194781709 1053091161 /nfs/dbraw/zinc/09/11/61/1053091161.db2.gz FFBGSZGTYWBXRL-UHFFFAOYSA-N -1 1 345.324 4.272 20 0 EIADMM Cc1ccc(Cl)c(S(=O)(=O)[N-]C(C)(C)/C=C/Cl)c1Cl ZINC001195042854 1053241801 /nfs/dbraw/zinc/24/18/01/1053241801.db2.gz OTIMCUDQKFKEGF-VOTSOKGWSA-N -1 1 342.675 4.111 20 0 EIADMM CCC[C@@H](Cc1ccccc1)N(CCC)C(=O)c1nc(C)ccc1[O-] ZINC001195325417 1053361556 /nfs/dbraw/zinc/36/15/56/1053361556.db2.gz CJLATRUOVLWVSK-SFHVURJKSA-N -1 1 340.467 4.359 20 0 EIADMM O=C(Nc1ccccc1Cc1ccccc1)c1cc([O-])cnc1Cl ZINC001195308269 1053372630 /nfs/dbraw/zinc/37/26/30/1053372630.db2.gz ARFOZAQGGATZKN-UHFFFAOYSA-N -1 1 338.794 4.284 20 0 EIADMM CCOC(=O)NC(=S)[N-]c1ccccc1Sc1ccccc1 ZINC001195487323 1053422498 /nfs/dbraw/zinc/42/24/98/1053422498.db2.gz RUVARRDQYMHEMM-UHFFFAOYSA-N -1 1 332.450 4.281 20 0 EIADMM Cc1cc(O)cc([N-]S(=O)(=O)c2ccc3cc(Cl)ccc3c2)c1 ZINC001196436023 1053659511 /nfs/dbraw/zinc/65/95/11/1053659511.db2.gz UYBJQEUWGKJWML-UHFFFAOYSA-N -1 1 347.823 4.308 20 0 EIADMM C[C@@H]([N-]C(=O)C(F)(F)c1ccccc1F)c1ccc(F)cc1F ZINC000765546165 1053664704 /nfs/dbraw/zinc/66/47/04/1053664704.db2.gz WHBGQWVYZLZGEA-SECBINFHSA-N -1 1 329.268 4.073 20 0 EIADMM Cc1cccc(OCCN(C)C(=O)c2cc3ccccc3cc2[O-])c1 ZINC000024215502 1053799923 /nfs/dbraw/zinc/79/99/23/1053799923.db2.gz ZFXQRNJKQYSAAN-UHFFFAOYSA-N -1 1 335.403 4.005 20 0 EIADMM Cc1sc(CC(=O)Nc2cc(F)c([O-])cc2Cl)nc1C(C)C ZINC000885678700 1053808867 /nfs/dbraw/zinc/80/88/67/1053808867.db2.gz USKYBEBRFQCPGP-UHFFFAOYSA-N -1 1 342.823 4.254 20 0 EIADMM [O-]c1c(F)ccc(-c2nc3cc(C(F)(F)F)c(F)cc3[nH]2)c1F ZINC001251234434 1053887635 /nfs/dbraw/zinc/88/76/35/1053887635.db2.gz BPUJQQHGICZLIN-UHFFFAOYSA-N -1 1 332.203 4.372 20 0 EIADMM [O-]c1cccc(NC(=S)Nc2cccc(F)c2)c1Br ZINC001197650046 1053959170 /nfs/dbraw/zinc/95/91/70/1053959170.db2.gz OVUQYKZHRUIELQ-UHFFFAOYSA-N -1 1 341.205 4.103 20 0 EIADMM CSc1cc(C)nc(SC)c1[N-]C(=O)c1cnccc1C1CC1 ZINC001197841746 1054002344 /nfs/dbraw/zinc/00/23/44/1054002344.db2.gz APSZOMQVKAUYMX-UHFFFAOYSA-N -1 1 345.493 4.359 20 0 EIADMM C[C@H](OC(=O)Cc1ccc([O-])c(Cl)c1)c1ncc(C(C)(C)C)o1 ZINC000869736981 1054028236 /nfs/dbraw/zinc/02/82/36/1054028236.db2.gz XQGGJIVWZSICTB-JTQLQIEISA-N -1 1 337.803 4.178 20 0 EIADMM Cc1cc2cc([N-]S(=O)(=O)c3ccc(C(C)C)cc3)ccc2[nH]1 ZINC000031721933 1054077466 /nfs/dbraw/zinc/07/74/66/1054077466.db2.gz LHCYRLUKRXNRPA-UHFFFAOYSA-N -1 1 328.437 4.401 20 0 EIADMM CCc1ccc(S(=O)(=O)[N-]c2ccc3oc(C4CC4)nc3c2)cc1 ZINC000032097357 1054091959 /nfs/dbraw/zinc/09/19/59/1054091959.db2.gz IHKBFWKKNDWQGU-UHFFFAOYSA-N -1 1 342.420 4.068 20 0 EIADMM CCO[C@@H](C)c1ncc(C(=O)[N-]c2cc(F)c(F)c(F)c2F)s1 ZINC000871269388 1054179547 /nfs/dbraw/zinc/17/95/47/1054179547.db2.gz SCFYWRAYFNRRDH-LURJTMIESA-N -1 1 348.321 4.049 20 0 EIADMM CC(C)(C)OC(=O)Nc1ccc(C(=O)N[C@H]2CCC(C)(C)C2)c([O-])c1 ZINC000857478521 1054269201 /nfs/dbraw/zinc/26/92/01/1054269201.db2.gz KUCNATKTDKBTCQ-ZDUSSCGKSA-N -1 1 348.443 4.048 20 0 EIADMM Cc1ccc2c([N-]S(=O)(=O)c3ccc4occc4c3)cccc2n1 ZINC001198858532 1054284381 /nfs/dbraw/zinc/28/43/81/1054284381.db2.gz CCENPOGRXNOXMX-UHFFFAOYSA-N -1 1 338.388 4.090 20 0 EIADMM O=S(=O)([N-]c1ccccc1-n1cccc1)c1ccc2occc2c1 ZINC001198861219 1054285424 /nfs/dbraw/zinc/28/54/24/1054285424.db2.gz IAWGFBYMOQFEDT-UHFFFAOYSA-N -1 1 338.388 4.024 20 0 EIADMM O=S(=O)([N-]c1ccc(OCC2CC2)cc1)c1ccc2occc2c1 ZINC001198859154 1054287639 /nfs/dbraw/zinc/28/76/39/1054287639.db2.gz QPPKDPBIAUERCM-UHFFFAOYSA-N -1 1 343.404 4.022 20 0 EIADMM CON(Cc1ccc(Cl)cc1)C(=O)c1cc2ccccc2cc1[O-] ZINC000857510273 1054289659 /nfs/dbraw/zinc/28/96/59/1054289659.db2.gz HWJCNTDCOCNGHP-UHFFFAOYSA-N -1 1 341.794 4.403 20 0 EIADMM O=S(=O)([N-]c1cccc2cc(O)ccc21)c1ccc2occc2c1 ZINC001198869550 1054296356 /nfs/dbraw/zinc/29/63/56/1054296356.db2.gz WSNWNQXHDMITQG-UHFFFAOYSA-N -1 1 339.372 4.092 20 0 EIADMM O=S(=O)([N-]c1ccc(F)c(C2CC2)c1)c1ccc2occc2c1 ZINC001198870263 1054297437 /nfs/dbraw/zinc/29/74/37/1054297437.db2.gz LGKAPJVHXPQQNU-UHFFFAOYSA-N -1 1 331.368 4.250 20 0 EIADMM CSc1ccc(CN[C@@H](CC(=O)[O-])c2ccccc2Cl)s1 ZINC000871883195 1054319596 /nfs/dbraw/zinc/31/95/96/1054319596.db2.gz FVHVWSJELJTDNS-ZDUSSCGKSA-N -1 1 341.885 4.429 20 0 EIADMM Cc1nc2cc(Cl)c([N-]C(=O)c3cnoc3C(F)(F)F)cc2o1 ZINC001199055047 1054334759 /nfs/dbraw/zinc/33/47/59/1054334759.db2.gz JKOQPIGYFTYMMM-UHFFFAOYSA-N -1 1 345.664 4.049 20 0 EIADMM [O-]c1c(NC(=S)NCC2CCCCC2)cccc1C(F)(F)F ZINC001199927693 1054498971 /nfs/dbraw/zinc/49/89/71/1054498971.db2.gz CPGXZJCGPRDDJB-UHFFFAOYSA-N -1 1 332.391 4.278 20 0 EIADMM C[C@@H]1C[C@H](c2ccccc2F)N(C(=O)Cc2ccc([O-])c(Cl)c2)C1 ZINC001137070306 1054523444 /nfs/dbraw/zinc/52/34/44/1054523444.db2.gz AKFIDWNELDKMGG-SJKOYZFVSA-N -1 1 347.817 4.337 20 0 EIADMM CSc1ccc(NC(=S)Nc2c(F)cc([O-])cc2F)cc1 ZINC001201186376 1054709617 /nfs/dbraw/zinc/70/96/17/1054709617.db2.gz LEALBQTXTXFSKU-UHFFFAOYSA-N -1 1 326.393 4.201 20 0 EIADMM Cc1onc(-c2ccccc2C)c1C(=O)[N-]c1nc(C(C)C)ns1 ZINC000874694284 1054718307 /nfs/dbraw/zinc/71/83/07/1054718307.db2.gz LOTDFJCRYPYORQ-UHFFFAOYSA-N -1 1 342.424 4.186 20 0 EIADMM O=C(Nc1ccc(N2CCCCCC2)cc1)c1ccc([O-])cc1F ZINC000776140353 1054729366 /nfs/dbraw/zinc/72/93/66/1054729366.db2.gz YBWMXJHKUKRPSF-UHFFFAOYSA-N -1 1 328.387 4.164 20 0 EIADMM CC(C)Cn1ccc2cc([N-]S(=O)(=O)c3ccc(F)cc3)ccc21 ZINC000063476054 1054811876 /nfs/dbraw/zinc/81/18/76/1054811876.db2.gz WCFBAVVVGLXXGG-UHFFFAOYSA-N -1 1 346.427 4.237 20 0 EIADMM CCc1nccc(C)c1[N-]S(=O)(=O)c1c(C)c(C)c(C)c(C)c1C ZINC001201795684 1054906736 /nfs/dbraw/zinc/90/67/36/1054906736.db2.gz VUEFZKNUYDKJLL-UHFFFAOYSA-N -1 1 346.496 4.295 20 0 EIADMM Cc1c(C)c(C)c(S(=O)(=O)[N-]c2ccc3cnoc3c2)c(C)c1C ZINC001201797601 1054909579 /nfs/dbraw/zinc/90/95/79/1054909579.db2.gz FVGAOJYSKMCGMQ-UHFFFAOYSA-N -1 1 344.436 4.171 20 0 EIADMM O=C(Nc1ccccc1Br)Nc1cc([O-])c(F)cc1F ZINC001201978488 1054955211 /nfs/dbraw/zinc/95/52/11/1054955211.db2.gz QIQWVWYBWPBQSM-UHFFFAOYSA-N -1 1 343.127 4.077 20 0 EIADMM CC(C)CN1C(=O)c2ccccc2N[C@H]1c1ccc([O-])c(Cl)c1 ZINC000065887906 1054973976 /nfs/dbraw/zinc/97/39/76/1054973976.db2.gz AWCQBTBZGUQJLX-QGZVFWFLSA-N -1 1 330.815 4.268 20 0 EIADMM O=C(Nc1ccc(C(F)(F)F)cc1)Nc1ccc([O-])c(F)c1F ZINC001202411411 1055160860 /nfs/dbraw/zinc/16/08/60/1055160860.db2.gz JUWZJAXYFLVKGJ-UHFFFAOYSA-N -1 1 332.228 4.333 20 0 EIADMM Cc1ccc(N[C@@H](C)c2cc(Br)cc(F)c2[O-])cn1 ZINC000186346459 1055376623 /nfs/dbraw/zinc/37/66/23/1055376623.db2.gz BXEYCOXDRFZYPK-VIFPVBQESA-N -1 1 325.181 4.170 20 0 EIADMM Cc1cc2cc([N-]S(=O)(=O)c3ccc(CCCl)cc3)ccc2[nH]1 ZINC000055585313 1055500762 /nfs/dbraw/zinc/50/07/62/1055500762.db2.gz NKXQETDRRKKNNV-UHFFFAOYSA-N -1 1 348.855 4.058 20 0 EIADMM Cc1ccc(Nc2c([O-])c(Br)ccc2Cl)c(CO)c1 ZINC001214466627 1055833543 /nfs/dbraw/zinc/83/35/43/1055833543.db2.gz HHQXIJYXWZLBJV-UHFFFAOYSA-N -1 1 342.620 4.352 20 0 EIADMM CCCc1cc(=O)[n-]c(SCc2sc(C)nc2C(F)(F)F)n1 ZINC000542764204 1055932482 /nfs/dbraw/zinc/93/24/82/1055932482.db2.gz PXMJLOUNMNLIFM-UHFFFAOYSA-N -1 1 349.403 4.211 20 0 EIADMM COCc1c2ccccc2oc1C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000542817692 1056096649 /nfs/dbraw/zinc/09/66/49/1056096649.db2.gz MQEONQCPCOVJKG-UHFFFAOYSA-N -1 1 331.755 4.191 20 0 EIADMM O=C(c1ccc([O-])c(F)c1)N1CCC([C@H](F)c2ccccc2F)CC1 ZINC000672083753 1056232931 /nfs/dbraw/zinc/23/29/31/1056232931.db2.gz QLWILISUXRYIRE-SFHVURJKSA-N -1 1 349.352 4.233 20 0 EIADMM C/C=C/C[C@@H]1CCCN(c2ccc(-c3nc(C)c(C)c(=O)[n-]3)cn2)C1 ZINC000624778136 1056507082 /nfs/dbraw/zinc/50/70/82/1056507082.db2.gz KCVXLRZRJJJVFG-DWTRPJMMSA-N -1 1 338.455 4.044 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2ccc(Cl)c(Cl)c2)c(C)c1O ZINC000060831637 1056531408 /nfs/dbraw/zinc/53/14/08/1056531408.db2.gz ZBQMYPHTJNCUCJ-UHFFFAOYSA-N -1 1 346.235 4.117 20 0 EIADMM C[C@H]1CC[C@@](C)(C[N-]S(=O)(=O)c2sccc2Cl)C1(C)C ZINC001212440482 1056690321 /nfs/dbraw/zinc/69/03/21/1056690321.db2.gz VGJPCEVQADBWSP-HZMBPMFUSA-N -1 1 335.922 4.142 20 0 EIADMM Cc1ncc(Nc2cc(F)c([O-])c(Cl)c2)cc1Br ZINC001214479838 1056699588 /nfs/dbraw/zinc/69/95/88/1056699588.db2.gz FPVYMTPGQMOFLQ-UHFFFAOYSA-N -1 1 331.572 4.394 20 0 EIADMM Cc1nc(Br)ccc1Nc1cc(F)c([O-])c(Cl)c1 ZINC001214479685 1056700134 /nfs/dbraw/zinc/70/01/34/1056700134.db2.gz CYXBLSFBXBDPLB-UHFFFAOYSA-N -1 1 331.572 4.394 20 0 EIADMM CCc1ccccc1[N-]S(=O)(=O)c1cc(Cl)cc(Cl)c1 ZINC000007050667 1056762235 /nfs/dbraw/zinc/76/22/35/1056762235.db2.gz QLRHLLNYOKJCBQ-UHFFFAOYSA-N -1 1 330.236 4.357 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2ccc(Cl)c(Cl)c2)cc1F ZINC000007405753 1056792587 /nfs/dbraw/zinc/79/25/87/1056792587.db2.gz HZJARFFQMMTWOL-UHFFFAOYSA-N -1 1 334.199 4.242 20 0 EIADMM CCc1cc2c(CNc3cc(F)c(F)c(F)c3)cc(=O)oc2cc1[O-] ZINC000741258720 1058186536 /nfs/dbraw/zinc/18/65/36/1058186536.db2.gz SZWKZNQXKCPEEK-UHFFFAOYSA-N -1 1 349.308 4.090 20 0 EIADMM O=C(NC1(c2ccc(Cl)c(Cl)c2)CC1)c1c([O-])cccc1F ZINC001155458599 1058921701 /nfs/dbraw/zinc/92/17/01/1058921701.db2.gz QAMXOLMPUAARHS-UHFFFAOYSA-N -1 1 340.181 4.257 20 0 EIADMM CC(=O)c1ccc([O-])c(CCOC(=O)c2cccc3ccccc32)c1 ZINC000744494461 1059555478 /nfs/dbraw/zinc/55/54/78/1059555478.db2.gz WQBJXKTWONLEJL-UHFFFAOYSA-N -1 1 334.371 4.148 20 0 EIADMM CC(=O)c1ccc([O-])c(CCOC(=O)c2cc3ccccc3s2)c1 ZINC000744579865 1059588466 /nfs/dbraw/zinc/58/84/66/1059588466.db2.gz NITUXHQGJBSRMS-UHFFFAOYSA-N -1 1 340.400 4.209 20 0 EIADMM Cc1c(F)cccc1[N-]S(=O)(=O)c1ccc(OC2CCCC2)cc1 ZINC000745979778 1059946847 /nfs/dbraw/zinc/94/68/47/1059946847.db2.gz IIUQFJMOHIJLTH-UHFFFAOYSA-N -1 1 349.427 4.256 20 0 EIADMM Cc1nc(NC(=O)c2ccc([O-])c(F)c2)sc1-c1ccccc1 ZINC000767296539 1061185388 /nfs/dbraw/zinc/18/53/88/1061185388.db2.gz SLOWGYIJLAJOKZ-UHFFFAOYSA-N -1 1 328.368 4.216 20 0 EIADMM CC(C)c1csc(C2CCN(C(=O)c3cc(F)ccc3[O-])CC2)n1 ZINC000363362219 519853093 /nfs/dbraw/zinc/85/30/93/519853093.db2.gz DVJGKALYCXSEBK-UHFFFAOYSA-N -1 1 348.443 4.131 20 0 EIADMM C[C@@H]1[C@H](C(=O)Nc2c([O-])cc(Br)cc2Cl)[C@H]1C1CC1 ZINC000529368737 1032331376 /nfs/dbraw/zinc/33/13/76/1032331376.db2.gz ZZUYLOCPBRPRLV-GHGOGRRBSA-N -1 1 344.636 4.039 20 0 EIADMM C[C@H]1O[C@@H](C)[C@@H](C)[C@@H]1C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000529539118 1032429564 /nfs/dbraw/zinc/42/95/64/1032429564.db2.gz PRIQFSXOOQLXKE-IDYSPNNHSA-N -1 1 333.815 4.197 20 0 EIADMM O=C(Nc1cc(Cl)c([O-])c2ccccc12)[C@@H]1C[C@H]1C(F)(F)F ZINC000529538566 1032443562 /nfs/dbraw/zinc/44/35/62/1032443562.db2.gz FFXKKCQLNVUOTR-NXEZZACHSA-N -1 1 329.705 4.336 20 0 EIADMM CC(=O)CC1(C(=O)Nc2cc(Cl)c([O-])c3ccccc23)CCC1 ZINC000529538526 1032444702 /nfs/dbraw/zinc/44/47/02/1032444702.db2.gz CRHWVGJVVNKETP-UHFFFAOYSA-N -1 1 331.799 4.287 20 0 EIADMM Cc1cc(Br)c([O-])c(NC(=O)C(C)(C)C(C)(F)F)c1 ZINC000450470234 1032517651 /nfs/dbraw/zinc/51/76/51/1032517651.db2.gz UAGDSTBCYFGTCF-UHFFFAOYSA-N -1 1 336.176 4.083 20 0 EIADMM C[C@@H](NCc1cccc([O-])c1Cl)c1nccn1-c1ccccc1 ZINC000339401166 1018841545 /nfs/dbraw/zinc/84/15/45/1018841545.db2.gz UJFBTISPBUXPEM-CYBMUJFWSA-N -1 1 327.815 4.082 20 0 EIADMM CCCc1nc(-c2nc3sc4c(c3c(=O)[n-]2)CC[C@@H](C)C4)co1 ZINC000579759849 1018865174 /nfs/dbraw/zinc/86/51/74/1018865174.db2.gz POBMUHIDZLPCEM-SECBINFHSA-N -1 1 329.425 4.129 20 0 EIADMM CC(=C([O-])Nc1nc(-c2ccccc2)ns1)c1cccc(Cl)c1 ZINC000607797478 1019418407 /nfs/dbraw/zinc/41/84/07/1019418407.db2.gz FAXWVSNYFXXPQS-NSHDSACASA-N -1 1 343.839 4.023 20 0 EIADMM CCCCOc1ccc(NC(=O)c2ccc(C(C)C)cc2[O-])cn1 ZINC001625838791 1020240018 /nfs/dbraw/zinc/24/00/18/1020240018.db2.gz RNVKXWMPLJTFNU-UHFFFAOYSA-N -1 1 328.412 4.342 20 0 EIADMM O=C(c1ccc(C(F)(F)F)c([O-])c1)N1CCC[C@@H]1c1ccsc1 ZINC001625854049 1020300443 /nfs/dbraw/zinc/30/04/43/1020300443.db2.gz REUCZXPXBPAMEZ-CYBMUJFWSA-N -1 1 341.354 4.450 20 0 EIADMM CCOc1ccc(Nc2ccc(-n3ccc(=O)[n-]3)cc2)c(Cl)c1 ZINC001209896684 1020596927 /nfs/dbraw/zinc/59/69/27/1020596927.db2.gz LUXYXSCNDASJQY-UHFFFAOYSA-N -1 1 329.787 4.374 20 0 EIADMM CCOc1cc(C(=O)Nc2cccc3cc[nH]c32)cc(Cl)c1[O-] ZINC000547819944 1020715449 /nfs/dbraw/zinc/71/54/49/1020715449.db2.gz JOWDMFAIMKUCAH-UHFFFAOYSA-N -1 1 330.771 4.178 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cc(-c4ccccc4F)on3)n2)c(F)c1 ZINC000683592147 1020945134 /nfs/dbraw/zinc/94/51/34/1020945134.db2.gz OEGRCBMPWGJMQM-UHFFFAOYSA-N -1 1 341.273 4.042 20 0 EIADMM [O-]c1ccc(-c2noc(C3CC(c4cccc(F)c4)C3)n2)c(F)c1 ZINC000683592206 1020945368 /nfs/dbraw/zinc/94/53/68/1020945368.db2.gz SECHBHDOMPZPOL-UHFFFAOYSA-N -1 1 328.318 4.382 20 0 EIADMM [O-]c1ccc(F)cc1-c1nc(Cc2ccc(Cl)cc2Cl)no1 ZINC000317326695 1021323793 /nfs/dbraw/zinc/32/37/93/1021323793.db2.gz WSFOCDRJGPHJEL-UHFFFAOYSA-N -1 1 339.153 4.479 20 0 EIADMM CCOC(=O)c1ncccc1Nc1cc(Cl)c([O-])c(Cl)c1 ZINC001210926672 1021867302 /nfs/dbraw/zinc/86/73/02/1021867302.db2.gz MIULLZDMKYABAG-UHFFFAOYSA-N -1 1 327.167 4.014 20 0 EIADMM Cc1ccnc(-c2nc(=O)c3c(C4CCCCC4)csc3[n-]2)n1 ZINC000683920849 1021945609 /nfs/dbraw/zinc/94/56/09/1021945609.db2.gz NVYRAGVROMVIIC-UHFFFAOYSA-N -1 1 326.425 4.210 20 0 EIADMM COc1ncc(Nc2ccc(F)c(Br)c2[O-])cc1Cl ZINC001211048873 1021988191 /nfs/dbraw/zinc/98/81/91/1021988191.db2.gz BKDHHSZWMNPSDF-UHFFFAOYSA-N -1 1 347.571 4.094 20 0 EIADMM CC(C)(Oc1ccc(Cl)cc1)C(=O)Nc1cc([O-])c(F)cc1F ZINC001625892927 1022079836 /nfs/dbraw/zinc/07/98/36/1022079836.db2.gz ASVKTHJLTJNPJL-UHFFFAOYSA-N -1 1 341.741 4.120 20 0 EIADMM Cc1c(=O)[n-]c(S[C@@H]2C[C@@H](C)CCC2=O)nc1-c1ccccc1 ZINC000580517261 1022143022 /nfs/dbraw/zinc/14/30/22/1022143022.db2.gz NBKUAEADLMWOCE-XHDPSFHLSA-N -1 1 328.437 4.007 20 0 EIADMM O=C(Cc1coc2cc3c(cc12)CCC3)Nc1cc([O-])c(F)cc1F ZINC001625894299 1022302213 /nfs/dbraw/zinc/30/22/13/1022302213.db2.gz WNJVWOINGFMXIG-UHFFFAOYSA-N -1 1 343.329 4.087 20 0 EIADMM COc1cc(C)cc(Nc2ccc(F)c(Br)c2[O-])c1 ZINC001211731918 1033064348 /nfs/dbraw/zinc/06/43/48/1033064348.db2.gz RHMOWROCQAKQQL-UHFFFAOYSA-N -1 1 326.165 4.354 20 0 EIADMM O=C(NCc1ccc(-c2ccccc2)s1)c1ccc([O-])c(F)c1 ZINC001167735417 1022689208 /nfs/dbraw/zinc/68/92/08/1022689208.db2.gz BLSPLRRBHVGGCK-UHFFFAOYSA-N -1 1 327.380 4.190 20 0 EIADMM CCOc1cc(C(=O)Nc2ccc3scnc3c2)cc(Cl)c1[O-] ZINC000186755614 1022740149 /nfs/dbraw/zinc/74/01/49/1022740149.db2.gz JWYHIAHXABRXDH-UHFFFAOYSA-N -1 1 348.811 4.306 20 0 EIADMM Nc1cc(Cl)c(Br)cc1Nc1cc(F)c([O-])cc1F ZINC001215577223 1022755979 /nfs/dbraw/zinc/75/59/79/1022755979.db2.gz VEOXLWXGPUOZMB-UHFFFAOYSA-N -1 1 349.562 4.412 20 0 EIADMM CN(Cc1ccc(C(F)(F)F)cc1)Cc1ccc([O-])c(F)c1F ZINC001140893594 1023164778 /nfs/dbraw/zinc/16/47/78/1023164778.db2.gz URTINOUTWPTCKV-UHFFFAOYSA-N -1 1 331.284 4.321 20 0 EIADMM CC(C)(C)c1cnc(CN[C@@H](CCC(=O)[O-])c2ccccc2)s1 ZINC000417601410 1023374407 /nfs/dbraw/zinc/37/44/07/1023374407.db2.gz LOTABJRGHFXPPA-AWEZNQCLSA-N -1 1 332.469 4.136 20 0 EIADMM Cc1cc(CNCc2ccccc2OCC(C)C)ccc1C(=O)[O-] ZINC000417667440 1023401901 /nfs/dbraw/zinc/40/19/01/1023401901.db2.gz IAJMLWPJWAJPQA-UHFFFAOYSA-N -1 1 327.424 4.018 20 0 EIADMM CCCCCCC(=O)CSc1nc(-c2ccccc2)c(C)c(=O)[n-]1 ZINC000190246025 1023464978 /nfs/dbraw/zinc/46/49/78/1023464978.db2.gz JVBMDLDKKRACQA-UHFFFAOYSA-N -1 1 344.480 4.377 20 0 EIADMM CC(C)c1ccc(CCC(=O)Nc2ccc(-c3cc(=O)[nH][n-]3)cc2)cc1 ZINC000613668444 1023486523 /nfs/dbraw/zinc/48/65/23/1023486523.db2.gz TXKDCVHSWKELCY-UHFFFAOYSA-N -1 1 349.434 4.477 20 0 EIADMM C[C@@H]1CCN(Cc2csc(-c3cccc(C(=O)[O-])c3)n2)[C@H](C)C1 ZINC000656758437 1023499830 /nfs/dbraw/zinc/49/98/30/1023499830.db2.gz YQMPAZGKPFLJFN-CHWSQXEVSA-N -1 1 330.453 4.129 20 0 EIADMM Cc1c(=O)[n-]c(SCc2ccncc2Cl)nc1-c1ccccc1 ZINC000189481149 1023575716 /nfs/dbraw/zinc/57/57/16/1023575716.db2.gz GSSGIHCGFUNXBC-UHFFFAOYSA-N -1 1 343.839 4.086 20 0 EIADMM Cc1ccc(C)c([N-]S(=O)(=O)c2ccc(C)c(C(F)(F)F)c2)c1 ZINC000500305552 1023679914 /nfs/dbraw/zinc/67/99/14/1023679914.db2.gz QEJAXYWJJFCYJK-UHFFFAOYSA-N -1 1 343.370 4.431 20 0 EIADMM Cc1cccc([N-]S(=O)(=O)c2ccc(C)c(C(F)(F)F)c2)c1 ZINC000500313371 1023686149 /nfs/dbraw/zinc/68/61/49/1023686149.db2.gz SIQNQYKLOLOWCG-UHFFFAOYSA-N -1 1 329.343 4.123 20 0 EIADMM CC[C@H](C)Oc1cccc([N-]S(=O)(=O)c2cccc(Cl)c2)c1 ZINC000511727650 1023839165 /nfs/dbraw/zinc/83/91/65/1023839165.db2.gz BYGAMZIQMINGLF-LBPRGKRZSA-N -1 1 339.844 4.318 20 0 EIADMM CC(C)(C)c1ncc(/C=C\C(=O)Nc2ccc([O-])c(Cl)c2)s1 ZINC000299736484 1023878625 /nfs/dbraw/zinc/87/86/25/1023878625.db2.gz QTKTURXDCDMNKP-ALCCZGGFSA-N -1 1 336.844 4.452 20 0 EIADMM CCCc1nnc([N-]C(=O)c2cc(-c3ccccc3Cl)on2)s1 ZINC000047442325 1023895517 /nfs/dbraw/zinc/89/55/17/1023895517.db2.gz SNHBSDZZTUIVSZ-UHFFFAOYSA-N -1 1 348.815 4.051 20 0 EIADMM Cc1cc(C(=O)Nc2ccc([O-])c(Cl)c2)c(C)n1[C@@H]1CCCOC1 ZINC000626228151 1023899847 /nfs/dbraw/zinc/89/98/47/1023899847.db2.gz ZVMIMTNEZDWNGA-CQSZACIVSA-N -1 1 348.830 4.068 20 0 EIADMM COc1cc(C(=O)Nc2ccc3nc(C)sc3c2)cc(Cl)c1[O-] ZINC000341614848 1023944984 /nfs/dbraw/zinc/94/49/84/1023944984.db2.gz JGOBWNNSYJQZQS-UHFFFAOYSA-N -1 1 348.811 4.225 20 0 EIADMM CCN(C(=O)c1cncc([O-])c1)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000111585243 1024718676 /nfs/dbraw/zinc/71/86/76/1024718676.db2.gz OBKZYRVWDLSEQA-NSHDSACASA-N -1 1 338.329 4.029 20 0 EIADMM Cc1c(Cl)cccc1[N-]S(=O)(=O)c1cccc(C(F)F)c1 ZINC000780365682 1024897832 /nfs/dbraw/zinc/89/78/32/1024897832.db2.gz OECJJXXVNPZRSN-UHFFFAOYSA-N -1 1 331.771 4.387 20 0 EIADMM CC(=O)Nc1c(C)ccc(NC(=O)c2cc3ccccc3cc2[O-])c1C ZINC000055889372 1025460717 /nfs/dbraw/zinc/46/07/17/1025460717.db2.gz WDSUWBIRWIRAAL-UHFFFAOYSA-N -1 1 348.402 4.373 20 0 EIADMM Cc1nc(CNCc2ccc(-c3ccccc3)s2)ccc1C(=O)[O-] ZINC000426651575 1025849415 /nfs/dbraw/zinc/84/94/15/1025849415.db2.gz MYSOJVYYKIGUES-UHFFFAOYSA-N -1 1 338.432 4.107 20 0 EIADMM Cc1nc(Cl)ccc1[N-]S(=O)(=O)c1ccc(CC(C)C)cc1 ZINC000318320537 1026060857 /nfs/dbraw/zinc/06/08/57/1026060857.db2.gz VAVDXUMBFVPNOO-UHFFFAOYSA-N -1 1 338.860 4.043 20 0 EIADMM Cc1sc2[n-]c(-c3nccc(C)n3)nc(=O)c2c1-c1ccc(C)cc1 ZINC000432495792 1026180329 /nfs/dbraw/zinc/18/03/29/1026180329.db2.gz SXHCEYPMIJNGKW-UHFFFAOYSA-N -1 1 348.431 4.446 20 0 EIADMM C[C@@H]1c2ccccc2CN1C(=O)c1cc(-c2ccc(C=O)o2)ccc1[O-] ZINC001167855251 1026232232 /nfs/dbraw/zinc/23/22/32/1026232232.db2.gz RVRMEQJQDXDHOW-CYBMUJFWSA-N -1 1 347.370 4.182 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1cnn(-c2ccc(Cl)cc2)c1 ZINC000111667915 1026314881 /nfs/dbraw/zinc/31/48/81/1026314881.db2.gz YWFLULQJJXEOMK-UHFFFAOYSA-N -1 1 348.189 4.137 20 0 EIADMM O=C(Cc1c[nH]c2cc(Cl)ccc12)Nc1ccc([O-])c(Cl)c1 ZINC000111667244 1026314951 /nfs/dbraw/zinc/31/49/51/1026314951.db2.gz IFLLGZSSMWOEGU-UHFFFAOYSA-N -1 1 335.190 4.362 20 0 EIADMM O=C(Nc1cccc(F)c1[O-])c1cc(Cl)cc(Br)c1 ZINC000707972070 1026474779 /nfs/dbraw/zinc/47/47/79/1026474779.db2.gz LOJLWRPUQWTRGJ-UHFFFAOYSA-N -1 1 344.567 4.200 20 0 EIADMM O=C(Nc1cccc(F)c1[O-])c1cccc(Br)c1Cl ZINC000707972912 1026467674 /nfs/dbraw/zinc/46/76/74/1026467674.db2.gz QDZXQCOCEPSAHZ-UHFFFAOYSA-N -1 1 344.567 4.200 20 0 EIADMM CN(C)C(=O)c1cc(Nc2cc(Cl)cc(Cl)c2[O-])ccc1F ZINC001211856046 1026472313 /nfs/dbraw/zinc/47/23/13/1026472313.db2.gz NIUBPGQEDJMISI-UHFFFAOYSA-N -1 1 343.185 4.284 20 0 EIADMM O=C([O-])C[C@@H](NCc1cccc(Cl)c1Cl)c1ccsc1 ZINC000426677013 1026479867 /nfs/dbraw/zinc/47/98/67/1026479867.db2.gz IOZOAYOZWHSDEM-GFCCVEGCSA-N -1 1 330.236 4.361 20 0 EIADMM CCCCc1oc2ccccc2c1CNCc1cc(C(=O)[O-])co1 ZINC000426713267 1026496246 /nfs/dbraw/zinc/49/62/46/1026496246.db2.gz DGJJAZXUUMPGTB-UHFFFAOYSA-N -1 1 327.380 4.356 20 0 EIADMM CCOc1cc(C(=O)NCCCCc2ccccc2)cc(Cl)c1[O-] ZINC000684834462 1026505678 /nfs/dbraw/zinc/50/56/78/1026505678.db2.gz GGBDNYUNWKASAR-UHFFFAOYSA-N -1 1 347.842 4.197 20 0 EIADMM O=C([O-])c1ccc(CNCc2ccc(-c3cccc(F)c3F)o2)cc1 ZINC000426712732 1026508184 /nfs/dbraw/zinc/50/81/84/1026508184.db2.gz YMTSMFRVIZRWSX-UHFFFAOYSA-N -1 1 343.329 4.213 20 0 EIADMM Cc1ccc(CN[C@H](CC(=O)[O-])c2cc(Cl)cc(Cl)c2)o1 ZINC000426745185 1026524193 /nfs/dbraw/zinc/52/41/93/1026524193.db2.gz FXOIXICMCKDIDC-CQSZACIVSA-N -1 1 328.195 4.200 20 0 EIADMM CC(C)(C)CC[C@H](NCc1ccc(-c2ccccc2F)o1)C(=O)[O-] ZINC000426742699 1026524480 /nfs/dbraw/zinc/52/44/80/1026524480.db2.gz QNJYHKKVEUTJOZ-INIZCTEOSA-N -1 1 333.403 4.455 20 0 EIADMM O=S(=O)([N-]c1ccc(Cl)c(F)c1)c1cccc(C(F)F)c1 ZINC000780375779 1026533093 /nfs/dbraw/zinc/53/30/93/1026533093.db2.gz JIFQZYZFAXKEMM-UHFFFAOYSA-N -1 1 335.734 4.218 20 0 EIADMM O=C([O-])[C@H](NCc1cccc2cc[nH]c21)c1c(Cl)cccc1Cl ZINC000426762110 1026545072 /nfs/dbraw/zinc/54/50/72/1026545072.db2.gz HMMLFNRYMQCDIP-MRXNPFEDSA-N -1 1 349.217 4.390 20 0 EIADMM CN(Cc1ccc(OC(F)F)cc1)Cc1cccc([O-])c1Cl ZINC000506947488 1026560984 /nfs/dbraw/zinc/56/09/84/1026560984.db2.gz YQMHOYJGFFCLMR-UHFFFAOYSA-N -1 1 327.758 4.279 20 0 EIADMM O=C([O-])C[C@@H](NCc1ccsc1Cl)c1cccc(Cl)c1 ZINC000426815432 1026576557 /nfs/dbraw/zinc/57/65/57/1026576557.db2.gz FPFFWEBJEQPSCG-GFCCVEGCSA-N -1 1 330.236 4.361 20 0 EIADMM [O-]c1cccc(CN(Cc2cccs2)C[C@H]2CCCO2)c1Cl ZINC000507022683 1026600643 /nfs/dbraw/zinc/60/06/43/1026600643.db2.gz PYPPICBBMNHBQR-CQSZACIVSA-N -1 1 337.872 4.288 20 0 EIADMM O=C(Nc1ccc(OC(F)F)cc1)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684870211 1026627638 /nfs/dbraw/zinc/62/76/38/1026627638.db2.gz SVKNSUQNJLIPSB-UHFFFAOYSA-N -1 1 347.239 4.265 20 0 EIADMM O=C(NC12CC3CC(CC(C3)C1)C2)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684870744 1026633549 /nfs/dbraw/zinc/63/35/49/1026633549.db2.gz NLBCEGMKWDDDLT-UHFFFAOYSA-N -1 1 339.357 4.110 20 0 EIADMM C[C@@H](c1ccc(F)cc1)N(C)C(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684870904 1026633575 /nfs/dbraw/zinc/63/35/75/1026633575.db2.gz PRPQOOQAMSDHBK-JTQLQIEISA-N -1 1 341.304 4.383 20 0 EIADMM C[C@H](c1ccco1)N(C(=O)c1ccc(C(F)(F)F)c([O-])c1)C1CC1 ZINC000684873794 1026644471 /nfs/dbraw/zinc/64/44/71/1026644471.db2.gz FTJLOGXNXFBZSY-SNVBAGLBSA-N -1 1 339.313 4.370 20 0 EIADMM Cc1cnc(C(=O)N(C)[C@@H](C)[C@H](C)c2ccc(Cl)cc2)c([O-])c1 ZINC000427249483 1026789297 /nfs/dbraw/zinc/78/92/97/1026789297.db2.gz NCNYTKJDVVGDBC-STQMWFEESA-N -1 1 332.831 4.013 20 0 EIADMM CC(=O)c1cc([N-]S(=O)(=O)c2ccccc2C(C)(C)C)ccc1F ZINC000507638915 1026857843 /nfs/dbraw/zinc/85/78/43/1026857843.db2.gz VEYGXSKECAABGI-UHFFFAOYSA-N -1 1 349.427 4.127 20 0 EIADMM Cc1ccc(-c2csc3[nH]c(-c4ccc([O-])cn4)nc(=O)c23)cc1 ZINC000427470392 1026861558 /nfs/dbraw/zinc/86/15/58/1026861558.db2.gz RGQUCAJMFIWQLU-UHFFFAOYSA-N -1 1 335.388 4.140 20 0 EIADMM CCC[C@H](Cc1ccccc1)N(CCC)C(=O)c1cncc([O-])c1 ZINC000550298438 1026903733 /nfs/dbraw/zinc/90/37/33/1026903733.db2.gz BUKCZEDDUVGHQI-GOSISDBHSA-N -1 1 326.440 4.051 20 0 EIADMM Cc1cccc(C(C)C)c1[N-]S(=O)(=O)c1ccc(F)c(F)c1 ZINC000014257183 1027152271 /nfs/dbraw/zinc/15/22/71/1027152271.db2.gz HUMAYIIUEBVDHE-UHFFFAOYSA-N -1 1 325.380 4.197 20 0 EIADMM Cc1cccc([C@H](C)Nc2ccc(-c3nc(C)c(C)c(=O)[n-]3)cn2)c1C ZINC000078264626 1027263965 /nfs/dbraw/zinc/26/39/65/1027263965.db2.gz IGCRRZBQUKTVPO-INIZCTEOSA-N -1 1 348.450 4.239 20 0 EIADMM CCOc1cc(-c2noc(-c3cnc(C4CC4)o3)n2)cc(Cl)c1[O-] ZINC000896206051 1027327274 /nfs/dbraw/zinc/32/72/74/1027327274.db2.gz XZZMLMZGUBALBO-UHFFFAOYSA-N -1 1 347.758 4.027 20 0 EIADMM C[C@@H]([N-]c1nc(C2CCOCC2)no1)c1cc2cccc(F)c2o1 ZINC000665714151 1027404025 /nfs/dbraw/zinc/40/40/25/1027404025.db2.gz AHQQJXOVDVIMKO-SNVBAGLBSA-N -1 1 331.347 4.022 20 0 EIADMM Cc1cccc(C2=CCN(Cc3ccc(C(=O)[O-])c(F)c3)CC2)c1 ZINC000582856128 1027519980 /nfs/dbraw/zinc/51/99/80/1027519980.db2.gz CGIPWNAKOMUVDG-UHFFFAOYSA-N -1 1 325.383 4.122 20 0 EIADMM C[C@H](C[N@@H+](Cc1nc2ccccc2s1)Cc1ccccc1)C(=O)[O-] ZINC000582971313 1027789105 /nfs/dbraw/zinc/78/91/05/1027789105.db2.gz XBIMXGQAUWACAV-CQSZACIVSA-N -1 1 340.448 4.019 20 0 EIADMM C[C@H](CN(Cc1nc2ccccc2s1)Cc1ccccc1)C(=O)[O-] ZINC000582971313 1027789126 /nfs/dbraw/zinc/78/91/26/1027789126.db2.gz XBIMXGQAUWACAV-CQSZACIVSA-N -1 1 340.448 4.019 20 0 EIADMM Cc1csc2ncnc([N-]c3nc4c(s3)C(=O)CC(C)(C)C4)c12 ZINC000328971707 1027839891 /nfs/dbraw/zinc/83/98/91/1027839891.db2.gz AADLWNGCXZIZPH-UHFFFAOYSA-N -1 1 344.465 4.355 20 0 EIADMM COc1ccc(C(=O)N2C[C@H](C(C)(C)C)c3ccccc32)c([O-])c1 ZINC000443858335 1028011639 /nfs/dbraw/zinc/01/16/39/1028011639.db2.gz JZBKAJLRUXYZFP-INIZCTEOSA-N -1 1 325.408 4.191 20 0 EIADMM CCC[C@@H](C)c1nc(-c2cc(Br)c([O-])c(OC)c2)no1 ZINC000445393861 1028508728 /nfs/dbraw/zinc/50/87/28/1028508728.db2.gz PWMPDDCVEWNLOZ-MRVPVSSYSA-N -1 1 341.205 4.117 20 0 EIADMM CCOc1cc(-c2noc(-c3cc(C(C)C)on3)n2)cc(Cl)c1[O-] ZINC000445402096 1028515791 /nfs/dbraw/zinc/51/57/91/1028515791.db2.gz MFQCPHZKINUDPZ-UHFFFAOYSA-N -1 1 349.774 4.273 20 0 EIADMM CCOc1cc(-c2noc(-c3cccc(F)c3)n2)cc(Cl)c1[O-] ZINC000445420617 1028536277 /nfs/dbraw/zinc/53/62/77/1028536277.db2.gz CLEIRNJTVSBGAZ-UHFFFAOYSA-N -1 1 334.734 4.300 20 0 EIADMM CCOc1ccc(CCc2nc(-c3ccc([O-])cc3Cl)no2)cc1 ZINC000445442916 1028572797 /nfs/dbraw/zinc/57/27/97/1028572797.db2.gz AYYNQZRFFPZZRT-UHFFFAOYSA-N -1 1 344.798 4.280 20 0 EIADMM Cc1ccc(C(=O)CCc2nc(-c3ccc([O-])cc3F)no2)cc1C ZINC000445464863 1028583129 /nfs/dbraw/zinc/58/31/29/1028583129.db2.gz VTXXWHXNZROCIL-UHFFFAOYSA-N -1 1 340.354 4.014 20 0 EIADMM [O-]c1ccc(-c2noc(Cc3ccccc3C(F)(F)F)n2)c(F)c1 ZINC000445453123 1028607266 /nfs/dbraw/zinc/60/72/66/1028607266.db2.gz ADKJNFXYRRLPOE-UHFFFAOYSA-N -1 1 338.260 4.191 20 0 EIADMM [O-]c1ccc(-c2noc(-c3ccc(Br)s3)n2)c(F)c1 ZINC000445456609 1028610288 /nfs/dbraw/zinc/61/02/88/1028610288.db2.gz OQXVFUSEJIBGNH-UHFFFAOYSA-N -1 1 341.161 4.072 20 0 EIADMM [O-]c1ccc(-c2noc([C@H]3C[C@H]3c3c(F)cccc3F)n2)c(F)c1 ZINC000445457016 1028613840 /nfs/dbraw/zinc/61/38/40/1028613840.db2.gz QHNWLHGTUWOKOE-MNOVXSKESA-N -1 1 332.281 4.131 20 0 EIADMM [O-]c1ccc(-c2noc([C@H]3C[C@@H]3c3cccc(F)c3F)n2)c(F)c1 ZINC000445460389 1028614876 /nfs/dbraw/zinc/61/48/76/1028614876.db2.gz ACDFMVMFGNDJFH-NEPJUHHUSA-N -1 1 332.281 4.131 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cnc(-c4ccsc4)s3)n2)cc1F ZINC000445480847 1028627353 /nfs/dbraw/zinc/62/73/53/1028627353.db2.gz LARRLSFAPVZNDH-UHFFFAOYSA-N -1 1 345.380 4.433 20 0 EIADMM C[C@H](CSc1ccccc1)c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445476357 1028648378 /nfs/dbraw/zinc/64/83/78/1028648378.db2.gz BMUAFAGGLAAMEA-LLVKDONJSA-N -1 1 330.384 4.477 20 0 EIADMM Cc1c(-c2nc(-c3ccc([O-])cc3Cl)no2)cnn1C(C)(C)C ZINC000278301634 1028852257 /nfs/dbraw/zinc/85/22/57/1028852257.db2.gz XNQPAPBRZWAIBG-UHFFFAOYSA-N -1 1 332.791 4.023 20 0 EIADMM C[C@@H](CC1CCCC1)C(=O)N1CCC(C(=O)c2ccc([O-])cc2)CC1 ZINC000114537009 1029173744 /nfs/dbraw/zinc/17/37/44/1029173744.db2.gz WFIVZFIRQKGFLK-HNNXBMFYSA-N -1 1 343.467 4.030 20 0 EIADMM CCC1(CC)[C@H](OC)C[C@@H]1[N@@H+](C)Cc1cccc(C(=O)[O-])c1Cl ZINC000583877690 1029312563 /nfs/dbraw/zinc/31/25/63/1029312563.db2.gz VHBVXGZHTDHYCV-LSDHHAIUSA-N -1 1 339.863 4.064 20 0 EIADMM CCC1(CC)[C@@H](OC)C[C@@H]1[N@@H+](C)Cc1cccc(C(=O)[O-])c1Cl ZINC000583877688 1029314076 /nfs/dbraw/zinc/31/40/76/1029314076.db2.gz VHBVXGZHTDHYCV-GJZGRUSLSA-N -1 1 339.863 4.064 20 0 EIADMM O=C(Nc1cc(Cl)cc(C(F)(F)F)c1)c1ccc([O-])cc1F ZINC000318166162 1029715897 /nfs/dbraw/zinc/71/58/97/1029715897.db2.gz ZGCZGAUGOAJKHY-UHFFFAOYSA-N -1 1 333.668 4.456 20 0 EIADMM O=C(/C=C\c1ccccc1OC(F)(F)F)Nc1c([O-])cccc1F ZINC000760196709 1029994307 /nfs/dbraw/zinc/99/43/07/1029994307.db2.gz OVJGNJLTSIFANN-HJWRWDBZSA-N -1 1 341.260 4.082 20 0 EIADMM CCCc1c(C(=O)Nc2cccc(F)c2[O-])cnn1C1CCCC1 ZINC000530005896 1030047382 /nfs/dbraw/zinc/04/73/82/1030047382.db2.gz NPMFVGIENQHFIZ-UHFFFAOYSA-N -1 1 331.391 4.048 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccccc2N2CCCCC2)cc1C ZINC000006317118 1030301288 /nfs/dbraw/zinc/30/12/88/1030301288.db2.gz OJMCRYDRIBRDGH-UHFFFAOYSA-N -1 1 344.480 4.095 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2cc(F)ccc2Cl)sc1Cl ZINC000530382667 1030348145 /nfs/dbraw/zinc/34/81/45/1030348145.db2.gz DLVCDLHXIUKPCY-UHFFFAOYSA-N -1 1 340.228 4.303 20 0 EIADMM COc1cc(C(=O)Nc2ccc(OC(C)C)cc2C)cc(Cl)c1[O-] ZINC000527483474 1030700406 /nfs/dbraw/zinc/70/04/06/1030700406.db2.gz IEKLBLPFPBSIKN-UHFFFAOYSA-N -1 1 349.814 4.402 20 0 EIADMM CCc1ccc(S(=O)(=O)[N-]c2ccccc2SC(F)F)cc1 ZINC000008108734 1030835803 /nfs/dbraw/zinc/83/58/03/1030835803.db2.gz AHKPVRJJFIWUML-UHFFFAOYSA-N -1 1 343.420 4.365 20 0 EIADMM CC(C)C(=O)Nc1cccc(NC(=O)c2cc3ccccc3cc2[O-])c1 ZINC000029800752 1031180572 /nfs/dbraw/zinc/18/05/72/1031180572.db2.gz CNKPPVKWJHYFPF-UHFFFAOYSA-N -1 1 348.402 4.392 20 0 EIADMM CCOC(=O)[C@@H](NCc1cccc([O-])c1Cl)c1cccc(C)c1C ZINC000512706164 1033757991 /nfs/dbraw/zinc/75/79/91/1033757991.db2.gz WCIHUCXUPXBBLR-SFHVURJKSA-N -1 1 347.842 4.056 20 0 EIADMM CC[C@H](C)Oc1cccc([N-]S(=O)(=O)c2cc(C)ccc2C)c1 ZINC000512827819 1034026641 /nfs/dbraw/zinc/02/66/41/1034026641.db2.gz OESTVLMOOCHDLV-HNNXBMFYSA-N -1 1 333.453 4.282 20 0 EIADMM CCc1nc(SCC[C@@H](C)OCc2ccccc2)[n-]c(=O)c1C ZINC000576412231 1034540572 /nfs/dbraw/zinc/54/05/72/1034540572.db2.gz YEZCNFVSQSIFFI-CYBMUJFWSA-N -1 1 332.469 4.141 20 0 EIADMM [O-]c1cccc(CN2CC3(CCOCC3)c3ccccc32)c1Cl ZINC000513174249 1034825704 /nfs/dbraw/zinc/82/57/04/1034825704.db2.gz QNKKTQBVLXYHPR-UHFFFAOYSA-N -1 1 329.827 4.114 20 0 EIADMM Cc1cc(C(=O)NC(C)C)ccc1NCc1cccc([O-])c1Cl ZINC000513434419 1034941362 /nfs/dbraw/zinc/94/13/62/1034941362.db2.gz IRTRKPUJQYUSHW-UHFFFAOYSA-N -1 1 332.831 4.104 20 0 EIADMM CCCC[C@@H](NCc1ccc(-c2nc3ccccc3s2)o1)C(=O)[O-] ZINC000262696997 1034966469 /nfs/dbraw/zinc/96/64/69/1034966469.db2.gz IOFPTSLQKBGJQE-CQSZACIVSA-N -1 1 344.436 4.289 20 0 EIADMM CC[C@@H](CC1CCCC1)C(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC000513459307 1034972197 /nfs/dbraw/zinc/97/21/97/1034972197.db2.gz ZFISJNJVAIBNTE-AWEZNQCLSA-N -1 1 327.428 4.327 20 0 EIADMM O=C([N-]c1nc(C2CCCCCC2)cs1)c1nnc(C2CC2)o1 ZINC000913424579 1035720187 /nfs/dbraw/zinc/72/01/87/1035720187.db2.gz AYYKVJHSAWZNHD-UHFFFAOYSA-N -1 1 332.429 4.094 20 0 EIADMM O=S(=O)([N-]c1cc(F)cc(Cl)c1)c1ccc(C(F)F)cc1 ZINC000575211059 1035724443 /nfs/dbraw/zinc/72/44/43/1035724443.db2.gz AIVOPHAEMHMHDX-UHFFFAOYSA-N -1 1 335.734 4.218 20 0 EIADMM CC(C)c1cccc(N(C)C(=O)c2nc[n-]c2C(=O)c2ccccc2)c1 ZINC000485375164 1035853029 /nfs/dbraw/zinc/85/30/29/1035853029.db2.gz RQPAXXTXZDHUDO-UHFFFAOYSA-N -1 1 347.418 4.041 20 0 EIADMM O=C1c2ccc([O-])cc2CC/C1=C\c1cc(Br)cs1 ZINC000060340087 1036031806 /nfs/dbraw/zinc/03/18/06/1036031806.db2.gz LMYAOZIVYZAKHF-UXBLZVDNSA-N -1 1 335.222 4.429 20 0 EIADMM C[C@@H]1CCc2nc(NC(=O)Nc3ccc([O-])c(Cl)c3)sc2C1 ZINC000486160903 1036519307 /nfs/dbraw/zinc/51/93/07/1036519307.db2.gz WCWLHVUXJWACKF-MRVPVSSYSA-N -1 1 337.832 4.271 20 0 EIADMM CO[C@H](C)c1cccc([N-]S(=O)(=O)c2ccc(C)c(Cl)c2)c1 ZINC000588833495 1036544937 /nfs/dbraw/zinc/54/49/37/1036544937.db2.gz MTOZPZDHDSNEPO-GFCCVEGCSA-N -1 1 339.844 4.157 20 0 EIADMM O=C(Nc1cc([O-])c(F)cc1F)[C@@H](Cc1cccnc1)C1CCCC1 ZINC000909973318 1037215251 /nfs/dbraw/zinc/21/52/51/1037215251.db2.gz WOJNXFSBIXSHDS-AWEZNQCLSA-N -1 1 346.377 4.053 20 0 EIADMM Cc1cnc([C@@H](C)Sc2nc(-c3ccccc3)c(C)c(=O)[n-]2)cn1 ZINC000488271715 1037468469 /nfs/dbraw/zinc/46/84/69/1037468469.db2.gz ZPYQRDBFZOZDGW-CYBMUJFWSA-N -1 1 338.436 4.109 20 0 EIADMM S=c1[n-]nc(CCC2CCCC2)n1CN1CCc2ccccc2C1 ZINC000058204693 1037586220 /nfs/dbraw/zinc/58/62/20/1037586220.db2.gz MBYFMSLGVMYZNQ-UHFFFAOYSA-N -1 1 342.512 4.079 20 0 EIADMM Cc1ccc(-c2cc(=NC(=O)c3sccc3C(C)C)[nH][n-]2)s1 ZINC000591828019 1037610211 /nfs/dbraw/zinc/61/02/11/1037610211.db2.gz LAVIABCWJZCKGA-UHFFFAOYSA-N -1 1 331.466 4.306 20 0 EIADMM Cc1ccc(-c2nc(C)c(C(=O)Nc3c([O-])cccc3F)s2)o1 ZINC000605439555 1037787170 /nfs/dbraw/zinc/78/71/70/1037787170.db2.gz XOJGAWXKBLAGCB-UHFFFAOYSA-N -1 1 332.356 4.117 20 0 EIADMM O=C(CCC(=O)c1ccc2c(c1)CCCC2)Nc1c([O-])cccc1F ZINC000605439119 1037789153 /nfs/dbraw/zinc/78/91/53/1037789153.db2.gz VATJZRVALWRYIC-UHFFFAOYSA-N -1 1 341.382 4.012 20 0 EIADMM CCSCc1cc(C(=O)[N-]c2ccc(F)cc2SC)no1 ZINC000592719946 1037857712 /nfs/dbraw/zinc/85/77/12/1037857712.db2.gz DBYUCVJEFLFBOR-UHFFFAOYSA-N -1 1 326.418 4.041 20 0 EIADMM CN(C(=O)c1ccc(NC(=O)OC(C)(C)C)cc1[O-])c1ccsc1 ZINC000912010160 1037872597 /nfs/dbraw/zinc/87/25/97/1037872597.db2.gz MFYBZURTAURVFX-UHFFFAOYSA-N -1 1 348.424 4.077 20 0 EIADMM Cc1ccc(-c2nsc([N-]C(=O)c3cc(C(C)(C)C)on3)n2)s1 ZINC000607821453 1038350344 /nfs/dbraw/zinc/35/03/44/1038350344.db2.gz FFALSUBTDLZABK-UHFFFAOYSA-N -1 1 348.453 4.113 20 0 EIADMM COc1cc(C(=O)N[C@H](C)c2ccccc2Cl)cc(Cl)c1[O-] ZINC000490322094 1038480718 /nfs/dbraw/zinc/48/07/18/1038480718.db2.gz MHPYLLDIALJKBO-SECBINFHSA-N -1 1 340.206 4.199 20 0 EIADMM CC[C@@H](c1ccccc1)S(=O)(=O)c1nc(C)c(-c2ccccc2)[nH]1 ZINC000490438994 1038637186 /nfs/dbraw/zinc/63/71/86/1038637186.db2.gz AHZUMXXPWHDAEO-KRWDZBQOSA-N -1 1 340.448 4.310 20 0 EIADMM CC(C)c1ccc2c(c1)C(=N[N-]c1nncc3ccccc31)C(=O)N2 ZINC000044395028 1038655598 /nfs/dbraw/zinc/65/55/98/1038655598.db2.gz BAIZORRWWNZSHN-UHFFFAOYSA-N -1 1 331.379 4.171 20 0 EIADMM Cc1cc(C)cc([N-]S(=O)(=O)c2ccc3c(cnn3C(C)C)c2)c1 ZINC000476482972 1038809151 /nfs/dbraw/zinc/80/91/51/1038809151.db2.gz PWKAAKQIXWDMHQ-UHFFFAOYSA-N -1 1 343.452 4.035 20 0 EIADMM Cc1c(F)cccc1-c1ccc(CN2CCC[C@@H](C)[C@H]2C(=O)[O-])o1 ZINC000424417971 1038842800 /nfs/dbraw/zinc/84/28/00/1038842800.db2.gz MWZDPZJTFORSQV-XIKOKIGWSA-N -1 1 331.387 4.079 20 0 EIADMM Cc1cc(Cl)ccc1S(=O)(=O)[N-]c1ccc(-c2cnco2)cc1 ZINC000119786158 1039007309 /nfs/dbraw/zinc/00/73/09/1039007309.db2.gz RVEUWWUHGGENJJ-UHFFFAOYSA-N -1 1 348.811 4.104 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N1CCCCC[C@H]1c1ccncc1 ZINC000120914045 1039236413 /nfs/dbraw/zinc/23/64/13/1039236413.db2.gz UFJFPHQAYXYHNF-INIZCTEOSA-N -1 1 330.815 4.198 20 0 EIADMM C[C@@H]1C[C@@H]1c1ccc([C@H]2C[C@@H]2C(=O)Nc2ccc([O-])c(F)c2F)o1 ZINC000456793741 1039611222 /nfs/dbraw/zinc/61/12/22/1039611222.db2.gz OGOHNSVZJATQBM-RCWTZXSCSA-N -1 1 333.334 4.129 20 0 EIADMM COc1cc([N-]S(=O)(=O)c2ccc(C)c(Cl)c2)c(C)cc1C ZINC000478712590 1039873583 /nfs/dbraw/zinc/87/35/83/1039873583.db2.gz XBMDCFNWVDGWQB-UHFFFAOYSA-N -1 1 339.844 4.075 20 0 EIADMM O=C(Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)c1cccc(-c2ccoc2)c1 ZINC000551336797 1040209443 /nfs/dbraw/zinc/20/94/43/1040209443.db2.gz WJTWGAXBBNEFGK-UHFFFAOYSA-N -1 1 345.358 4.295 20 0 EIADMM CCOc1ccc([N-]S(=O)(=O)c2ccc(C(C)C)cc2)cc1F ZINC000515699547 1040459351 /nfs/dbraw/zinc/45/93/51/1040459351.db2.gz PMXMERXPCBFRHU-UHFFFAOYSA-N -1 1 337.416 4.149 20 0 EIADMM Cc1nc(-c2ccc(N[C@H](C)c3ccsc3)nc2)[n-]c(=O)c1C ZINC000669826964 1040479759 /nfs/dbraw/zinc/47/97/59/1040479759.db2.gz AGJFLRWHCIKFIE-GFCCVEGCSA-N -1 1 326.425 4.096 20 0 EIADMM Cc1nc(SCc2coc(-c3cccc(Cl)c3)n2)[n-]c(=O)c1C ZINC000553843073 1040581943 /nfs/dbraw/zinc/58/19/43/1040581943.db2.gz JQLWYMIPENCGQR-UHFFFAOYSA-N -1 1 347.827 4.400 20 0 EIADMM CCN(CCC(F)(F)F)Cc1ccc(-c2ccccc2C(=O)[O-])o1 ZINC000902203657 1040597262 /nfs/dbraw/zinc/59/72/62/1040597262.db2.gz IJAKBURJZLGKSL-UHFFFAOYSA-N -1 1 341.329 4.419 20 0 EIADMM Cc1ccc(-c2nnc([C@@H](C)Sc3nc(C)c(C)c(=O)[n-]3)o2)cc1 ZINC000539616386 1040612129 /nfs/dbraw/zinc/61/21/29/1040612129.db2.gz HYPBZVYOEDKWRQ-GFCCVEGCSA-N -1 1 342.424 4.011 20 0 EIADMM Cc1ccc2c(c1)N(C(=O)c1cc3ccccc3cc1[O-])C[C@H](C)O2 ZINC000539871744 1040856546 /nfs/dbraw/zinc/85/65/46/1040856546.db2.gz IETSSBXGFBCAFA-AWEZNQCLSA-N -1 1 333.387 4.282 20 0 EIADMM Cc1cc2cc[nH]c2cc1[N-]S(=O)(=O)c1cccc(Cl)c1C ZINC000436169492 1040921851 /nfs/dbraw/zinc/92/18/51/1040921851.db2.gz AUFRIHSALHVGBI-UHFFFAOYSA-N -1 1 334.828 4.239 20 0 EIADMM CCc1cc(=O)[n-]c(SCCCOc2cccc3ccccc32)n1 ZINC000436187949 1040932835 /nfs/dbraw/zinc/93/28/35/1040932835.db2.gz MCAUECJRQBWADB-UHFFFAOYSA-N -1 1 340.448 4.459 20 0 EIADMM Cc1nc(-c2ccc(N(C)C[C@@H](C)c3ccccc3)nc2)[n-]c(=O)c1C ZINC000462809975 1040955279 /nfs/dbraw/zinc/95/52/79/1040955279.db2.gz JVIKLPBCZLQVAC-CQSZACIVSA-N -1 1 348.450 4.101 20 0 EIADMM CCc1cc(=O)[n-]c(SCCCOc2ccc3ccccc3c2)n1 ZINC000436192082 1040963062 /nfs/dbraw/zinc/96/30/62/1040963062.db2.gz ANUWBZGJMKUWJS-UHFFFAOYSA-N -1 1 340.448 4.459 20 0 EIADMM CCc1cc(=O)[n-]c(SCC(=O)c2ccc([C@H](C)CC)cc2)n1 ZINC000436194838 1040965435 /nfs/dbraw/zinc/96/54/35/1040965435.db2.gz AWHPCIPUGCJCSV-GFCCVEGCSA-N -1 1 330.453 4.233 20 0 EIADMM CC[C@@H](Cc1ccccc1)Nc1ccc(-c2nc(C)c(C)c(=O)[n-]2)cn1 ZINC000462803421 1040970384 /nfs/dbraw/zinc/97/03/84/1040970384.db2.gz AWEFCEFEECLUOK-SFHVURJKSA-N -1 1 348.450 4.294 20 0 EIADMM Cc1nc(-c2ccc(N[C@@H]3CCC[C@@H](C(C)C)C3)nc2)[n-]c(=O)c1C ZINC000462828811 1040980080 /nfs/dbraw/zinc/98/00/80/1040980080.db2.gz QPQLWQDCHBYXFF-NVXWUHKLSA-N -1 1 340.471 4.488 20 0 EIADMM Cc1ccc(C[C@H]2CCCN(C(=O)c3cc(Cl)ccc3[O-])C2)cc1 ZINC000065321598 1040982456 /nfs/dbraw/zinc/98/24/56/1040982456.db2.gz DDXBKPWAMANAPH-MRXNPFEDSA-N -1 1 343.854 4.449 20 0 EIADMM Cc1cccc(S(=O)(=O)[N-]c2ccc(OC3CCCC3)c(F)c2)c1 ZINC000460829474 1040991098 /nfs/dbraw/zinc/99/10/98/1040991098.db2.gz MKHFTECJPOPYPZ-UHFFFAOYSA-N -1 1 349.427 4.256 20 0 EIADMM Cc1cc([N-]S(=O)(=O)c2ccc(CC(F)(F)F)cc2)ccc1F ZINC000480201815 1041076077 /nfs/dbraw/zinc/07/60/77/1041076077.db2.gz WPULCTGVZSTKDI-UHFFFAOYSA-N -1 1 347.333 4.040 20 0 EIADMM Cc1cc(F)cc([N-]S(=O)(=O)c2ccc(CC(F)(F)F)cc2)c1 ZINC000480208739 1041082335 /nfs/dbraw/zinc/08/23/35/1041082335.db2.gz KKEHNAKUWVOTRD-UHFFFAOYSA-N -1 1 347.333 4.040 20 0 EIADMM COc1cc(C(=O)N2CCC[C@@H](c3ccccc3)C2)cc(Cl)c1[O-] ZINC000554411546 1041093660 /nfs/dbraw/zinc/09/36/60/1041093660.db2.gz JOBPUQHONYITGY-CQSZACIVSA-N -1 1 345.826 4.074 20 0 EIADMM CC[C@H](C)[C@H](C)[N@@H+](Cc1coc(-c2ccc(C(=O)[O-])cc2)n1)C1CC1 ZINC000567359166 1041243760 /nfs/dbraw/zinc/24/37/60/1041243760.db2.gz MEOSWMYEMVIALV-KBPBESRZSA-N -1 1 342.439 4.439 20 0 EIADMM O=C(Nc1ccccc1COCc1ccccc1)c1ccccc1[O-] ZINC000436507601 1041293006 /nfs/dbraw/zinc/29/30/06/1041293006.db2.gz AJRVLTBGDAABRN-UHFFFAOYSA-N -1 1 333.387 4.361 20 0 EIADMM COc1ccc2ccc(-c3nc(-c4ccc([O-])c(F)c4)no3)cc2c1 ZINC000436522107 1041304144 /nfs/dbraw/zinc/30/41/44/1041304144.db2.gz RUEHUGWQGHWBTK-UHFFFAOYSA-N -1 1 336.322 4.410 20 0 EIADMM Cc1ccc2snc(-c3nc(-c4ccc([O-])cc4F)no3)c2c1 ZINC000436522835 1041305044 /nfs/dbraw/zinc/30/50/44/1041305044.db2.gz XJMXLRMNONRLKP-UHFFFAOYSA-N -1 1 327.340 4.166 20 0 EIADMM O=C(NC(c1cccs1)c1cccs1)c1cc(F)ccc1[O-] ZINC000436525836 1041308257 /nfs/dbraw/zinc/30/82/57/1041308257.db2.gz BUOCXGJCHUAQAC-UHFFFAOYSA-N -1 1 333.409 4.174 20 0 EIADMM CN(C(=O)c1cc2ccccc2cc1[O-])[C@@H]1CCc2ccccc2C1 ZINC000436548191 1041326395 /nfs/dbraw/zinc/32/63/95/1041326395.db2.gz PSJNSZKXWUHCHQ-LJQANCHMSA-N -1 1 331.415 4.175 20 0 EIADMM CCCC[C@@H]1CCC[C@H]1NC(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC000436552234 1041327561 /nfs/dbraw/zinc/32/75/61/1041327561.db2.gz BLYLGJLCNVFVFH-BXUZGUMPSA-N -1 1 325.836 4.143 20 0 EIADMM CCN(C(=O)c1cc(Cl)ccc1[O-])[C@H](C)Cc1ccc(OC)cc1 ZINC000436553670 1041327970 /nfs/dbraw/zinc/32/79/70/1041327970.db2.gz FYQWKUYXEPRVLW-CYBMUJFWSA-N -1 1 347.842 4.148 20 0 EIADMM CC[C@H](C)[C@H](C)N(C(=O)c1cc(Cl)c([O-])c(OC)c1)C1CC1 ZINC000436538551 1041331002 /nfs/dbraw/zinc/33/10/02/1041331002.db2.gz WDQAGCLGTJMULP-QWRGUYRKSA-N -1 1 325.836 4.093 20 0 EIADMM CCC[C@]1(C)CCCN(C(=O)c2cc(Cl)c([O-])c(OC)c2)C1 ZINC000436539578 1041334065 /nfs/dbraw/zinc/33/40/65/1041334065.db2.gz YXSHUAXDWLPNJZ-QGZVFWFLSA-N -1 1 325.836 4.097 20 0 EIADMM C[C@H]1CN(C(=O)c2cc3ccccc3cc2[O-])[C@H](c2ccccc2)CO1 ZINC000436575125 1041338531 /nfs/dbraw/zinc/33/85/31/1041338531.db2.gz NNSKGIGTOYMSKF-YWZLYKJASA-N -1 1 347.414 4.148 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N1C[C@H](c2ccccc2)[C@H]2CCC[C@@H]21 ZINC000436557200 1041341888 /nfs/dbraw/zinc/34/18/88/1041341888.db2.gz SWXMUMGFGCRSBT-NXHRZFHOSA-N -1 1 341.838 4.454 20 0 EIADMM O=C(N[C@@H]1CCOC2(CCCCC2)C1)c1ccc2ccccc2c1[O-] ZINC000436596369 1041355093 /nfs/dbraw/zinc/35/50/93/1041355093.db2.gz QFERCIWRICTUME-MRXNPFEDSA-N -1 1 339.435 4.157 20 0 EIADMM Cc1csc([C@H](NC(=O)c2ccc3ccccc3c2[O-])C2CC2)n1 ZINC000436581500 1041360215 /nfs/dbraw/zinc/36/02/15/1041360215.db2.gz FVFTYYABFMPZTK-MRXNPFEDSA-N -1 1 338.432 4.191 20 0 EIADMM O=C(C[C@@H]1CCCN1C(=O)c1ccc2ccccc2c1[O-])c1ccco1 ZINC000436581649 1041361664 /nfs/dbraw/zinc/36/16/64/1041361664.db2.gz BGPALDJPIPZDNK-HNNXBMFYSA-N -1 1 349.386 4.016 20 0 EIADMM O=C(NC[C@@H]1CCO[C@H]1c1ccccc1)c1ccc2ccccc2c1[O-] ZINC000436587429 1041363298 /nfs/dbraw/zinc/36/32/98/1041363298.db2.gz FDSRUZRGHKCZLC-UWJYYQICSA-N -1 1 347.414 4.053 20 0 EIADMM CC[C@H]1CN(C(=O)c2cc(F)ccc2[O-])CC[C@H]1c1ccccc1 ZINC000436587171 1041364006 /nfs/dbraw/zinc/36/40/06/1041364006.db2.gz ODIMUCOCEKTUOM-WMLDXEAASA-N -1 1 327.399 4.187 20 0 EIADMM Cc1ccccc1[C@@H]1CCN(C(=O)c2ccc3ccccc3c2[O-])C1 ZINC000436625753 1041377721 /nfs/dbraw/zinc/37/77/21/1041377721.db2.gz PIJPDKIMECXWGS-QGZVFWFLSA-N -1 1 331.415 4.484 20 0 EIADMM CC1=C(c2ccco2)CN(C(=O)c2ccc3ccccc3c2[O-])CC1 ZINC000436637578 1041386316 /nfs/dbraw/zinc/38/63/16/1041386316.db2.gz XBAAKWVPOPWLFG-UHFFFAOYSA-N -1 1 333.387 4.458 20 0 EIADMM Cc1ccccc1[C@H]1CCN(C(=O)c2cc3ccccc3cc2[O-])C1 ZINC000436623819 1041389587 /nfs/dbraw/zinc/38/95/87/1041389587.db2.gz JEIUHJQTODYJBL-SFHVURJKSA-N -1 1 331.415 4.484 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1CCn2c(cc3ccccc32)C1 ZINC000436657391 1041397047 /nfs/dbraw/zinc/39/70/47/1041397047.db2.gz VGDMZTGJHKKXIV-UHFFFAOYSA-N -1 1 342.398 4.156 20 0 EIADMM [O-]c1c(-c2nc(-c3ncsc3Cl)no2)ccc2ccccc12 ZINC000436656381 1041397672 /nfs/dbraw/zinc/39/76/72/1041397672.db2.gz IORWGRWOUHSRQY-UHFFFAOYSA-N -1 1 329.768 4.372 20 0 EIADMM Cc1cnn([C@H]2CCCc3ccccc32)c1NC(=O)c1ccccc1[O-] ZINC000436640446 1041399220 /nfs/dbraw/zinc/39/92/20/1041399220.db2.gz HZKKZZQJSILISA-SFHVURJKSA-N -1 1 347.418 4.075 20 0 EIADMM O=C(NC12CCC(C(F)(F)F)(CC1)CC2)c1ccc(Cl)cc1[O-] ZINC000436716830 1041440987 /nfs/dbraw/zinc/44/09/87/1041440987.db2.gz RGWRIFVZOROJCO-UHFFFAOYSA-N -1 1 347.764 4.431 20 0 EIADMM C[C@H](c1cccc(C(F)(F)F)c1)N(C)C(=O)c1cc(F)ccc1[O-] ZINC000436759855 1041458314 /nfs/dbraw/zinc/45/83/14/1041458314.db2.gz HNUYCXUGUIFIKX-SNVBAGLBSA-N -1 1 341.304 4.383 20 0 EIADMM C[C@H]1C[C@@H](c2ccccc2)CCN1C(=O)c1cc(Cl)ccc1[O-] ZINC000436749604 1041461304 /nfs/dbraw/zinc/46/13/04/1041461304.db2.gz KLRIWJIGPPNREE-ZFWWWQNUSA-N -1 1 329.827 4.454 20 0 EIADMM O=C(c1ccc(C(F)(F)F)cc1[O-])N1CC[C@@H](Cc2ccccc2)C1 ZINC000436750896 1041463161 /nfs/dbraw/zinc/46/31/61/1041463161.db2.gz IKEREAXPSOJIOR-AWEZNQCLSA-N -1 1 349.352 4.116 20 0 EIADMM O=C(N[C@@H](c1ccccc1)[C@H]1CCOC1)c1ccc2ccccc2c1[O-] ZINC000436750974 1041463558 /nfs/dbraw/zinc/46/35/58/1041463558.db2.gz PZYWOMZMYLJHKW-PXNSSMCTSA-N -1 1 347.414 4.053 20 0 EIADMM C[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436752418 1041465253 /nfs/dbraw/zinc/46/52/53/1041465253.db2.gz RJJZWEMMSGEYMS-UHIISALHSA-N -1 1 327.346 4.204 20 0 EIADMM C[C@H]1C[C@H](c2ccccc2)CN1C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436752918 1041465639 /nfs/dbraw/zinc/46/56/39/1041465639.db2.gz SQOWIQXKAWKXNR-JSGCOSHPSA-N -1 1 349.352 4.429 20 0 EIADMM CC[C@]1(C(=O)[O-])CCCN(Cc2cc(Cl)cc(Cl)c2OC)C1 ZINC000904399866 1041467365 /nfs/dbraw/zinc/46/73/65/1041467365.db2.gz BMKYRSGMPGKBLM-INIZCTEOSA-N -1 1 346.254 4.079 20 0 EIADMM O=C(c1ccc(C(F)(F)F)cc1[O-])N(Cc1ccccc1)C1CC1 ZINC000436764540 1041474690 /nfs/dbraw/zinc/47/46/90/1041474690.db2.gz RUMUSBOBEORKRL-UHFFFAOYSA-N -1 1 335.325 4.216 20 0 EIADMM C[C@H]1c2ccsc2CCN1C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436797231 1041485568 /nfs/dbraw/zinc/48/55/68/1041485568.db2.gz ZGWUUTQJTYBTST-VIFPVBQESA-N -1 1 341.354 4.232 20 0 EIADMM C[C@H](NC(=O)c1cc(Cl)ccc1[O-])c1nc(C(C)(C)C)cs1 ZINC000436816221 1041493351 /nfs/dbraw/zinc/49/33/51/1041493351.db2.gz CXHWMGZQDMAOBN-VIFPVBQESA-N -1 1 338.860 4.291 20 0 EIADMM O=C(c1cc(F)ccc1[O-])N1CCC([C@H](F)c2ccccc2F)CC1 ZINC000436836317 1041500557 /nfs/dbraw/zinc/50/05/57/1041500557.db2.gz CSEMOHJUHFAVKB-SFHVURJKSA-N -1 1 349.352 4.233 20 0 EIADMM O=C(Nc1cc(F)c(F)cc1F)c1ccc(C(F)(F)F)cc1[O-] ZINC000436821707 1041501576 /nfs/dbraw/zinc/50/15/76/1041501576.db2.gz XNOXZAICOPMWTQ-UHFFFAOYSA-N -1 1 335.203 4.081 20 0 EIADMM CO[C@@H]1CCOc2c(NC(=O)c3ccc4ccccc4c3[O-])cccc21 ZINC000436819441 1041501643 /nfs/dbraw/zinc/50/16/43/1041501643.db2.gz NNGDBWMALCOCGR-GOSISDBHSA-N -1 1 349.386 4.268 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N1CCC[C@@H]1Cc1ccc(F)cc1 ZINC000436822886 1041502065 /nfs/dbraw/zinc/50/20/65/1041502065.db2.gz XNYCOJMLKWLRRB-OAHLLOKOSA-N -1 1 333.790 4.032 20 0 EIADMM Cc1cccc([C@@H]2CCN(C(=O)c3ccc4ccccc4c3[O-])C2)c1 ZINC000436847016 1041516356 /nfs/dbraw/zinc/51/63/56/1041516356.db2.gz DFSQAJWLWNWAGI-GOSISDBHSA-N -1 1 331.415 4.484 20 0 EIADMM Cc1cccc([C@@H]2CCN(C(=O)c3cc4ccccc4cc3[O-])C2)c1 ZINC000436850526 1041518761 /nfs/dbraw/zinc/51/87/61/1041518761.db2.gz IFWZPTKQHJYJFG-LJQANCHMSA-N -1 1 331.415 4.484 20 0 EIADMM [O-]c1ccc(-c2noc(-c3csc(C(F)(F)F)n3)n2)c(Cl)c1 ZINC000436868190 1041524670 /nfs/dbraw/zinc/52/46/70/1041524670.db2.gz HIIUMTHKUNYZCT-UHFFFAOYSA-N -1 1 347.705 4.238 20 0 EIADMM CSc1ccc([O-])c(-c2nc(Cc3ccc(Cl)cc3)no2)c1 ZINC000904544447 1041526037 /nfs/dbraw/zinc/52/60/37/1041526037.db2.gz LXCOWIXFPSHCLT-UHFFFAOYSA-N -1 1 332.812 4.408 20 0 EIADMM O=C(Nc1ccc(-c2ncco2)cc1)c1ccc2ccccc2c1[O-] ZINC000436866809 1041526327 /nfs/dbraw/zinc/52/63/27/1041526327.db2.gz ZJIOGURSEONWBG-UHFFFAOYSA-N -1 1 330.343 4.453 20 0 EIADMM CC(=O)c1cc(-c2nc(-c3ccc([O-])cc3Cl)no2)ccc1C ZINC000436868606 1041527502 /nfs/dbraw/zinc/52/75/02/1041527502.db2.gz AMNSDMVAFWDPLF-UHFFFAOYSA-N -1 1 328.755 4.274 20 0 EIADMM Cc1ccc(C(=O)CCc2nc(-c3ccc([O-])cc3Cl)no2)s1 ZINC000436874759 1041533283 /nfs/dbraw/zinc/53/32/83/1041533283.db2.gz VLFFBRDUJRHEDN-UHFFFAOYSA-N -1 1 348.811 4.281 20 0 EIADMM Cc1cccc(C2(CNC(=O)c3c(F)ccc([O-])c3F)CCCC2)c1 ZINC000540546351 1041534113 /nfs/dbraw/zinc/53/41/13/1041534113.db2.gz HIQFUVQLSOFHQU-UHFFFAOYSA-N -1 1 345.389 4.221 20 0 EIADMM [O-]c1ccc(-c2noc([C@@H]3[C@@H](c4ccccc4)C3(F)F)n2)cc1F ZINC000436876557 1041536367 /nfs/dbraw/zinc/53/63/67/1041536367.db2.gz ABKIONVMHNWTEW-KGLIPLIRSA-N -1 1 332.281 4.098 20 0 EIADMM CCCOc1cc(OC)ccc1-c1nc(-c2ccc([O-])cc2F)no1 ZINC000436878175 1041536383 /nfs/dbraw/zinc/53/63/83/1041536383.db2.gz IUZOLRKHLPNYFJ-UHFFFAOYSA-N -1 1 344.342 4.046 20 0 EIADMM CCOc1cc(Cl)ccc1-c1nc(-c2ccc([O-])cc2F)no1 ZINC000436876672 1041536551 /nfs/dbraw/zinc/53/65/51/1041536551.db2.gz ANIWEVBZOZSUOC-UHFFFAOYSA-N -1 1 334.734 4.300 20 0 EIADMM O=C(NCC1(Cc2ccccc2)CCCC1)c1c(F)ccc([O-])c1F ZINC000540567446 1041537156 /nfs/dbraw/zinc/53/71/56/1041537156.db2.gz UAPOZPGJWDWFFC-UHFFFAOYSA-N -1 1 345.389 4.203 20 0 EIADMM COc1ccc2occ(-c3nc(-c4ccc([O-])c(F)c4)no3)c2c1 ZINC000436881039 1041537664 /nfs/dbraw/zinc/53/76/64/1041537664.db2.gz UZZVNBWCDVOTRH-UHFFFAOYSA-N -1 1 326.283 4.003 20 0 EIADMM CCOc1cc(-c2noc(/C=C\c3ccn(C)c3)n2)cc(Cl)c1[O-] ZINC000436878941 1041537805 /nfs/dbraw/zinc/53/78/05/1041537805.db2.gz LEEXKTBJQZGZID-PLNGDYQASA-N -1 1 345.786 4.003 20 0 EIADMM O=C(c1ccc([O-])cc1F)N(C1CC1)[C@H]1CCCc2ccccc21 ZINC000436881571 1041538775 /nfs/dbraw/zinc/53/87/75/1041538775.db2.gz SYACADLKNPIQMW-IBGZPJMESA-N -1 1 325.383 4.214 20 0 EIADMM C[C@H](Cc1nc(-c2ccc([O-])c(F)c2)no1)c1c[nH]c2ccccc21 ZINC000436881909 1041539004 /nfs/dbraw/zinc/53/90/04/1041539004.db2.gz ZBUJYSWRRWSTPG-LLVKDONJSA-N -1 1 337.354 4.409 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1CCc2c(Cl)cccc2C1 ZINC000436886840 1041542205 /nfs/dbraw/zinc/54/22/05/1041542205.db2.gz LYXDYWLDURAGQJ-UHFFFAOYSA-N -1 1 337.806 4.397 20 0 EIADMM C[C@]1(c2ccccc2)CCCN(C(=O)c2ccc(Cl)cc2[O-])C1 ZINC000436946271 1041569040 /nfs/dbraw/zinc/56/90/40/1041569040.db2.gz AFEHVVDSAWZLJP-IBGZPJMESA-N -1 1 329.827 4.240 20 0 EIADMM CCC(C)(C)OCc1ccccc1NC(=O)c1cc(F)ccc1[O-] ZINC000436984514 1041588162 /nfs/dbraw/zinc/58/81/62/1041588162.db2.gz BRQLTRDYMNLZIQ-UHFFFAOYSA-N -1 1 331.387 4.489 20 0 EIADMM CCCCN(C(=O)C(=O)c1ccc([O-])cc1)[C@H](CC)c1ccccc1 ZINC000437002172 1041595493 /nfs/dbraw/zinc/59/54/93/1041595493.db2.gz PNKWVIQDVJNGBZ-LJQANCHMSA-N -1 1 339.435 4.355 20 0 EIADMM Cc1ccc(F)cc1S(=O)(=O)[N-]c1cc(C)c(C)c2ncccc12 ZINC000437304910 1041748686 /nfs/dbraw/zinc/74/86/86/1041748686.db2.gz LKSYKVRGGZMXKT-UHFFFAOYSA-N -1 1 344.411 4.100 20 0 EIADMM COc1ccc(C(=O)Nc2ccc3oc(C(C)(C)C)nc3c2)c([O-])c1 ZINC000302963465 1042210201 /nfs/dbraw/zinc/21/02/01/1042210201.db2.gz PICWQUXRILYVRE-UHFFFAOYSA-N -1 1 340.379 4.092 20 0 EIADMM COc1ccc(S(=O)(=O)[N-]c2ccccc2C(C)C)c(C)c1F ZINC000542094820 1042281297 /nfs/dbraw/zinc/28/12/97/1042281297.db2.gz VHANDFVFMIAFAM-UHFFFAOYSA-N -1 1 337.416 4.067 20 0 EIADMM CCSc1cccc(F)c1[N-]S(=O)(=O)c1c(C)cccc1F ZINC000518023919 1042310136 /nfs/dbraw/zinc/31/01/36/1042310136.db2.gz XTECSEVPTPBHOQ-UHFFFAOYSA-N -1 1 343.420 4.186 20 0 EIADMM CCOCc1ccc([N-]S(=O)(=O)c2cccc(C(C)C)c2)cc1 ZINC000438710180 1042318931 /nfs/dbraw/zinc/31/89/31/1042318931.db2.gz CQSRMABTVDUZDU-UHFFFAOYSA-N -1 1 333.453 4.147 20 0 EIADMM CC(C)(C)c1nc2ccc([N-]S(=O)(=O)c3ccccc3)cc2s1 ZINC000438771910 1042341802 /nfs/dbraw/zinc/34/18/02/1042341802.db2.gz CZGPKRQQFDZSNY-UHFFFAOYSA-N -1 1 346.477 4.395 20 0 EIADMM Cc1ccc2[nH]cc(CCC(=O)Nc3ccc([O-])c(Cl)c3)c2c1 ZINC000174416415 1042685092 /nfs/dbraw/zinc/68/50/92/1042685092.db2.gz YGHWEKXNINYOEI-UHFFFAOYSA-N -1 1 328.799 4.407 20 0 EIADMM C[C@@H](CC(=O)Nc1ccc([O-])c(Cl)c1)C(=O)c1cccc(F)c1 ZINC000174416387 1042685101 /nfs/dbraw/zinc/68/51/01/1042685101.db2.gz VPCWLZGHVMPOHD-JTQLQIEISA-N -1 1 335.762 4.032 20 0 EIADMM O=S(=O)([N-]c1cccc(C(F)F)c1)c1ccc2c(c1)CCCC2 ZINC000509596342 1042689677 /nfs/dbraw/zinc/68/96/77/1042689677.db2.gz PIXJPORQJRCMJP-UHFFFAOYSA-N -1 1 337.391 4.304 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1C[C@@H]2CCC[C@]2(C(F)(F)F)C1 ZINC000894387285 1042743063 /nfs/dbraw/zinc/74/30/63/1042743063.db2.gz WOVYQFQJUYLMPZ-UGSOOPFHSA-N -1 1 349.352 4.350 20 0 EIADMM CCCCOc1ccc([N-]S(=O)(=O)c2ccsc2)c(C)c1 ZINC000506712300 1042798527 /nfs/dbraw/zinc/79/85/27/1042798527.db2.gz YEPSAMREOZMHDP-UHFFFAOYSA-N -1 1 325.455 4.036 20 0 EIADMM CCOc1cc([N-]S(=O)(=O)c2ccc(C(F)F)cc2)ccc1C ZINC000520598753 1042918165 /nfs/dbraw/zinc/91/81/65/1042918165.db2.gz GSJJWNJUXADJRV-UHFFFAOYSA-N -1 1 341.379 4.132 20 0 EIADMM O=S(=O)([N-]c1ccccc1CCC(F)(F)F)c1cccc(F)c1 ZINC000089103005 1042936461 /nfs/dbraw/zinc/93/64/61/1042936461.db2.gz DBQWKOXTPZCSEF-UHFFFAOYSA-N -1 1 347.333 4.121 20 0 EIADMM C[C@H](c1ccc(Cl)cc1Cl)N1CCC2(C[C@@H]2C(=O)[O-])CC1 ZINC000405350637 1042949923 /nfs/dbraw/zinc/94/99/23/1042949923.db2.gz CJCHPAMUIDAGJL-ZWNOBZJWSA-N -1 1 328.239 4.241 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@H]1C[C@H]1c1cc(F)c(F)c(F)c1 ZINC000184002008 1043072564 /nfs/dbraw/zinc/07/25/64/1043072564.db2.gz LTVKRLCOQGTFQA-UWVGGRQHSA-N -1 1 341.716 4.205 20 0 EIADMM Cc1nc(C(C)C)[n-]c(=O)c1C(=O)NCC1CCC(C(C)(C)C)CC1 ZINC000766032074 1043074225 /nfs/dbraw/zinc/07/42/25/1043074225.db2.gz RFCNZXCZAHLCRP-UHFFFAOYSA-N -1 1 347.503 4.196 20 0 EIADMM CCc1ccc([C@H]2CCCN(C(=O)c3ccc([O-])c(F)c3)C2)cc1 ZINC000672298401 1043076145 /nfs/dbraw/zinc/07/61/45/1043076145.db2.gz PWWFUYWPPRKGDJ-KRWDZBQOSA-N -1 1 327.399 4.114 20 0 EIADMM Cc1c(=O)[n-]c(SCc2ccc(F)cc2F)nc1-c1ccccc1 ZINC000185056633 1043153503 /nfs/dbraw/zinc/15/35/03/1043153503.db2.gz CJXXPSMLEFMBOG-UHFFFAOYSA-N -1 1 344.386 4.316 20 0 EIADMM Cc1ccc(Cl)c2sc(NC(=O)c3ccc([O-])c(F)c3)nc21 ZINC000672366070 1043156910 /nfs/dbraw/zinc/15/69/10/1043156910.db2.gz ZWHCIHXYPODNFR-UHFFFAOYSA-N -1 1 336.775 4.355 20 0 EIADMM Cc1cnc(C(=O)N2CCCCC[C@@H]2/C=C/c2cccs2)c([O-])c1 ZINC000427912236 1043258691 /nfs/dbraw/zinc/25/86/91/1043258691.db2.gz GCVYPZGDYZCUQM-XVJNWHFHSA-N -1 1 342.464 4.255 20 0 EIADMM C[C@H](C(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)c1ccc(Cl)s1 ZINC000428039278 1043300746 /nfs/dbraw/zinc/30/07/46/1043300746.db2.gz DGKIXYCALSOTEB-VIFPVBQESA-N -1 1 347.827 4.239 20 0 EIADMM [O-]c1cccnc1-c1nc(-c2cc(Cl)cc(C(F)(F)F)c2)no1 ZINC001212480792 1043438283 /nfs/dbraw/zinc/43/82/83/1043438283.db2.gz JAAQTTMTYJRDQT-UHFFFAOYSA-N -1 1 341.676 4.176 20 0 EIADMM Cc1ccc(C(=O)COC(=O)c2ccc(Cl)c(Cl)c2[O-])cc1 ZINC000730359715 1043503175 /nfs/dbraw/zinc/50/31/75/1043503175.db2.gz MPLDSAVGRDZFKK-UHFFFAOYSA-N -1 1 339.174 4.047 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)Nc1ccccc1N1CCCC1 ZINC000190923405 1043749242 /nfs/dbraw/zinc/74/92/42/1043749242.db2.gz ZOSVBVQUOWKTNV-UHFFFAOYSA-N -1 1 331.803 4.290 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1ncccc1Oc1ccccc1 ZINC000442660387 1043787667 /nfs/dbraw/zinc/78/76/67/1043787667.db2.gz ZFBDPHYBRRUZHE-UHFFFAOYSA-N -1 1 340.766 4.485 20 0 EIADMM COc1cc(C(=O)N(Cc2ccccc2)CC(C)C)cc(Cl)c1[O-] ZINC000442937379 1043897172 /nfs/dbraw/zinc/89/71/72/1043897172.db2.gz CBFDFSQSIYBGJG-UHFFFAOYSA-N -1 1 347.842 4.353 20 0 EIADMM CCN(C(=O)c1cc(Cl)c([O-])c(OC)c1)[C@H]1CCCC[C@@H]1C ZINC000442966743 1043927334 /nfs/dbraw/zinc/92/73/34/1043927334.db2.gz NGVZAAAUCLYKPQ-FZMZJTMJSA-N -1 1 325.836 4.095 20 0 EIADMM COc1cc(C(=O)NCC2(CC(C)C)CCC2)cc(Cl)c1[O-] ZINC000443066089 1043985164 /nfs/dbraw/zinc/98/51/64/1043985164.db2.gz RCGWWNODJYDOMK-UHFFFAOYSA-N -1 1 325.836 4.000 20 0 EIADMM COc1cc(C(=O)N2CCC[C@@H]2CCC(C)C)cc(Cl)c1[O-] ZINC000443067705 1043988318 /nfs/dbraw/zinc/98/83/18/1043988318.db2.gz UNGXGLAWWPRQHH-CYBMUJFWSA-N -1 1 325.836 4.095 20 0 EIADMM C[C@@H](c1cc(F)ccc1F)N1CCC(C(=O)c2ccc([O-])cc2)CC1 ZINC000079877910 1044028593 /nfs/dbraw/zinc/02/85/93/1044028593.db2.gz CJRKJNAKRXVMGK-ZDUSSCGKSA-N -1 1 345.389 4.326 20 0 EIADMM CCOc1cc(-c2nc([C@@H](C)SCC)no2)cc(Cl)c1[O-] ZINC000443218757 1044107015 /nfs/dbraw/zinc/10/70/15/1044107015.db2.gz GVSKNAAMLYVTJF-MRVPVSSYSA-N -1 1 328.821 4.308 20 0 EIADMM C[C@@H]1CCCCC[N@H+]1Cc1csc(-c2cccc(C(=O)[O-])c2)n1 ZINC000522008794 1044152611 /nfs/dbraw/zinc/15/26/11/1044152611.db2.gz WFZWAJRTANUFQO-CYBMUJFWSA-N -1 1 330.453 4.273 20 0 EIADMM CCc1cc2c(CNc3ccc4[nH]c(C)cc4c3)cc(=O)oc2cc1[O-] ZINC000733321831 1044184016 /nfs/dbraw/zinc/18/40/16/1044184016.db2.gz VUXGLEYUOLQVDD-UHFFFAOYSA-N -1 1 348.402 4.463 20 0 EIADMM C[C@@H]([N-]c1nc(-c2cc(Cl)cc(Cl)c2)no1)c1ccon1 ZINC000673442941 1044355903 /nfs/dbraw/zinc/35/59/03/1044355903.db2.gz BSPQLOMPUCBWST-SSDOTTSWSA-N -1 1 325.155 4.205 20 0 EIADMM CCCN(CC1CC1)C(=O)c1ccc(NC(=O)OC(C)(C)C)cc1[O-] ZINC000093901637 1044426751 /nfs/dbraw/zinc/42/67/51/1044426751.db2.gz ROEBDYJVXBZQHP-UHFFFAOYSA-N -1 1 348.443 4.001 20 0 EIADMM CCc1ccc(-c2nc(CN3CCC[C@H](CC(=O)[O-])C3)cs2)cc1 ZINC000676232326 1044690066 /nfs/dbraw/zinc/69/00/66/1044690066.db2.gz ADJQMZFJCMMGDC-OAHLLOKOSA-N -1 1 344.480 4.059 20 0 EIADMM CCc1ccc(-c2nc(CN3CCC[C@@H](CC(=O)[O-])C3)cs2)cc1 ZINC000676232324 1044690659 /nfs/dbraw/zinc/69/06/59/1044690659.db2.gz ADJQMZFJCMMGDC-HNNXBMFYSA-N -1 1 344.480 4.059 20 0 EIADMM Cc1ccc(OC2CCN(C(=O)c3c([O-])cccc3Cl)CC2)cc1 ZINC000735117680 1044753010 /nfs/dbraw/zinc/75/30/10/1044753010.db2.gz CIOJQOFWEJJXKL-UHFFFAOYSA-N -1 1 345.826 4.038 20 0 EIADMM O=S(=O)(C=Cc1ccc(F)cc1)[N-]c1cc(C2CCCCC2)[nH]n1 ZINC000761841396 1044770116 /nfs/dbraw/zinc/77/01/16/1044770116.db2.gz SLADDEGREMMCSM-ZHACJKMWSA-N -1 1 349.431 4.009 20 0 EIADMM [O-]c1ccc(-c2nc(-c3cc(Br)cs3)no2)c(F)c1 ZINC000230225865 1044810110 /nfs/dbraw/zinc/81/01/10/1044810110.db2.gz LFZCIPNZQHNZFQ-UHFFFAOYSA-N -1 1 341.161 4.072 20 0 EIADMM Cc1oc(-c2ccccc2)nc1CSc1nc(C2CC2)cc(=O)[n-]1 ZINC000470448245 1044880401 /nfs/dbraw/zinc/88/04/01/1044880401.db2.gz NEOBMIKJKFBLBJ-UHFFFAOYSA-N -1 1 339.420 4.315 20 0 EIADMM CCCc1nc(C(=O)[N-]c2nnc(-c3cc(C)cc(C)c3)s2)co1 ZINC000509446211 1045177686 /nfs/dbraw/zinc/17/76/86/1045177686.db2.gz GZLWZKAZGGYTOF-UHFFFAOYSA-N -1 1 342.424 4.015 20 0 EIADMM Cc1nc2cc(Nc3c(Cl)c(F)[n-]c(=O)c3Cl)ccc2[nH]1 ZINC001213071201 1045204730 /nfs/dbraw/zinc/20/47/30/1045204730.db2.gz FBYPTKJGHBMSAT-UHFFFAOYSA-N -1 1 327.146 4.161 20 0 EIADMM CCOc1ccc([N-]S(=O)(=O)c2cccc3ccccc32)c(C)c1 ZINC000325891232 1045507209 /nfs/dbraw/zinc/50/72/09/1045507209.db2.gz LPEYSYBZZJOWDK-UHFFFAOYSA-N -1 1 341.432 4.348 20 0 EIADMM CC1(C)[C@H](C(F)(F)F)CCN1C(=O)c1cc2ccccc2cc1[O-] ZINC000326391112 1045803432 /nfs/dbraw/zinc/80/34/32/1045803432.db2.gz KLFJRXIAJWCBHL-OAHLLOKOSA-N -1 1 337.341 4.348 20 0 EIADMM O=c1nc(CNC(c2ccccc2)c2ccccc2)[n-]c2ccsc21 ZINC000326670808 1045832306 /nfs/dbraw/zinc/83/23/06/1045832306.db2.gz JFKMUWBHXGAMIR-UHFFFAOYSA-N -1 1 347.443 4.276 20 0 EIADMM C[C@@H](c1ccc(F)c(F)c1)N(C)C(=O)c1c([O-])cccc1Cl ZINC000769636764 1046029708 /nfs/dbraw/zinc/02/97/08/1046029708.db2.gz IPIRHUBAYLZGDJ-VIFPVBQESA-N -1 1 325.742 4.157 20 0 EIADMM O=C(c1c([O-])cccc1Cl)N1CCC[C@H]1CCc1ccccc1 ZINC000769711771 1046050564 /nfs/dbraw/zinc/05/05/64/1046050564.db2.gz IHXGFGJAQDIMQP-HNNXBMFYSA-N -1 1 329.827 4.283 20 0 EIADMM O=C(N[C@H](c1ccco1)c1ccccc1)c1c([O-])cccc1Cl ZINC000792804649 1046070004 /nfs/dbraw/zinc/07/00/04/1046070004.db2.gz UWEIKSXPMOLMII-KRWDZBQOSA-N -1 1 327.767 4.158 20 0 EIADMM O=C(Nc1ccc(CC[C@H](O)c2ccccc2)cc1)c1ccccc1[O-] ZINC000769969931 1046112102 /nfs/dbraw/zinc/11/21/02/1046112102.db2.gz FDMNXCPKPMDGTK-FQEVSTJZSA-N -1 1 347.414 4.311 20 0 EIADMM CCCCCC[C@@](C)(CC)C(=O)NCc1n[n-]c(=S)n1C1CC1 ZINC000080061374 1046236035 /nfs/dbraw/zinc/23/60/35/1046236035.db2.gz ZGJZIANGZMVCQP-QGZVFWFLSA-N -1 1 338.521 4.278 20 0 EIADMM O=C([N-]C1(C(F)(F)F)CCCCC1)C(F)(F)Cc1ccccc1 ZINC000793490803 1046270838 /nfs/dbraw/zinc/27/08/38/1046270838.db2.gz GSTWGIDACQSATN-UHFFFAOYSA-N -1 1 335.316 4.246 20 0 EIADMM O=C([O-])c1ccc(CN2CCCC[C@H]2c2nc3ccccc3o2)cc1 ZINC000263485441 1046293729 /nfs/dbraw/zinc/29/37/29/1046293729.db2.gz PFYFQBDLXQLBGU-KRWDZBQOSA-N -1 1 336.391 4.253 20 0 EIADMM C[C@@H]1CN(Cc2cccc([O-])c2Cl)C[C@@H](c2ccc(F)cc2)O1 ZINC000508720153 1046393526 /nfs/dbraw/zinc/39/35/26/1046393526.db2.gz PRVHEAOBEXRREM-PXAZEXFGSA-N -1 1 335.806 4.147 20 0 EIADMM Cc1cc([C@H]2CN(Cc3cccc([O-])c3Cl)CCO2)ccc1F ZINC000508726322 1046452428 /nfs/dbraw/zinc/45/24/28/1046452428.db2.gz HNFHMKZTOBFWGI-QGZVFWFLSA-N -1 1 335.806 4.067 20 0 EIADMM CC(=C([O-])Nc1nc(-c2cccc(Cl)c2)ns1)c1ccccc1 ZINC000476017369 1046642131 /nfs/dbraw/zinc/64/21/31/1046642131.db2.gz IAZOHIAMBCLIOO-NSHDSACASA-N -1 1 343.839 4.023 20 0 EIADMM C[C@@H](CNC(=O)c1cc2ccccc2cc1[O-])c1nc2ccccc2o1 ZINC000746569284 1046790363 /nfs/dbraw/zinc/79/03/63/1046790363.db2.gz XWTALKSWYINHQW-ZDUSSCGKSA-N -1 1 346.386 4.220 20 0 EIADMM C[C@H](C(=O)Nc1cc(F)c([O-])cc1Cl)c1c(F)cccc1F ZINC001157899936 1046826706 /nfs/dbraw/zinc/82/67/06/1046826706.db2.gz OEHSIJNHLGZMQF-ZETCQYMHSA-N -1 1 329.705 4.205 20 0 EIADMM COc1cc(C(C)=O)ccc1SC[C@H](C)C(=O)c1ccc([O-])cc1 ZINC000917347246 1046849859 /nfs/dbraw/zinc/84/98/59/1046849859.db2.gz OZUBIHVFPOWICV-LBPRGKRZSA-N -1 1 344.432 4.215 20 0 EIADMM CSc1cc(F)ccc1[N-]C(=O)c1coc(-c2ccnc(C)c2)n1 ZINC001130290469 1046943423 /nfs/dbraw/zinc/94/34/23/1046943423.db2.gz NUIGJYHHUVUKFR-UHFFFAOYSA-N -1 1 343.383 4.158 20 0 EIADMM COc1cc(C(=O)N[C@@H](C)c2cc(C)cc(C)c2)cc(Cl)c1[O-] ZINC000460202402 1047158699 /nfs/dbraw/zinc/15/86/99/1047158699.db2.gz ONRNTLSNULTEEP-LBPRGKRZSA-N -1 1 333.815 4.162 20 0 EIADMM Cc1ccc(Cl)c(S(=O)(=O)[N-]c2cccc(Cl)c2F)c1 ZINC000498030601 1047298147 /nfs/dbraw/zinc/29/81/47/1047298147.db2.gz JBZIZHQDESGVJS-UHFFFAOYSA-N -1 1 334.199 4.242 20 0 EIADMM O=S(=O)([N-]c1ccc2oc(C3CC3)nc2c1)c1cccc(Cl)c1 ZINC000032097219 1047304965 /nfs/dbraw/zinc/30/49/65/1047304965.db2.gz NFCOIBRHFLWOIB-UHFFFAOYSA-N -1 1 348.811 4.159 20 0 EIADMM Cc1nc(C(C)C)[n-]c(=O)c1C(=O)NC[C@@H]1CCCC[C@H]1C(C)(C)C ZINC000747366121 1047392127 /nfs/dbraw/zinc/39/21/27/1047392127.db2.gz UKNYZUCHFCLKNR-LSDHHAIUSA-N -1 1 347.503 4.196 20 0 EIADMM Cc1ccc(CN(C(=O)c2ccc(C(F)(F)F)c([O-])c2)C2CC2)o1 ZINC001625991543 1047409288 /nfs/dbraw/zinc/40/92/88/1047409288.db2.gz SWPBSMSSJYAOKE-UHFFFAOYSA-N -1 1 339.313 4.117 20 0 EIADMM CCCc1ccc(Cl)c(S(=O)(=O)[N-]c2cccnc2Cl)c1 ZINC000789725769 1047468409 /nfs/dbraw/zinc/46/84/09/1047468409.db2.gz CEBVAHXKNOMKMB-UHFFFAOYSA-N -1 1 345.251 4.142 20 0 EIADMM Cc1c(S(=O)(=O)[N-]c2c(C)cc(C)cc2C)c2ccccc2n1C ZINC000556302692 1047661095 /nfs/dbraw/zinc/66/10/95/1047661095.db2.gz FDFYWYMHKLMCOW-UHFFFAOYSA-N -1 1 342.464 4.213 20 0 EIADMM CC[C@@H](Cc1ccc(C)cc1)N(C)C(=O)c1ccc(Cl)cc1[O-] ZINC001137037110 1048091791 /nfs/dbraw/zinc/09/17/91/1048091791.db2.gz PQALXVDEHPZHTD-INIZCTEOSA-N -1 1 331.843 4.447 20 0 EIADMM CC/C(C)=C(\C)C(=O)Nc1c([O-])cc(Br)cc1Cl ZINC000843887459 1048137581 /nfs/dbraw/zinc/13/75/81/1048137581.db2.gz WTGWZFDBJOKRQG-BQYQJAHWSA-N -1 1 332.625 4.493 20 0 EIADMM CCc1noc(C)c1[N-]C(=O)c1cc(-c2ccc(Cl)cc2)on1 ZINC000132606456 1048369276 /nfs/dbraw/zinc/36/92/76/1048369276.db2.gz YMPFAJYSTIXSLH-UHFFFAOYSA-N -1 1 331.759 4.106 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2cccc(-c3ncco3)c2)cc1Cl ZINC000132773275 1048490568 /nfs/dbraw/zinc/49/05/68/1048490568.db2.gz IWJVNNKWZMODGP-UHFFFAOYSA-N -1 1 348.811 4.104 20 0 EIADMM O=C(NCCSc1ccc(Cl)cc1)c1c([O-])cccc1Cl ZINC000920431057 1048679534 /nfs/dbraw/zinc/67/95/34/1048679534.db2.gz NXXBOFGAMPIRNU-UHFFFAOYSA-N -1 1 342.247 4.221 20 0 EIADMM Cc1ccc(CSCCNC(=O)c2c([O-])cccc2Cl)cc1 ZINC000920430787 1048679706 /nfs/dbraw/zinc/67/97/06/1048679706.db2.gz BDJOVZAFIWMLJA-UHFFFAOYSA-N -1 1 335.856 4.017 20 0 EIADMM [O-]c1cc(F)c(CN2CCSC[C@@H]2c2ccc(F)cc2)c(F)c1 ZINC001144554617 1048723273 /nfs/dbraw/zinc/72/32/73/1048723273.db2.gz CHYHRVUIKOOKAT-QGZVFWFLSA-N -1 1 339.382 4.100 20 0 EIADMM COc1ccc([C@H]2CCCN2Cc2c(F)cc([O-])cc2F)cc1OC ZINC001144554592 1048723758 /nfs/dbraw/zinc/72/37/58/1048723758.db2.gz BHNYXPNYVYUOIZ-QGZVFWFLSA-N -1 1 349.377 4.025 20 0 EIADMM [O-]c1cc(F)c(CN2CCc3ccc(C(F)(F)F)cc3C2)c(F)c1 ZINC001144555023 1048726388 /nfs/dbraw/zinc/72/63/88/1048726388.db2.gz RGUVMLOPTDSJFA-UHFFFAOYSA-N -1 1 343.295 4.248 20 0 EIADMM C[C@@H]([N-]C(=O)C(F)(F)c1cc(Cl)ccc1Cl)c1ccccn1 ZINC001135517255 1048761548 /nfs/dbraw/zinc/76/15/48/1048761548.db2.gz ICLLFPVVFKFJOL-SECBINFHSA-N -1 1 345.176 4.358 20 0 EIADMM O=C([N-]Cc1c(F)cccc1Cl)C(F)(F)c1ccc(F)cc1 ZINC000920845942 1048803475 /nfs/dbraw/zinc/80/34/75/1048803475.db2.gz YXPAWUHCYPEGMW-UHFFFAOYSA-N -1 1 331.696 4.026 20 0 EIADMM COc1ccc(C(C)=O)c(OC(=O)c2cc3cc(Cl)sc3[n-]2)c1 ZINC000810569839 1048815583 /nfs/dbraw/zinc/81/55/83/1048815583.db2.gz PJYHVWYHWLTWIJ-UHFFFAOYSA-N -1 1 349.795 4.313 20 0 EIADMM CN(Cc1ccc(Cl)cc1)C(=O)c1c([O-])cnc2c(F)cccc21 ZINC001135591156 1048818543 /nfs/dbraw/zinc/81/85/43/1048818543.db2.gz GZTALBSKMHNODQ-UHFFFAOYSA-N -1 1 344.773 4.005 20 0 EIADMM O=C([N-]Cc1ccc(F)cc1F)C(F)(F)c1cccc(Cl)c1 ZINC000921003882 1048824996 /nfs/dbraw/zinc/82/49/96/1048824996.db2.gz KGDYTIDLMLKJDB-UHFFFAOYSA-N -1 1 331.696 4.026 20 0 EIADMM O=C(NCc1cccc2ccccc21)c1ccc(C(F)(F)F)cc1[O-] ZINC001144752665 1048845397 /nfs/dbraw/zinc/84/53/97/1048845397.db2.gz MXDBONRMEBWUBU-UHFFFAOYSA-N -1 1 345.320 4.494 20 0 EIADMM C/C(=C/CN1Cc2cc(Cl)ccc2C[C@@H]1c1ccccc1)C(=O)[O-] ZINC000846254027 1048850065 /nfs/dbraw/zinc/85/00/65/1048850065.db2.gz BEQCFVCGGJYJQC-BZPDREMPSA-N -1 1 341.838 4.470 20 0 EIADMM CCOc1cccc2cc([C@H](C)NC(=O)c3c([O-])cccc3F)oc21 ZINC001135846685 1048928300 /nfs/dbraw/zinc/92/83/00/1048928300.db2.gz SZNSBUINGXCBRH-NSHDSACASA-N -1 1 343.354 4.167 20 0 EIADMM COc1ccc(C(C)=O)cc1OC(=O)c1cc2cc(Cl)sc2[n-]1 ZINC000811191447 1048978757 /nfs/dbraw/zinc/97/87/57/1048978757.db2.gz VZPUOWISAUQPED-UHFFFAOYSA-N -1 1 349.795 4.313 20 0 EIADMM O=C(Nc1ccc(OC(F)F)c(Cl)c1)c1ccc(F)c([O-])c1 ZINC001136048832 1049052938 /nfs/dbraw/zinc/05/29/38/1049052938.db2.gz SAEKUHFZYXLQAN-UHFFFAOYSA-N -1 1 331.677 4.038 20 0 EIADMM CC(C)(C)[C@@H]1OCCC[C@@H]1CNC(=O)c1ccc2ccccc2c1[O-] ZINC001146821400 1049058537 /nfs/dbraw/zinc/05/85/37/1049058537.db2.gz CTIUQCIRQRPKRH-DNVCBOLYSA-N -1 1 341.451 4.117 20 0 EIADMM CSc1c(F)cccc1NC(=O)c1ccc2ccc(O)cc2c1[O-] ZINC001147039026 1049080432 /nfs/dbraw/zinc/08/04/32/1049080432.db2.gz ASVGVKUGGJULJD-UHFFFAOYSA-N -1 1 343.379 4.364 20 0 EIADMM CN(Cc1ccc(Cl)cc1Cl)C(=O)c1ccc(F)c([O-])c1 ZINC001136155353 1049189235 /nfs/dbraw/zinc/18/92/35/1049189235.db2.gz MECDMRFGJDHWIY-UHFFFAOYSA-N -1 1 328.170 4.110 20 0 EIADMM O=C(c1ccc(C(F)(F)F)cc1[O-])N1CCCC2(CC(F)C2)CC1 ZINC001148798333 1049382814 /nfs/dbraw/zinc/38/28/14/1049382814.db2.gz VTTUJELJPFUIOO-UHFFFAOYSA-N -1 1 345.336 4.155 20 0 EIADMM O=C(Nc1cc(C(F)(F)F)no1)c1cccc(-c2ccccc2)c1[O-] ZINC001148861454 1049390567 /nfs/dbraw/zinc/39/05/67/1049390567.db2.gz QZCJPFHACNLILU-UHFFFAOYSA-N -1 1 348.280 4.318 20 0 EIADMM CCC[C@H]1CCC[C@H]1C(=O)Nc1cccc([O-])c1Br ZINC001158832418 1049474604 /nfs/dbraw/zinc/47/46/04/1049474604.db2.gz RVIHVIBJJRDCFP-WDEREUQCSA-N -1 1 326.234 4.310 20 0 EIADMM O=C([N-]c1nnc(C2CCCCC2)s1)c1nc(C2CC2)cs1 ZINC001136359218 1049530684 /nfs/dbraw/zinc/53/06/84/1049530684.db2.gz YQMOPMGGBWLWNS-UHFFFAOYSA-N -1 1 334.470 4.172 20 0 EIADMM COCCCCN(Cc1ccccc1)C(=O)c1cc(Cl)ccc1[O-] ZINC001136402404 1049585251 /nfs/dbraw/zinc/58/52/51/1049585251.db2.gz YUCVUBYUNWQXTG-UHFFFAOYSA-N -1 1 347.842 4.115 20 0 EIADMM COc1cnc(C=Cc2ccc(-c3ccccc3F)s2)[n-]c1=O ZINC000821009257 1049594070 /nfs/dbraw/zinc/59/40/70/1049594070.db2.gz YFNHXTPRUWOPJD-CLFYSBASSA-N -1 1 328.368 4.229 20 0 EIADMM CC(C)N(Cc1cccs1)C(=O)c1ccc2ccc(O)cc2c1[O-] ZINC001136418271 1049604288 /nfs/dbraw/zinc/60/42/88/1049604288.db2.gz CWUSAITYMLMJQZ-UHFFFAOYSA-N -1 1 341.432 4.363 20 0 EIADMM O=C(Nc1ncccc1OCC1CCCCC1)c1ccc([O-])cc1F ZINC001136563867 1049748921 /nfs/dbraw/zinc/74/89/21/1049748921.db2.gz MEPPIJPYCHTPMQ-UHFFFAOYSA-N -1 1 344.386 4.138 20 0 EIADMM O=C(NCCc1nc(C2CCCCC2)cs1)c1cccc([O-])c1F ZINC001136627829 1049799525 /nfs/dbraw/zinc/79/95/25/1049799525.db2.gz BNGNVETZHBYMKT-UHFFFAOYSA-N -1 1 348.443 4.008 20 0 EIADMM O=C(c1ccc([O-])c(F)c1)N1CCC(Cc2ccc(Cl)cc2)CC1 ZINC001171802062 1049806896 /nfs/dbraw/zinc/80/68/96/1049806896.db2.gz LQPPCJWGCWODKB-UHFFFAOYSA-N -1 1 347.817 4.280 20 0 EIADMM CC[C@H](c1ccccc1OC)N(C)C(=O)c1c([O-])cccc1Cl ZINC000813760191 1049811095 /nfs/dbraw/zinc/81/10/95/1049811095.db2.gz OONYMOSBZFQXTB-CQSZACIVSA-N -1 1 333.815 4.278 20 0 EIADMM O=C(N[C@@H](c1ccc(Cl)cc1)C1CCC1)c1c([O-])cccc1F ZINC001136712737 1049842080 /nfs/dbraw/zinc/84/20/80/1049842080.db2.gz KYROAWNUKAQZIT-QGZVFWFLSA-N -1 1 333.790 4.456 20 0 EIADMM O=C(Nc1ccc([O-])c(F)c1F)[C@H]1CCC[C@H]1Cc1ccccc1 ZINC000616100542 1049845743 /nfs/dbraw/zinc/84/57/43/1049845743.db2.gz JVPQYRMIFKNUGK-KBPBESRZSA-N -1 1 331.362 4.268 20 0 EIADMM O=C(NCC1CCC(c2ccccc2)CC1)c1cc(F)ccc1[O-] ZINC001136727462 1049851416 /nfs/dbraw/zinc/85/14/16/1049851416.db2.gz LOKOTTQANSRBQX-UHFFFAOYSA-N -1 1 327.399 4.235 20 0 EIADMM Cc1c(=O)[n-]n(-c2ccccc2)c1NC1CC(C)(C)OC(C)(C)C1 ZINC001172655060 1049957399 /nfs/dbraw/zinc/95/73/99/1049957399.db2.gz PCIQXRZELLJNOA-UHFFFAOYSA-N -1 1 329.444 4.034 20 0 EIADMM CCOc1cc(C(=O)N2CCC(c3ccco3)CC2)cc(Cl)c1[O-] ZINC000617377719 1049984232 /nfs/dbraw/zinc/98/42/32/1049984232.db2.gz DJTCKYCUBLFQIV-UHFFFAOYSA-N -1 1 349.814 4.057 20 0 EIADMM Cc1nc([C@@H](C)[N@H+]2CC[C@@](C)(C(=O)[O-])C2)oc1-c1ccc(Cl)cc1 ZINC000263571521 1049995320 /nfs/dbraw/zinc/99/53/20/1049995320.db2.gz JMOUNCCPEQSCDO-KZULUSFZSA-N -1 1 348.830 4.161 20 0 EIADMM COc1ccc(C)cc1-c1csc(NC(=O)c2ccccc2[O-])n1 ZINC000248342607 1050050268 /nfs/dbraw/zinc/05/02/68/1050050268.db2.gz YMXWHCUTTXKCFD-UHFFFAOYSA-N -1 1 340.404 4.085 20 0 EIADMM Cc1c(F)cccc1S(=O)(=O)[N-]c1cccc(OC(C)(C)C)c1 ZINC001185836140 1050169028 /nfs/dbraw/zinc/16/90/28/1050169028.db2.gz CYVFKULERJBWSX-UHFFFAOYSA-N -1 1 337.416 4.112 20 0 EIADMM Cc1cccc(-c2noc(-c3ncc(C(F)(F)F)[n-]3)n2)c1Cl ZINC001212689717 1050229422 /nfs/dbraw/zinc/22/94/22/1050229422.db2.gz NTEPRMJHXCVMKI-UHFFFAOYSA-N -1 1 328.681 4.107 20 0 EIADMM Cc1cccc(-c2noc(-c3nc(C(F)(F)F)c[n-]3)n2)c1Cl ZINC001212689717 1050229440 /nfs/dbraw/zinc/22/94/40/1050229440.db2.gz NTEPRMJHXCVMKI-UHFFFAOYSA-N -1 1 328.681 4.107 20 0 EIADMM CC(=O)OCc1cccc(Cl)c1Nc1c([O-])cc(F)cc1F ZINC001212777634 1050281432 /nfs/dbraw/zinc/28/14/32/1050281432.db2.gz VPELWCSFBCFSJB-UHFFFAOYSA-N -1 1 327.714 4.131 20 0 EIADMM O=C(Nc1c[nH]c2ccc(Br)cc12)c1ccc([O-])cc1F ZINC001186319585 1050285519 /nfs/dbraw/zinc/28/55/19/1050285519.db2.gz XXAVNPAOZOWBHP-UHFFFAOYSA-N -1 1 349.159 4.027 20 0 EIADMM O=C(NCc1c(Cl)ccc(Cl)c1Cl)c1ccc([O-])cc1F ZINC001186339696 1050302030 /nfs/dbraw/zinc/30/20/30/1050302030.db2.gz OVNVRDNRDWBRNV-UHFFFAOYSA-N -1 1 348.588 4.422 20 0 EIADMM O=S(=O)([N-]C1(C(F)(F)F)CCCC1)c1csc2ccccc21 ZINC001186523238 1050352415 /nfs/dbraw/zinc/35/24/15/1050352415.db2.gz VWOSISOYZILYPS-UHFFFAOYSA-N -1 1 349.399 4.055 20 0 EIADMM O=C(NCc1ccc(C(F)(F)F)cc1)Nc1ccc([O-])c(F)c1F ZINC001186809450 1050423265 /nfs/dbraw/zinc/42/32/65/1050423265.db2.gz BMBFPSVLJDAUEB-UHFFFAOYSA-N -1 1 346.255 4.011 20 0 EIADMM [O-]c1cnccc1-c1nc(-c2ccc(OCc3ccccc3)cc2)no1 ZINC001212721154 1050430040 /nfs/dbraw/zinc/43/00/40/1050430040.db2.gz AHUGHXRQVVGWMW-UHFFFAOYSA-N -1 1 345.358 4.083 20 0 EIADMM Cc1nc(C(C)C)[n-]c(=O)c1C(=O)N1C[C@H](C(C)C)c2ccccc21 ZINC000773774941 1050564021 /nfs/dbraw/zinc/56/40/21/1050564021.db2.gz CTRPRDCORPHUND-OAHLLOKOSA-N -1 1 339.439 4.014 20 0 EIADMM O=C(Nc1cc(=O)n(-c2ccccc2)[n-]1)Nc1ccc(F)c(Cl)c1 ZINC001187672533 1050590660 /nfs/dbraw/zinc/59/06/60/1050590660.db2.gz YXOSRTQGPBEDMJ-UHFFFAOYSA-N -1 1 346.749 4.014 20 0 EIADMM CCCCCCc1ccc(NC(=O)c2n[n-]nc2C(F)(F)F)cc1 ZINC001187763835 1050620634 /nfs/dbraw/zinc/62/06/34/1050620634.db2.gz SEBLOLJAGPWAJA-UHFFFAOYSA-N -1 1 340.349 4.199 20 0 EIADMM COc1cc(OC)c(Nc2ccc(Cl)c(Cl)c2[O-])c(OC)c1 ZINC001173910675 1050623240 /nfs/dbraw/zinc/62/32/40/1050623240.db2.gz IEVUQIFGXDCXQC-UHFFFAOYSA-N -1 1 344.194 4.468 20 0 EIADMM COc1cccc(Nc2ccc(F)c(Br)c2[O-])c1OC ZINC001174018724 1050705161 /nfs/dbraw/zinc/70/51/61/1050705161.db2.gz KIKVYCDYZVNSPM-UHFFFAOYSA-N -1 1 342.164 4.055 20 0 EIADMM CCCc1cc(=O)[n-]c(SC[C@H](OC)c2ccc(Cl)cc2)n1 ZINC001188163227 1050712154 /nfs/dbraw/zinc/71/21/54/1050712154.db2.gz QGODHPIYGQATBK-AWEZNQCLSA-N -1 1 338.860 4.268 20 0 EIADMM Cc1ccc(CC(=O)Nc2cc(F)c([O-])cc2Cl)c(Cl)c1 ZINC001179659540 1050740949 /nfs/dbraw/zinc/74/09/49/1050740949.db2.gz AYIUTMDNHNVYLS-UHFFFAOYSA-N -1 1 328.170 4.328 20 0 EIADMM O=C(c1ccc(Nc2cc([O-])c(Cl)cc2F)cc1)N1CCCC1 ZINC001174068015 1050741527 /nfs/dbraw/zinc/74/15/27/1050741527.db2.gz MAOFDAFPPMWAAR-UHFFFAOYSA-N -1 1 334.778 4.164 20 0 EIADMM CCc1c(Cl)cc(Nc2cccc(C(=O)NC)c2)c([O-])c1Cl ZINC001174143161 1050784726 /nfs/dbraw/zinc/78/47/26/1050784726.db2.gz OYBHITLPLFAYEE-UHFFFAOYSA-N -1 1 339.222 4.365 20 0 EIADMM O=S(=O)([N-]c1c(Cl)cccc1-c1ccccc1)c1ccoc1 ZINC001188614114 1050806606 /nfs/dbraw/zinc/80/66/06/1050806606.db2.gz IDAQAYZDQXWHPN-UHFFFAOYSA-N -1 1 333.796 4.401 20 0 EIADMM CC(=O)NCc1ccc(Nc2ccc(Cl)c(Cl)c2[O-])cc1 ZINC001174233445 1050859503 /nfs/dbraw/zinc/85/95/03/1050859503.db2.gz MHYJKSATQUDOAC-UHFFFAOYSA-N -1 1 325.195 4.079 20 0 EIADMM CCc1ccc(C(=O)Nc2nc3c(s2)C[C@@H](C(C)C)CC3)c([O-])c1 ZINC001180111451 1050889034 /nfs/dbraw/zinc/88/90/34/1050889034.db2.gz YFNFPEQOYRTDQQ-ZDUSSCGKSA-N -1 1 344.480 4.424 20 0 EIADMM O=C([N-]c1cc(Cl)cc2ncoc21)c1cc(-c2cccs2)on1 ZINC001189193369 1050922815 /nfs/dbraw/zinc/92/28/15/1050922815.db2.gz GHCAKWNOAXFCOU-UHFFFAOYSA-N -1 1 345.767 4.450 20 0 EIADMM Cc1c(F)cccc1[N-]S(=O)(=O)c1ccc(F)c2ccccc21 ZINC001189347482 1050958087 /nfs/dbraw/zinc/95/80/87/1050958087.db2.gz HNIDUPVNKMFMIS-UHFFFAOYSA-N -1 1 333.359 4.227 20 0 EIADMM CCCCOc1ccc(NC(=O)Nc2cc(F)c(F)cc2[O-])cc1 ZINC001189314882 1050960044 /nfs/dbraw/zinc/96/00/44/1050960044.db2.gz AYEMNMLIYDMMOC-UHFFFAOYSA-N -1 1 336.338 4.493 20 0 EIADMM COC(=O)c1ccc(Nc2cc(Cl)c([O-])cc2Cl)cc1OC ZINC001174429515 1050962543 /nfs/dbraw/zinc/96/25/43/1050962543.db2.gz DMMKBRIMFUIXON-UHFFFAOYSA-N -1 1 342.178 4.238 20 0 EIADMM COc1ccccc1/C=C/C(=O)Nc1cccc(C(F)(F)F)c1[O-] ZINC001180530696 1051018024 /nfs/dbraw/zinc/01/80/24/1051018024.db2.gz VRAXSYUWLAYWQU-MDZDMXLPSA-N -1 1 337.297 4.072 20 0 EIADMM Cc1nc(SCCOc2ccccc2Cl)[n-]c(=O)c1C1CC1 ZINC001189884078 1051073830 /nfs/dbraw/zinc/07/38/30/1051073830.db2.gz BCJJNZXOQKDYLG-UHFFFAOYSA-N -1 1 336.844 4.193 20 0 EIADMM COc1cc(Nc2cc(Br)cc(Cl)c2[O-])ccc1O ZINC001174545194 1051076914 /nfs/dbraw/zinc/07/69/14/1051076914.db2.gz GDMSVICXOZBHKM-UHFFFAOYSA-N -1 1 344.592 4.266 20 0 EIADMM Cc1nc(SCC2([C@H]3CCCCO3)CCC2)[n-]c(=O)c1C1CC1 ZINC001189891030 1051080800 /nfs/dbraw/zinc/08/08/00/1051080800.db2.gz ASEXOPOUGKEELR-CQSZACIVSA-N -1 1 334.485 4.200 20 0 EIADMM C=Cc1ccc([N-]S(=O)(=O)c2cc(F)cc(C(F)(F)F)c2)cc1 ZINC001189983106 1051096291 /nfs/dbraw/zinc/09/62/91/1051096291.db2.gz XRBFXLNUNANNFD-UHFFFAOYSA-N -1 1 345.317 4.288 20 0 EIADMM CC(C)[C@H](CNC(=O)c1ccc2ccccc2c1[O-])Nc1ccccc1 ZINC001181043724 1051135494 /nfs/dbraw/zinc/13/54/94/1051135494.db2.gz WAAIFALPZNBWNV-FQEVSTJZSA-N -1 1 348.446 4.412 20 0 EIADMM Cc1cc([N-]S(=O)(=O)c2ccc(C3CC3)cc2)cc2scnc21 ZINC001190506160 1051197720 /nfs/dbraw/zinc/19/77/20/1051197720.db2.gz IWQPEZRWEKKIMT-UHFFFAOYSA-N -1 1 344.461 4.283 20 0 EIADMM COc1cc(C(=O)NCc2oc3ccccc3c2C)cc(Cl)c1[O-] ZINC000153829166 1051233552 /nfs/dbraw/zinc/23/35/52/1051233552.db2.gz FONJXJGTQVMDIA-UHFFFAOYSA-N -1 1 345.782 4.039 20 0 EIADMM CCc1ccc2c(c1)CN(C(=O)c1ccc3ccccc3c1[O-])CC2 ZINC001181680284 1051279454 /nfs/dbraw/zinc/27/94/54/1051279454.db2.gz JHUKFGHFJOUNSE-UHFFFAOYSA-N -1 1 331.415 4.306 20 0 EIADMM CCCCOc1ccccc1Nc1cc(S(=O)(=O)CC)ccc1[O-] ZINC001174999595 1051287213 /nfs/dbraw/zinc/28/72/13/1051287213.db2.gz GDDKTNAHOXACKA-UHFFFAOYSA-N -1 1 349.452 4.108 20 0 EIADMM O=C(Cc1ccc2cc[nH]c2c1)Nc1cccc(C(F)(F)F)c1[O-] ZINC001181808451 1051312647 /nfs/dbraw/zinc/31/26/47/1051312647.db2.gz LEMVURMEQRHREQ-UHFFFAOYSA-N -1 1 334.297 4.074 20 0 EIADMM COc1cc(C(=O)Nc2cccc3nc(C)ccc32)cc(Cl)c1[O-] ZINC001191148230 1051364469 /nfs/dbraw/zinc/36/44/69/1051364469.db2.gz IDFZPPANVYIECM-UHFFFAOYSA-N -1 1 342.782 4.163 20 0 EIADMM CCCCc1ccc(S(=O)(=O)[N-]c2ccc3nc(C)oc3c2)cc1 ZINC001191248476 1051411587 /nfs/dbraw/zinc/41/15/87/1051411587.db2.gz CUYOBVPIVISLBA-UHFFFAOYSA-N -1 1 344.436 4.280 20 0 EIADMM CC1(C)CCC(C)(C[N-]S(=O)(=O)c2sccc2Cl)CC1 ZINC001191394185 1051438521 /nfs/dbraw/zinc/43/85/21/1051438521.db2.gz IIUHXYHGMDRAKE-UHFFFAOYSA-N -1 1 335.922 4.286 20 0 EIADMM CC(=O)c1ccc(F)c(Nc2cc(Br)cc(F)c2[O-])c1 ZINC001175275349 1051475760 /nfs/dbraw/zinc/47/57/60/1051475760.db2.gz GFJQQXZGOLRWHP-UHFFFAOYSA-N -1 1 342.139 4.379 20 0 EIADMM Cc1c(Cl)ccc(S(=O)(=O)[N-]c2ccccc2F)c1Cl ZINC001191723026 1051519689 /nfs/dbraw/zinc/51/96/89/1051519689.db2.gz UXRGJSKBAGAZFN-UHFFFAOYSA-N -1 1 334.199 4.242 20 0 EIADMM Cc1[nH]nc2ccc(Nc3c(Cl)c(F)[n-]c(=O)c3Cl)cc12 ZINC001175693693 1051705840 /nfs/dbraw/zinc/70/58/40/1051705840.db2.gz HTEIJSGPSUSQHO-UHFFFAOYSA-N -1 1 327.146 4.161 20 0 EIADMM Cc1n[nH]c2cc(Nc3ccc(F)c(Br)c3[O-])ccc12 ZINC001175662714 1051719965 /nfs/dbraw/zinc/71/99/65/1051719965.db2.gz BGURQSWNZHPKRM-UHFFFAOYSA-N -1 1 336.164 4.222 20 0 EIADMM CCCC[C@@H](CC)COCCCNC(=O)c1c(F)ccc([O-])c1F ZINC001192551920 1051756343 /nfs/dbraw/zinc/75/63/43/1051756343.db2.gz IPSGTZGFSCVOGQ-CYBMUJFWSA-N -1 1 343.414 4.023 20 0 EIADMM [O-]c1c(Cl)cc(Br)cc1Nc1cnn(C2CCC2)c1 ZINC001175762913 1051773002 /nfs/dbraw/zinc/77/30/02/1051773002.db2.gz PFZWAKZDRUPDSR-UHFFFAOYSA-N -1 1 342.624 4.473 20 0 EIADMM C[C@H](NC(=O)c1cc([O-])cc(F)c1F)c1ccccc1C(F)(F)F ZINC001192679490 1051790527 /nfs/dbraw/zinc/79/05/27/1051790527.db2.gz VNSHHLAXRHWCCG-QMMMGPOBSA-N -1 1 345.267 4.180 20 0 EIADMM O=C(Cc1ccc([S-])cc1)Nc1c(Cl)ccc(O)c1Cl ZINC001183188988 1051801914 /nfs/dbraw/zinc/80/19/14/1051801914.db2.gz ONYRYJCNAJOCQH-UHFFFAOYSA-N -1 1 328.220 4.169 20 0 EIADMM CCC(CC)Oc1ccc(C(=O)Nc2nc(Cl)ccc2[O-])cc1 ZINC001183218491 1051807942 /nfs/dbraw/zinc/80/79/42/1051807942.db2.gz MRHRMGGGVMWVFF-UHFFFAOYSA-N -1 1 334.803 4.260 20 0 EIADMM Fc1cc(-c2cc([N-]c3cscn3)on2)ccc1Br ZINC001175937314 1051833294 /nfs/dbraw/zinc/83/32/94/1051833294.db2.gz GHOFTOSDUUVUNW-UHFFFAOYSA-N -1 1 340.177 4.443 20 0 EIADMM O=C([N-]CCCS[C@@H]1CCc2c1cccc2Cl)C(F)(F)F ZINC000774679147 1051894408 /nfs/dbraw/zinc/89/44/08/1051894408.db2.gz DBDOCNKVTLICFM-GFCCVEGCSA-N -1 1 337.794 4.129 20 0 EIADMM O=C([N-]CCCSCc1cccc(C(F)(F)F)c1)C(F)(F)F ZINC000774680310 1051894476 /nfs/dbraw/zinc/89/44/76/1051894476.db2.gz RBRXLUMCERQUQP-UHFFFAOYSA-N -1 1 345.308 4.007 20 0 EIADMM CC(C)Oc1c(F)c(F)c(Nc2ncc(F)cc2[O-])c(F)c1F ZINC001193363366 1051910258 /nfs/dbraw/zinc/91/02/58/1051910258.db2.gz CDSBSJMZBYHCHY-UHFFFAOYSA-N -1 1 334.244 4.014 20 0 EIADMM O=C(OCc1coc(-c2cccc(Cl)c2)n1)c1ccc([O-])cc1F ZINC000773567388 1052037568 /nfs/dbraw/zinc/03/75/68/1052037568.db2.gz LGDOHZGZPGHJFW-UHFFFAOYSA-N -1 1 347.729 4.197 20 0 EIADMM CCCC[C@H](CC)COC(=O)Nc1cc2ccc([O-])cc2oc1=O ZINC001193950819 1052046805 /nfs/dbraw/zinc/04/68/05/1052046805.db2.gz HBYHFLNTIJCAKF-LBPRGKRZSA-N -1 1 333.384 4.264 20 0 EIADMM O=S(=O)([N-]c1cccc(F)c1)c1ccc(-c2cccs2)cc1 ZINC001194130876 1052080299 /nfs/dbraw/zinc/08/02/99/1052080299.db2.gz IHWNHZLEUZGIOD-UHFFFAOYSA-N -1 1 333.409 4.355 20 0 EIADMM O=c1oc2cc([O-])ccc2cc1Nc1cccc(OC(F)(F)F)c1 ZINC001176538098 1052117292 /nfs/dbraw/zinc/11/72/92/1052117292.db2.gz SZDSHNWVRZQUIF-UHFFFAOYSA-N -1 1 337.253 4.141 20 0 EIADMM C[C@@H]1CC(C)(C)C[C@](C)([N-]S(=O)(=O)c2sccc2Cl)C1 ZINC001194409577 1052143859 /nfs/dbraw/zinc/14/38/59/1052143859.db2.gz PNEJWJCZMDCIJE-QMTHXVAHSA-N -1 1 335.922 4.285 20 0 EIADMM Cc1ccc(C)c([N-]S(=O)(=O)c2cccc3c(Cl)nccc32)c1 ZINC001194454882 1052149262 /nfs/dbraw/zinc/14/92/62/1052149262.db2.gz IHUPZHMDCWENSK-UHFFFAOYSA-N -1 1 346.839 4.306 20 0 EIADMM COc1cccc(-n2nc(C)cc2Nc2c(F)cc(F)c([O-])c2F)c1 ZINC001176663831 1052157580 /nfs/dbraw/zinc/15/75/80/1052157580.db2.gz NFWCIIGGRBMNFW-UHFFFAOYSA-N -1 1 349.312 4.056 20 0 EIADMM Cc1cnn(-c2cccc(C)c2)c1Nc1c(F)cc(F)c([O-])c1F ZINC001176669091 1052157611 /nfs/dbraw/zinc/15/76/11/1052157611.db2.gz DFDMRKBNSKOZCB-UHFFFAOYSA-N -1 1 333.313 4.356 20 0 EIADMM COC(=O)CCCc1ccc(Nc2c(F)cc(F)c([O-])c2F)cc1 ZINC001176671238 1052159313 /nfs/dbraw/zinc/15/93/13/1052159313.db2.gz VIUXDEKZECPZMK-UHFFFAOYSA-N -1 1 339.313 4.049 20 0 EIADMM [O-]c1c(F)cc(F)c(Nc2cc(Br)ccc2F)c1F ZINC001176671437 1052159513 /nfs/dbraw/zinc/15/95/13/1052159513.db2.gz DBVOWUAWPSCFGN-UHFFFAOYSA-N -1 1 336.082 4.455 20 0 EIADMM COC(=O)c1cccc2c(Nc3c(F)cc(F)c([O-])c3F)cccc12 ZINC001176674130 1052161135 /nfs/dbraw/zinc/16/11/35/1052161135.db2.gz QXWGWZZRHIQNJQ-UHFFFAOYSA-N -1 1 347.292 4.493 20 0 EIADMM Cc1cc(Nc2c(F)cc(F)c([O-])c2F)nc(C)c1Br ZINC001176662056 1052170797 /nfs/dbraw/zinc/17/07/97/1052170797.db2.gz GPZULRSUFVRCKT-UHFFFAOYSA-N -1 1 347.134 4.327 20 0 EIADMM C[C@H](CCc1ccc(F)cc1)C(=O)NCc1ccc([O-])c(Cl)c1 ZINC001176993624 1052214715 /nfs/dbraw/zinc/21/47/15/1052214715.db2.gz HASPQWQSKJEGLS-GFCCVEGCSA-N -1 1 335.806 4.070 20 0 EIADMM CC(C)[C@H]1CCCN(C(=O)c2ccc(C(F)(F)F)cc2[O-])CC1 ZINC000622374598 1052228616 /nfs/dbraw/zinc/22/86/16/1052228616.db2.gz UXZPEWHQVYDUPM-LBPRGKRZSA-N -1 1 329.362 4.309 20 0 EIADMM CC(C)(C)C1CCN(C(=O)c2ccc(C(F)(F)F)cc2[O-])CC1 ZINC000622376880 1052243684 /nfs/dbraw/zinc/24/36/84/1052243684.db2.gz WNHXCYDNFHKRPM-UHFFFAOYSA-N -1 1 329.362 4.309 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2ccc3sncc3c2)ccc1Cl ZINC001185530129 1052256849 /nfs/dbraw/zinc/25/68/49/1052256849.db2.gz UKOBTLUQIHBQEE-UHFFFAOYSA-N -1 1 338.841 4.059 20 0 EIADMM CC(C)C[C@H]1CCCCN1C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000622431846 1052267052 /nfs/dbraw/zinc/26/70/52/1052267052.db2.gz NCWQHDQFHKPWLK-CYBMUJFWSA-N -1 1 329.362 4.452 20 0 EIADMM O=C(c1csc(=NC2CC2)[n-]1)N1CCC[C@@H]1CCC1CCCCC1 ZINC000622447452 1052280439 /nfs/dbraw/zinc/28/04/39/1052280439.db2.gz INQZWNGTYPWSQU-MRXNPFEDSA-N -1 1 347.528 4.104 20 0 EIADMM CCSc1cccc(F)c1[N-]C(=O)c1cc(COC)cs1 ZINC000622874959 1052514768 /nfs/dbraw/zinc/51/47/68/1052514768.db2.gz LXUZJXBIIMILBU-UHFFFAOYSA-N -1 1 325.430 4.398 20 0 EIADMM Cc1cc(NC(=O)c2c[n-]c(C(F)(F)F)n2)cc(C(F)(F)F)c1 ZINC001194782576 1053089641 /nfs/dbraw/zinc/08/96/41/1053089641.db2.gz USXJXSLRUXCISV-UHFFFAOYSA-N -1 1 337.223 4.008 20 0 EIADMM CC(C)c1cccc(S(=O)(=O)[N-]c2ccc3c(ccn3C)c2)c1 ZINC001195156958 1053307590 /nfs/dbraw/zinc/30/75/90/1053307590.db2.gz XZPFQXJDAFCCJV-UHFFFAOYSA-N -1 1 328.437 4.103 20 0 EIADMM O=C([N-]c1c(Cl)cnnc1Cl)c1cc(Cl)c(Cl)s1 ZINC001195169581 1053313690 /nfs/dbraw/zinc/31/36/90/1053313690.db2.gz OIOANOWJZFQGKF-UHFFFAOYSA-N -1 1 343.022 4.404 20 0 EIADMM O=C(Nc1ccc(-c2cccc(O)c2)cc1)c1cc([O-])cnc1Cl ZINC001195306644 1053370267 /nfs/dbraw/zinc/37/02/67/1053370267.db2.gz VXLJCNKLSGMOHY-UHFFFAOYSA-N -1 1 340.766 4.066 20 0 EIADMM CCOC(=O)NC(=S)[N-]c1cccc(C)c1Oc1ccccc1 ZINC001195482728 1053419214 /nfs/dbraw/zinc/41/92/14/1053419214.db2.gz NIZAAZWHDOUFQY-UHFFFAOYSA-N -1 1 330.409 4.230 20 0 EIADMM CCOC(=O)NC(=S)[N-]c1ccccc1-c1ccc(F)c(F)c1 ZINC001195485081 1053419378 /nfs/dbraw/zinc/41/93/78/1053419378.db2.gz WXMOBACTFUTVDQ-UHFFFAOYSA-N -1 1 336.363 4.075 20 0 EIADMM CN(CCCOCc1ccccc1)C(=O)c1cc2ccccc2cc1[O-] ZINC000384312522 1053442300 /nfs/dbraw/zinc/44/23/00/1053442300.db2.gz OEIDFNFCDJVIOQ-UHFFFAOYSA-N -1 1 349.430 4.224 20 0 EIADMM C[C@H](NC(=O)c1c([O-])cccc1Cl)c1ccccc1OC(F)F ZINC000765426177 1053544208 /nfs/dbraw/zinc/54/42/08/1053544208.db2.gz NEELZKFMHSIWPR-VIFPVBQESA-N -1 1 341.741 4.138 20 0 EIADMM O=C(NCc1nccc2ccccc21)c1ccc2ccccc2c1[O-] ZINC000014388858 1053636995 /nfs/dbraw/zinc/63/69/95/1053636995.db2.gz FEWGREFZSAVYKK-UHFFFAOYSA-N -1 1 328.371 4.024 20 0 EIADMM Cc1cccc(NC(=S)Nc2ccc(-n3ccc(=O)[n-]3)cc2)c1C ZINC001196426201 1053672799 /nfs/dbraw/zinc/67/27/99/1053672799.db2.gz WIPYWHLKHCTAIU-UHFFFAOYSA-N -1 1 338.436 4.004 20 0 EIADMM Cc1nc(C(C)(C)C)sc1C(=O)Nc1cc(F)c([O-])cc1Cl ZINC000885674135 1053781402 /nfs/dbraw/zinc/78/14/02/1053781402.db2.gz IFDRMXWKKWKKME-UHFFFAOYSA-N -1 1 342.823 4.499 20 0 EIADMM Cc1ccc(NC(=O)CCn2c(=S)[n-]nc2-c2cccs2)cc1 ZINC000016597912 1053828628 /nfs/dbraw/zinc/82/86/28/1053828628.db2.gz QSXQHHMWWUPDJV-UHFFFAOYSA-N -1 1 344.465 4.006 20 0 EIADMM [O-]c1cc(F)ccc1NC(=S)Nc1ccccc1C(F)(F)F ZINC001197257764 1053862309 /nfs/dbraw/zinc/86/23/09/1053862309.db2.gz FBHUTFVIFUUXAN-UHFFFAOYSA-N -1 1 330.306 4.359 20 0 EIADMM CCN(C(=O)c1cc(NC(C)=O)ccc1[O-])c1ccc2ccccc2c1 ZINC000122058239 1053886971 /nfs/dbraw/zinc/88/69/71/1053886971.db2.gz ZFTKJNTYSUJNQE-UHFFFAOYSA-N -1 1 348.402 4.171 20 0 EIADMM O=S(=O)(Cc1c(F)cccc1F)[N-]c1csc2ccccc12 ZINC001197566966 1053940131 /nfs/dbraw/zinc/94/01/31/1053940131.db2.gz QGGZHCWMHVGBLG-UHFFFAOYSA-N -1 1 339.388 4.121 20 0 EIADMM [O-]c1cc(F)ccc1NC(=S)Nc1ccccc1Br ZINC001197782307 1053995454 /nfs/dbraw/zinc/99/54/54/1053995454.db2.gz FTJRPMKZCKQTBO-UHFFFAOYSA-N -1 1 341.205 4.103 20 0 EIADMM O=C(Nc1ccc(SCc2cccnc2)cc1)c1ccccc1[O-] ZINC000029357603 1054002414 /nfs/dbraw/zinc/00/24/14/1054002414.db2.gz DJPLPYRMGABBQC-UHFFFAOYSA-N -1 1 336.416 4.332 20 0 EIADMM [O-]c1c(F)cc(F)cc1NC(=S)Nc1cccc(C(F)(F)F)c1 ZINC001198064928 1054072887 /nfs/dbraw/zinc/07/28/87/1054072887.db2.gz WMJSGJVYUBWFIX-UHFFFAOYSA-N -1 1 348.296 4.498 20 0 EIADMM CCS[C@H]1CCC[C@H](NC(=O)c2ccc3ccccc3c2[O-])C1 ZINC001149045317 1054169089 /nfs/dbraw/zinc/16/90/89/1054169089.db2.gz SYRQOAAZQVAGEP-GJZGRUSLSA-N -1 1 329.465 4.340 20 0 EIADMM COC(=O)c1ccc([O-])c(NC(=S)Nc2ccc(C(C)C)cc2)c1 ZINC001198618646 1054223752 /nfs/dbraw/zinc/22/37/52/1054223752.db2.gz ROSGKCDSYRRBBW-UHFFFAOYSA-N -1 1 344.436 4.111 20 0 EIADMM O=C([N-]Cc1ccccc1Cl)C(F)(F)c1c(F)cccc1F ZINC000857430748 1054234470 /nfs/dbraw/zinc/23/44/70/1054234470.db2.gz WOKSQWQNRTYUGU-UHFFFAOYSA-N -1 1 331.696 4.026 20 0 EIADMM Cc1c(=O)[n-]c(SC[C@@H]2C[C@H]3CCC[C@@H]3O2)nc1-c1ccccc1 ZINC000871666990 1054242455 /nfs/dbraw/zinc/24/24/55/1054242455.db2.gz BCTIQCGGCCPBNI-PMPSAXMXSA-N -1 1 342.464 4.207 20 0 EIADMM O=S(=O)([N-]c1ccc2c3c(cccc31)CC2)c1ccc2occc2c1 ZINC001198868707 1054293459 /nfs/dbraw/zinc/29/34/59/1054293459.db2.gz LWZDERBIBRRFQB-UHFFFAOYSA-N -1 1 349.411 4.485 20 0 EIADMM COc1ccc([C@@H](C)NC(=O)c2cc3ccccc3cc2[O-])cc1F ZINC000045580837 1054336836 /nfs/dbraw/zinc/33/68/36/1054336836.db2.gz UYLISSXOMSFDJE-GFCCVEGCSA-N -1 1 339.366 4.184 20 0 EIADMM O=C(c1cc([O-])c2ccccc2c1)N1C[C@@H]2CCC(=O)c3cccc1c32 ZINC000472520860 1054348004 /nfs/dbraw/zinc/34/80/04/1054348004.db2.gz WHEDAOVFJRQHPU-AWEZNQCLSA-N -1 1 343.382 4.266 20 0 EIADMM O=C(c1ccc([O-])cc1F)N1CCC(c2cc3ccccc3[nH]2)CC1 ZINC000776129469 1054588931 /nfs/dbraw/zinc/58/89/31/1054588931.db2.gz YZCBPVIJNWRAEE-UHFFFAOYSA-N -1 1 338.382 4.032 20 0 EIADMM C[C@@H](CNC(=O)c1ccc(C(F)(F)F)c([O-])c1)Cc1cccs1 ZINC001137082148 1054720331 /nfs/dbraw/zinc/72/03/31/1054720331.db2.gz QDSDIRWAPHDONS-SNVBAGLBSA-N -1 1 343.370 4.081 20 0 EIADMM O=C1[N-]C(=O)C(=Cc2ccc(Oc3cc(F)cc(F)c3)cc2)S1 ZINC000874928821 1054743258 /nfs/dbraw/zinc/74/32/58/1054743258.db2.gz WLMOIRIEJAKFKW-RZNTYIFUSA-N -1 1 333.315 4.081 20 0 EIADMM Cc1occ(C(F)(F)F)c1C(=O)[N-]c1nc(C(C)(C)C)ns1 ZINC000875294085 1054777218 /nfs/dbraw/zinc/77/72/18/1054777218.db2.gz AKRCOFNDUPBJLD-UHFFFAOYSA-N -1 1 333.335 4.008 20 0 EIADMM CC(C)Oc1cncc(Nc2ccc(F)c(Br)c2[O-])c1 ZINC001201553366 1054841043 /nfs/dbraw/zinc/84/10/43/1054841043.db2.gz OXISQYIRSYEQOQ-UHFFFAOYSA-N -1 1 341.180 4.220 20 0 EIADMM O=C(NCc1ccc([O-])c(Cl)c1)N(Cc1ccccc1F)C1CC1 ZINC000876392904 1054894478 /nfs/dbraw/zinc/89/44/78/1054894478.db2.gz DLDVXWZOEGPBRX-UHFFFAOYSA-N -1 1 348.805 4.059 20 0 EIADMM O=C(Nc1cc(Cl)c(Cl)cc1[O-])N[C@@H]1C[C@H]1c1ccccc1 ZINC001201938152 1054946939 /nfs/dbraw/zinc/94/69/39/1054946939.db2.gz WQLWDBJZNDVWQZ-GXFFZTMASA-N -1 1 337.206 4.377 20 0 EIADMM O=C(Nc1cc(Cl)ncc1[O-])Nc1c(Cl)cccc1Cl ZINC001202092632 1055028026 /nfs/dbraw/zinc/02/80/26/1055028026.db2.gz BIZFZOLVAXXVCH-UHFFFAOYSA-N -1 1 332.574 4.391 20 0 EIADMM CC(=O)c1cc(-c2nc(-c3ccc(-c4ccc(F)cc4)cc3)no2)n[n-]1 ZINC001212430040 1055936167 /nfs/dbraw/zinc/93/61/67/1055936167.db2.gz XAOLKENQYPWIOM-UHFFFAOYSA-N -1 1 348.337 4.135 20 0 EIADMM CC(=O)c1cc(-c2nc(-c3ccc(-c4ccc(F)cc4)cc3)no2)[n-]n1 ZINC001212430040 1055936175 /nfs/dbraw/zinc/93/61/75/1055936175.db2.gz XAOLKENQYPWIOM-UHFFFAOYSA-N -1 1 348.337 4.135 20 0 EIADMM COc1ccccc1[C@@H]1CC[C@@H](C)CN1C(=O)c1ccc([O-])c(F)c1 ZINC000672141438 1056667860 /nfs/dbraw/zinc/66/78/60/1056667860.db2.gz JRARLLGITWHVEC-DYVFJYSZSA-N -1 1 343.398 4.153 20 0 EIADMM Cc1ccc(F)c([N-]S(=O)(=O)c2cccc(Cl)c2Cl)c1 ZINC000007428498 1056795399 /nfs/dbraw/zinc/79/53/99/1056795399.db2.gz HGAAKUZGOJGGEL-UHFFFAOYSA-N -1 1 334.199 4.242 20 0 EIADMM C[C@H]1CN(C(=O)c2c([O-])cccc2Cl)CC[C@H]1c1ccccc1 ZINC000743703800 1059079105 /nfs/dbraw/zinc/07/91/05/1059079105.db2.gz YPTIHBFEYRRCET-DZGCQCFKSA-N -1 1 329.827 4.311 20 0 EIADMM CC(=O)c1ccc([O-])c(CCOC(=O)C=Cc2ccc(Cl)cc2)c1 ZINC000744491762 1059534076 /nfs/dbraw/zinc/53/40/76/1059534076.db2.gz WZBROWUYFMEVJJ-RUDMXATFSA-N -1 1 344.794 4.047 20 0 EIADMM CC[C@H](C)c1ccc(S(=O)(=O)[N-]c2ccc(COC)cc2)cc1 ZINC000766585614 1060645089 /nfs/dbraw/zinc/64/50/89/1060645089.db2.gz QAZYKAQVKSDWJR-AWEZNQCLSA-N -1 1 333.453 4.147 20 0 EIADMM O=C(Nc1ccc(F)cc1[O-])c1ccc(COc2ccccc2)cc1 ZINC000532267518 1032125966 /nfs/dbraw/zinc/12/59/66/1032125966.db2.gz UFOXQODKPPHWST-UHFFFAOYSA-N -1 1 337.350 4.363 20 0 EIADMM O=C(Nc1ccc(F)cc1[O-])c1csc(-c2ccccc2F)n1 ZINC000532267144 1032126214 /nfs/dbraw/zinc/12/62/14/1032126214.db2.gz JMBNJUDEXNAYHP-UHFFFAOYSA-N -1 1 332.331 4.046 20 0 EIADMM O=C(Nc1ccc(F)cc1[O-])c1cc(-c2ccccc2Cl)on1 ZINC000532266343 1032126727 /nfs/dbraw/zinc/12/67/27/1032126727.db2.gz PVLCTMLAMMRSEK-UHFFFAOYSA-N -1 1 332.718 4.092 20 0 EIADMM C[C@H]1O[C@@H](C)[C@@H](C)[C@H]1C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000529539120 1032429437 /nfs/dbraw/zinc/42/94/37/1032429437.db2.gz PRIQFSXOOQLXKE-ZAQLIGFBSA-N -1 1 333.815 4.197 20 0 EIADMM CO[C@H]1CCCC[C@@H]1C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000529539292 1032444814 /nfs/dbraw/zinc/44/48/14/1032444814.db2.gz QEIUWIYTDSBOQQ-BBRMVZONSA-N -1 1 333.815 4.343 20 0 EIADMM O=C(Nc1ccc(Cl)cc1[O-])c1cc(-c2ccc(F)cc2)on1 ZINC000533158644 1032513759 /nfs/dbraw/zinc/51/37/59/1032513759.db2.gz KJFWHGFIDJSQAD-UHFFFAOYSA-N -1 1 332.718 4.092 20 0 EIADMM CCSCc1cccc([N-]S(=O)(=O)c2cc(C)sc2C)c1 ZINC000610193603 1019206655 /nfs/dbraw/zinc/20/66/55/1019206655.db2.gz CLGQLOIXSIQLJK-UHFFFAOYSA-N -1 1 341.523 4.419 20 0 EIADMM CCSCc1cccc([N-]S(=O)(=O)c2ccc(Cl)cc2)c1 ZINC000610193668 1019207930 /nfs/dbraw/zinc/20/79/30/1019207930.db2.gz DAQKGUFXUFAALH-UHFFFAOYSA-N -1 1 341.885 4.394 20 0 EIADMM Cc1nc(-c2ccc([N-]S(=O)(=O)c3cccc(Cl)c3)cc2)co1 ZINC000029433345 1019216524 /nfs/dbraw/zinc/21/65/24/1019216524.db2.gz UWZBNQZUCPSKAD-UHFFFAOYSA-N -1 1 348.811 4.104 20 0 EIADMM Cc1cc(F)ccc1[N-]S(=O)(=O)c1ccc(Cl)c(Cl)c1 ZINC000007381944 1019896425 /nfs/dbraw/zinc/89/64/25/1019896425.db2.gz RMUFHEXFPHFQTF-UHFFFAOYSA-N -1 1 334.199 4.242 20 0 EIADMM C[C@@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)c1cncc([O-])c1 ZINC000339897806 1020057303 /nfs/dbraw/zinc/05/73/03/1020057303.db2.gz VKQPWPOQYJFTMD-HNNXBMFYSA-N -1 1 332.403 4.287 20 0 EIADMM O=C(Nc1nc(-c2cccc3ccccc32)cs1)c1cncc([O-])c1 ZINC000339936217 1020137017 /nfs/dbraw/zinc/13/70/17/1020137017.db2.gz NTKDNUCMZUFJDX-UHFFFAOYSA-N -1 1 347.399 4.316 20 0 EIADMM Fc1cccnc1[N-]c1oncc1-c1ccc(Br)cc1 ZINC001209805577 1020519642 /nfs/dbraw/zinc/51/96/42/1020519642.db2.gz IEBVNGHHVZJBRY-UHFFFAOYSA-N -1 1 334.148 4.382 20 0 EIADMM CC(C)(C)c1nnc([N-]C(=O)c2coc(C3CCCCC3)n2)s1 ZINC000547944962 1020928152 /nfs/dbraw/zinc/92/81/52/1020928152.db2.gz YDAICRIJZSQYIX-UHFFFAOYSA-N -1 1 334.445 4.124 20 0 EIADMM COc1cccc2cc(-c3nc(-c4ccc([O-])cc4F)no3)oc21 ZINC000683592159 1020945345 /nfs/dbraw/zinc/94/53/45/1020945345.db2.gz OPFJGMKNSSLRFT-UHFFFAOYSA-N -1 1 326.283 4.003 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cc(-c4ccccc4F)on3)n2)cc1F ZINC000683593129 1020948251 /nfs/dbraw/zinc/94/82/51/1020948251.db2.gz HJXSXUHNGJHMON-UHFFFAOYSA-N -1 1 341.273 4.042 20 0 EIADMM O=C(c1ncccc1[O-])N1CC=C(c2ccc(Cl)c(Cl)c2)CC1 ZINC000512505564 1032944691 /nfs/dbraw/zinc/94/46/91/1032944691.db2.gz ZSVKJLKBWROCNK-UHFFFAOYSA-N -1 1 349.217 4.024 20 0 EIADMM Cc1cc(C(=O)Nc2ccc([O-])c(Cl)c2)c(C)n1C1CCOCC1 ZINC000612758917 1021347275 /nfs/dbraw/zinc/34/72/75/1021347275.db2.gz DLVPKTFQJBLSEN-UHFFFAOYSA-N -1 1 348.830 4.068 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2cccc(OC(F)(F)F)c2)cc1C ZINC000024222646 1021476578 /nfs/dbraw/zinc/47/65/78/1021476578.db2.gz DNAMEWVSBHNCFP-UHFFFAOYSA-N -1 1 345.342 4.003 20 0 EIADMM COC(=O)c1sc(SC)nc1[N-]c1cc2cc(F)ccc2o1 ZINC001210724302 1021575323 /nfs/dbraw/zinc/57/53/23/1021575323.db2.gz FTUFANFOZNUHFL-UHFFFAOYSA-N -1 1 338.385 4.281 20 0 EIADMM O=C(Nc1c([O-])cccc1F)c1cc(-c2ccc(Cl)cc2)c[nH]1 ZINC000683864365 1021847871 /nfs/dbraw/zinc/84/78/71/1021847871.db2.gz KNMZDQAKGFZEHI-UHFFFAOYSA-N -1 1 330.746 4.432 20 0 EIADMM CN1CCCN(C(=O)c2ccc3ccccc3c2[O-])c2ccccc21 ZINC000172428284 1021855326 /nfs/dbraw/zinc/85/53/26/1021855326.db2.gz FTUUIUBHNMKPEJ-UHFFFAOYSA-N -1 1 332.403 4.032 20 0 EIADMM C[C@@H](CC(=O)N1CCC(C(=O)c2ccc([O-])cc2)CC1)CC(C)(C)C ZINC000613346793 1021883268 /nfs/dbraw/zinc/88/32/68/1021883268.db2.gz ITFPCBITKAGFCU-HNNXBMFYSA-N -1 1 345.483 4.276 20 0 EIADMM [O-]C(c1ccc(Nc2nccs2)cc1)(C(F)(F)F)C(F)(F)F ZINC001210992068 1021901804 /nfs/dbraw/zinc/90/18/04/1021901804.db2.gz QYIRGMDMNGIYHU-UHFFFAOYSA-N -1 1 342.264 4.199 20 0 EIADMM Cc1cccc([N-]S(=O)(=O)c2ccc(SC(F)(F)F)cc2)c1 ZINC000064937620 1022068121 /nfs/dbraw/zinc/06/81/21/1022068121.db2.gz CDPOYYMJQWKVSX-UHFFFAOYSA-N -1 1 347.383 4.408 20 0 EIADMM Cc1ccc(OC[C@@H](C)NC(=O)c2cc3ccccc3cc2[O-])cc1 ZINC001625865693 1022122314 /nfs/dbraw/zinc/12/23/14/1022122314.db2.gz CLSJWHGIMIIVIF-OAHLLOKOSA-N -1 1 335.403 4.051 20 0 EIADMM CC/C(=C/C(=O)Nc1cc([O-])c(F)cc1F)c1ccc(OC)cc1 ZINC001625893797 1022172869 /nfs/dbraw/zinc/17/28/69/1022172869.db2.gz NIHPDYVLRWARAZ-FLIBITNWSA-N -1 1 333.334 4.111 20 0 EIADMM CCS[C@H]1CC[C@H](N(C)C(=O)c2cc3ccccc3cc2[O-])C1 ZINC000175393065 1022348154 /nfs/dbraw/zinc/34/81/54/1022348154.db2.gz FCBINFWCJJBVKL-HOTGVXAUSA-N -1 1 329.465 4.292 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1CCS[C@@H]2CCCC[C@@H]21 ZINC000175456924 1022357387 /nfs/dbraw/zinc/35/73/87/1022357387.db2.gz HDXZAZNLDOYZRS-FUHWJXTLSA-N -1 1 327.449 4.046 20 0 EIADMM O=C([N-]c1nnc(-c2ccc(Cl)cc2)s1)c1ccc(Cl)o1 ZINC000134264629 1022526049 /nfs/dbraw/zinc/52/60/49/1022526049.db2.gz YXNLPMNRHNIOQF-UHFFFAOYSA-N -1 1 340.191 4.357 20 0 EIADMM CCOc1cc(C(=O)NCc2ccc(Cl)s2)cc(Cl)c1[O-] ZINC000186578573 1022683832 /nfs/dbraw/zinc/68/38/32/1022683832.db2.gz FEWGJMNWHLHDPI-UHFFFAOYSA-N -1 1 346.235 4.089 20 0 EIADMM CCOc1cc(C(=O)Nc2ccc3[nH]c(C)cc3c2)cc(Cl)c1[O-] ZINC000186588730 1022684927 /nfs/dbraw/zinc/68/49/27/1022684927.db2.gz VWBRUCGIUYARAI-UHFFFAOYSA-N -1 1 344.798 4.486 20 0 EIADMM CCOc1cc(C(=O)N2CCC[C@@H]2C2CCCC2)cc(Cl)c1[O-] ZINC000186674369 1022729079 /nfs/dbraw/zinc/72/90/79/1022729079.db2.gz SZHOHERJOGBXQM-OAHLLOKOSA-N -1 1 337.847 4.239 20 0 EIADMM CCOc1cc(C(=O)N2CCC3(C2)CCCCC3)cc(Cl)c1[O-] ZINC000186834758 1022767515 /nfs/dbraw/zinc/76/75/15/1022767515.db2.gz LYRCJERKOHEDBG-UHFFFAOYSA-N -1 1 337.847 4.241 20 0 EIADMM CCc1ccc(S(=O)(=O)[N-]c2ccc(-c3nccs3)cc2)cc1 ZINC000096695249 1022898476 /nfs/dbraw/zinc/89/84/76/1022898476.db2.gz UYGXFNRJPYICFD-UHFFFAOYSA-N -1 1 344.461 4.173 20 0 EIADMM O=S(=O)([N-][C@H]1CC=CCC1)c1c(Cl)cc(Cl)cc1Cl ZINC000605593687 1022943521 /nfs/dbraw/zinc/94/35/21/1022943521.db2.gz WQPCSTXJLBMYAK-VIFPVBQESA-N -1 1 340.659 4.034 20 0 EIADMM CCOc1cc(C(=O)Nc2cccc(N(C)C)c2C)cc(Cl)c1[O-] ZINC000186987230 1023189668 /nfs/dbraw/zinc/18/96/68/1023189668.db2.gz PHPGEVYXPHCNKJ-UHFFFAOYSA-N -1 1 348.830 4.071 20 0 EIADMM CSc1ccc([N-]S(=O)(=O)c2cccc(C(F)F)c2)cc1 ZINC000780371374 1023341090 /nfs/dbraw/zinc/34/10/90/1023341090.db2.gz ZYLWVQHEXJRAQK-UHFFFAOYSA-N -1 1 329.393 4.147 20 0 EIADMM Cc1oc([C@H](C)N2CC[C@@H](C(F)(F)F)C(C)(C)C2)cc1C(=O)[O-] ZINC000581553828 1023357152 /nfs/dbraw/zinc/35/71/52/1023357152.db2.gz HRSKIOCDVKRFNF-TVQRCGJNSA-N -1 1 333.350 4.258 20 0 EIADMM O=C(Nc1ccc2nc(C3CCC3)[nH]c2c1)c1cc(F)c([O-])c(F)c1 ZINC000183526162 1023374627 /nfs/dbraw/zinc/37/46/27/1023374627.db2.gz LQRLUONQTXUTON-UHFFFAOYSA-N -1 1 343.333 4.067 20 0 EIADMM CC(C)c1cccc(CN(C)Cc2nc(=O)c3sccc3[n-]2)c1 ZINC000660292884 1023440178 /nfs/dbraw/zinc/44/01/78/1023440178.db2.gz CCUAEAXPQIERSR-UHFFFAOYSA-N -1 1 327.453 4.152 20 0 EIADMM Cc1ccc(F)cc1[N-]S(=O)(=O)c1ccc(C)c(C(F)(F)F)c1 ZINC000500350189 1023739354 /nfs/dbraw/zinc/73/93/54/1023739354.db2.gz RQKNZXNNRHZLMF-UHFFFAOYSA-N -1 1 347.333 4.262 20 0 EIADMM CCc1ccc(S(=O)(=O)[N-]c2ccc3nc(C4CC4)oc3c2)cc1 ZINC000432192878 1023985569 /nfs/dbraw/zinc/98/55/69/1023985569.db2.gz PULZKIOYOPKCRP-UHFFFAOYSA-N -1 1 342.420 4.068 20 0 EIADMM Cc1c2ccccc2oc1[C@@H]([N-]C(=O)C(F)(F)C(F)F)C(C)C ZINC001126050810 1024006542 /nfs/dbraw/zinc/00/65/42/1024006542.db2.gz FSMSKBUYYGCVRN-LBPRGKRZSA-N -1 1 331.309 4.455 20 0 EIADMM Cc1ccc(Cl)cc1[N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1 ZINC000007409018 1024126922 /nfs/dbraw/zinc/12/69/22/1024126922.db2.gz UDFBOQPCFHJADL-UHFFFAOYSA-N -1 1 349.761 4.468 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1C[C@H]2CCC(=O)c3cccc1c32 ZINC000184391869 1024851114 /nfs/dbraw/zinc/85/11/14/1024851114.db2.gz SSPIHGJPPSOJND-CQSZACIVSA-N -1 1 343.382 4.266 20 0 EIADMM O=C([O-])C[C@@H](NCc1cc(F)cc(C(F)(F)F)c1)c1ccsc1 ZINC000277041964 1025008562 /nfs/dbraw/zinc/00/85/62/1025008562.db2.gz QYUXVAVEHINLDL-CYBMUJFWSA-N -1 1 347.333 4.212 20 0 EIADMM O=C(C[C@H]1CCCc2ccccc21)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC000342062666 1025084043 /nfs/dbraw/zinc/08/40/43/1025084043.db2.gz MSAYWTNRCCKNFF-MRXNPFEDSA-N -1 1 347.418 4.231 20 0 EIADMM O=S(=O)([N-]c1cccc(C(F)F)c1)c1cc(F)cc(Cl)c1 ZINC000535894686 1025221932 /nfs/dbraw/zinc/22/19/32/1025221932.db2.gz FXBRIAGYNWROIH-UHFFFAOYSA-N -1 1 335.734 4.218 20 0 EIADMM O=C(CCc1nc2ccccc2s1)Nc1ccc([O-])c(Cl)c1 ZINC000067738934 1025235276 /nfs/dbraw/zinc/23/52/76/1025235276.db2.gz MYHRHNJHFFICHZ-UHFFFAOYSA-N -1 1 332.812 4.227 20 0 EIADMM Cc1nc(-c2cccc([N-]S(=O)(=O)c3cccc(F)c3)c2)cs1 ZINC000007109239 1025824305 /nfs/dbraw/zinc/82/43/05/1025824305.db2.gz KUMVOHCVXVLGID-UHFFFAOYSA-N -1 1 348.424 4.058 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2cccc(Cl)c2C)cc1Cl ZINC000048652645 1026026048 /nfs/dbraw/zinc/02/60/48/1026026048.db2.gz GHSDSUBDIWMZCF-UHFFFAOYSA-N -1 1 330.236 4.411 20 0 EIADMM Cc1c(Cl)cccc1S(=O)(=O)[N-]c1ccc(-c2cnco2)cc1 ZINC000119786486 1026103437 /nfs/dbraw/zinc/10/34/37/1026103437.db2.gz OGVQENZLYUQHNV-UHFFFAOYSA-N -1 1 348.811 4.104 20 0 EIADMM O=C(COc1ccc(C(F)(F)F)cc1)Nc1ccc([O-])c(Cl)c1 ZINC000111666086 1026315518 /nfs/dbraw/zinc/31/55/18/1026315518.db2.gz ZJQBCUMPFLJCFX-UHFFFAOYSA-N -1 1 345.704 4.082 20 0 EIADMM CC(C)Oc1ccc([N-]S(=O)(=O)c2cccc3ccccc32)cc1 ZINC000033752390 1026327714 /nfs/dbraw/zinc/32/77/14/1026327714.db2.gz DLKFHLUJKJIKRK-UHFFFAOYSA-N -1 1 341.432 4.428 20 0 EIADMM O=C(CCC(=O)c1ccc2ccccc2c1)Nc1ccc(F)cc1[O-] ZINC000532012952 1026406500 /nfs/dbraw/zinc/40/65/00/1026406500.db2.gz PXEQXYMNQZXDOO-UHFFFAOYSA-N -1 1 337.350 4.286 20 0 EIADMM O=C([O-])C[C@@H](NCc1cc(Cl)ccc1Cl)c1ccsc1 ZINC000426683935 1026470880 /nfs/dbraw/zinc/47/08/80/1026470880.db2.gz WMFCVCWZPJDNLT-CYBMUJFWSA-N -1 1 330.236 4.361 20 0 EIADMM CCC[C@@H](NCc1ccc(-c2ccc(C(F)(F)F)cc2)o1)C(=O)[O-] ZINC000426685746 1026475978 /nfs/dbraw/zinc/47/59/78/1026475978.db2.gz KGEGJSVSRXCEGX-CQSZACIVSA-N -1 1 341.329 4.308 20 0 EIADMM CO[C@H](c1ccccc1Cl)[C@H](C)[NH2+]Cc1c(F)ccc(O)c1F ZINC000512216078 1026490473 /nfs/dbraw/zinc/49/04/73/1026490473.db2.gz ADUDVOGXVIOVFR-BTDLBPIBSA-N -1 1 341.785 4.190 20 0 EIADMM CC(C)[C@@H](NCc1ccc(-c2ccc(C(F)(F)F)cc2)o1)C(=O)[O-] ZINC000426691994 1026492553 /nfs/dbraw/zinc/49/25/53/1026492553.db2.gz NNIIMQNAAXRGKN-OAHLLOKOSA-N -1 1 341.329 4.164 20 0 EIADMM CC(C)[C@H](NCc1ccc(-c2ccc(C(F)(F)F)cc2)o1)C(=O)[O-] ZINC000426691993 1026492590 /nfs/dbraw/zinc/49/25/90/1026492590.db2.gz NNIIMQNAAXRGKN-HNNXBMFYSA-N -1 1 341.329 4.164 20 0 EIADMM O=C([O-])[C@@H](NCc1cccc(Cl)c1F)c1cccc(Cl)c1 ZINC000426735524 1026516522 /nfs/dbraw/zinc/51/65/22/1026516522.db2.gz FWQWVFMLWABTGJ-AWEZNQCLSA-N -1 1 328.170 4.048 20 0 EIADMM O=C([O-])[C@H](NCc1cc(Cl)ccc1F)c1cccc(Cl)c1 ZINC000426733266 1026517040 /nfs/dbraw/zinc/51/70/40/1026517040.db2.gz MBKCWDWBULXRDC-CQSZACIVSA-N -1 1 328.170 4.048 20 0 EIADMM O=C(c1ccc(F)c([O-])c1)N1[C@@H]2CC[C@H]1C[C@@H](c1ccccc1)C2 ZINC001625918346 1026534838 /nfs/dbraw/zinc/53/48/38/1026534838.db2.gz UCJZOOLTCYUHGZ-BJWYYQGGSA-N -1 1 325.383 4.082 20 0 EIADMM O=C([O-])[C@H](NCc1cc(Cl)ccc1F)c1ccc(Cl)c(F)c1 ZINC000426754152 1026538371 /nfs/dbraw/zinc/53/83/71/1026538371.db2.gz OCZUCSIZYFUDQT-CQSZACIVSA-N -1 1 346.160 4.187 20 0 EIADMM O=C([O-])[C@@H](NCc1ccc(Cl)cc1Cl)c1ccc(F)cc1 ZINC000426770915 1026550664 /nfs/dbraw/zinc/55/06/64/1026550664.db2.gz XFVOUGURRFRFED-AWEZNQCLSA-N -1 1 328.170 4.048 20 0 EIADMM O=C([O-])C[C@H](NCc1cc2ccccc2o1)c1cccc(Cl)c1 ZINC000426806182 1026560867 /nfs/dbraw/zinc/56/08/67/1026560867.db2.gz IMDMRHDILYPENI-INIZCTEOSA-N -1 1 329.783 4.392 20 0 EIADMM Cc1ccc([C@@H](CC(=O)[O-])NCc2cnc(-c3ccsc3)s2)o1 ZINC000426794893 1026566743 /nfs/dbraw/zinc/56/67/43/1026566743.db2.gz WAZAILDWHGRXCJ-CYBMUJFWSA-N -1 1 348.449 4.079 20 0 EIADMM C[C@@H]1CCCN(Cc2csc(-c3cccc(C(=O)[O-])c3)n2)[C@@H]1C ZINC000582425793 1026622634 /nfs/dbraw/zinc/62/26/34/1026622634.db2.gz NXCYXBWQKUGMCF-CHWSQXEVSA-N -1 1 330.453 4.129 20 0 EIADMM CN(Cc1cccc(Cl)c1)C(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684870010 1026627276 /nfs/dbraw/zinc/62/72/76/1026627276.db2.gz GGQPKJUMGZIZQR-UHFFFAOYSA-N -1 1 343.732 4.337 20 0 EIADMM O=C(c1ccc(C(F)(F)F)c([O-])c1)N1CCC[C@H]1C1CCCC1 ZINC000684872406 1026639394 /nfs/dbraw/zinc/63/93/94/1026639394.db2.gz DZHCVQXERXNZHG-AWEZNQCLSA-N -1 1 327.346 4.206 20 0 EIADMM CSc1ccc(C(=O)[N-]c2nc(-c3ccc(C)s3)ns2)o1 ZINC000112243844 1026669237 /nfs/dbraw/zinc/66/92/37/1026669237.db2.gz WWEUAJNCIMJERY-UHFFFAOYSA-N -1 1 337.451 4.142 20 0 EIADMM COC(=O)c1c[n-]c(S[C@H](C)c2ccc(Cl)cc2Cl)n1 ZINC000432669834 1026698049 /nfs/dbraw/zinc/69/80/49/1026698049.db2.gz REKKAHSOYFQISC-SSDOTTSWSA-N -1 1 331.224 4.356 20 0 EIADMM CSc1c(F)cccc1[N-]C(=O)c1oc2c(c1C)C(=O)CCC2 ZINC000617275537 1026707944 /nfs/dbraw/zinc/70/79/44/1026707944.db2.gz AUUHCQMBJZKBMR-UHFFFAOYSA-N -1 1 333.384 4.220 20 0 EIADMM Cc1nc2ccc(S(=O)(=O)[N-]c3cccc(C)c3C)cc2s1 ZINC000427114742 1026723987 /nfs/dbraw/zinc/72/39/87/1026723987.db2.gz QYGSGTPSWTWMPG-UHFFFAOYSA-N -1 1 332.450 4.022 20 0 EIADMM Cc1noc(C2CC2)c1[N-]C(=O)c1cc(F)c(C(F)(F)F)cc1F ZINC000342603433 1026724097 /nfs/dbraw/zinc/72/40/97/1026724097.db2.gz GYPBQJMLPLLTDY-UHFFFAOYSA-N -1 1 346.255 4.410 20 0 EIADMM Cc1cc(Cl)c(C(=O)Nc2ccc(-c3cc(=O)[nH][n-]3)cc2)cc1C ZINC000512346058 1026766779 /nfs/dbraw/zinc/76/67/79/1026766779.db2.gz GYYBWUIMEWNINC-UHFFFAOYSA-N -1 1 341.798 4.305 20 0 EIADMM C[C@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)c1ncccc1[O-] ZINC000427242852 1026785374 /nfs/dbraw/zinc/78/53/74/1026785374.db2.gz PMEGGIXQVGTOBM-OAHLLOKOSA-N -1 1 332.403 4.287 20 0 EIADMM CSc1ccc([O-])c(-c2nc(C3(c4ccncc4)CCC3)no2)c1 ZINC000664912856 1026908359 /nfs/dbraw/zinc/90/83/59/1026908359.db2.gz MZQFYOBEXMAWFU-UHFFFAOYSA-N -1 1 339.420 4.029 20 0 EIADMM CCCCC1CCC(NC(=O)c2c(C)nc(C(C)(C)C)[n-]c2=O)CC1 ZINC000474562258 1027217803 /nfs/dbraw/zinc/21/78/03/1027217803.db2.gz SCZIYRGDAZVZLP-UHFFFAOYSA-N -1 1 347.503 4.267 20 0 EIADMM CC(C)c1cc(C(=O)[N-]c2nc(-c3ccccc3Cl)ns2)no1 ZINC000179306546 1027648983 /nfs/dbraw/zinc/64/89/83/1027648983.db2.gz GFVDJDNXVUVWFK-UHFFFAOYSA-N -1 1 348.815 4.222 20 0 EIADMM C[C@@H](OCC(F)(F)F)c1noc(-c2ccc3ccccc3c2[O-])n1 ZINC000896606304 1027699454 /nfs/dbraw/zinc/69/94/54/1027699454.db2.gz IZWZLRIYWSLLMW-SECBINFHSA-N -1 1 338.285 4.235 20 0 EIADMM Cc1cc([C@H](C)N2CCC(Oc3ccc(F)cc3)CC2)oc1C(=O)[O-] ZINC000582246649 1027768483 /nfs/dbraw/zinc/76/84/83/1027768483.db2.gz KUJQJDNLAYUVMF-ZDUSSCGKSA-N -1 1 347.386 4.030 20 0 EIADMM CCOc1cc(-c2noc([C@H]3CCCCS3)n2)cc(Cl)c1[O-] ZINC000278032855 1027876578 /nfs/dbraw/zinc/87/65/78/1027876578.db2.gz XAQRXGFNTBATGN-GFCCVEGCSA-N -1 1 340.832 4.453 20 0 EIADMM O=C([O-])C[C@H](NCc1csc(Cl)c1Cl)c1cccs1 ZINC000669472638 1027879119 /nfs/dbraw/zinc/87/91/19/1027879119.db2.gz HKZRFHOYSRVWFO-QMMMGPOBSA-N -1 1 336.265 4.422 20 0 EIADMM CCSc1ccc(Cl)cc1[N-]C(=O)c1ncc(F)cc1F ZINC000192279298 1027916342 /nfs/dbraw/zinc/91/63/42/1027916342.db2.gz NRKFQDIMZISMRQ-UHFFFAOYSA-N -1 1 328.771 4.378 20 0 EIADMM CSc1ccc(S(=O)(=O)[N-]c2cccc(C(C)(F)F)c2)cc1 ZINC000188563112 1027983970 /nfs/dbraw/zinc/98/39/70/1027983970.db2.gz IBFMNGLACGZSEJ-UHFFFAOYSA-N -1 1 343.420 4.321 20 0 EIADMM C[C@H](C(=O)OC(C)(C)C)c1noc(-c2ccc3ccccc3c2[O-])n1 ZINC000281024284 1028349007 /nfs/dbraw/zinc/34/90/07/1028349007.db2.gz ZPPSORFEWMKYPT-NSHDSACASA-N -1 1 340.379 4.041 20 0 EIADMM Cc1nc2ccccc2n1CCCCCSc1ncc(C)c(=O)[n-]1 ZINC000583274147 1028402306 /nfs/dbraw/zinc/40/23/06/1028402306.db2.gz OTGZVJZZJXRILO-UHFFFAOYSA-N -1 1 342.468 4.111 20 0 EIADMM CCOc1cc(-c2noc(-c3ccccc3OC)n2)cc(Cl)c1[O-] ZINC000445430778 1028530027 /nfs/dbraw/zinc/53/00/27/1028530027.db2.gz JQPVGICUFCICLF-UHFFFAOYSA-N -1 1 346.770 4.170 20 0 EIADMM CCOc1cc(-c2noc(C(C3CC3)C3CC3)n2)cc(Cl)c1[O-] ZINC000445414222 1028533345 /nfs/dbraw/zinc/53/33/45/1028533345.db2.gz XFRXHADDRUPQEC-UHFFFAOYSA-N -1 1 334.803 4.398 20 0 EIADMM COc1cc(-c2nc(-c3ccc([O-])cc3Cl)no2)cc(OC)c1C ZINC000445450443 1028540215 /nfs/dbraw/zinc/54/02/15/1028540215.db2.gz SUWOIJAZDSTWCV-UHFFFAOYSA-N -1 1 346.770 4.088 20 0 EIADMM Cc1ccc(F)c(OCc2nc(-c3ccc([O-])cc3Cl)no2)c1 ZINC000445450253 1028544801 /nfs/dbraw/zinc/54/48/01/1028544801.db2.gz XKCLLQJLGBGYHM-UHFFFAOYSA-N -1 1 334.734 4.122 20 0 EIADMM COc1cccc([C@H]2C[C@H]2c2nc(-c3ccc([O-])cc3Cl)no2)c1 ZINC000445443174 1028570434 /nfs/dbraw/zinc/57/04/34/1028570434.db2.gz FQJGLGOVRTUIKY-HUUCEWRRSA-N -1 1 342.782 4.375 20 0 EIADMM C[C@H](Oc1ccccc1F)c1nc(-c2ccc([O-])cc2Cl)no1 ZINC000445445719 1028572504 /nfs/dbraw/zinc/57/25/04/1028572504.db2.gz KAWIUSBPWZVPTB-VIFPVBQESA-N -1 1 334.734 4.375 20 0 EIADMM [O-]c1ccc(-c2noc(CCc3cc(F)ccc3F)n2)c(Cl)c1 ZINC000445445710 1028573595 /nfs/dbraw/zinc/57/35/95/1028573595.db2.gz AZPXFVDOKQPEQQ-UHFFFAOYSA-N -1 1 336.725 4.159 20 0 EIADMM O=c1[nH]c2ccccc2cc1-c1nc(-c2ccc([O-])cc2Cl)no1 ZINC000445447772 1028578015 /nfs/dbraw/zinc/57/80/15/1028578015.db2.gz PUPUZMDJMNNNET-UHFFFAOYSA-N -1 1 339.738 4.016 20 0 EIADMM C[C@H](Sc1ccccn1)c1nc(-c2ccc([O-])cc2Cl)no1 ZINC000445452477 1028578855 /nfs/dbraw/zinc/57/88/55/1028578855.db2.gz RARRQJVXDGRXSI-VIFPVBQESA-N -1 1 333.800 4.344 20 0 EIADMM COc1ccc(/C(C)=C\c2nc(-c3ccc([O-])c(F)c3)no2)cc1 ZINC000445469715 1028595511 /nfs/dbraw/zinc/59/55/11/1028595511.db2.gz CCGRABVGRKDREI-LUAWRHEFSA-N -1 1 326.327 4.150 20 0 EIADMM Cc1ccc(CSCc2nc(-c3ccc([O-])cc3F)no2)cc1 ZINC000445453708 1028604514 /nfs/dbraw/zinc/60/45/14/1028604514.db2.gz JFUCIEUEYWXXOX-UHFFFAOYSA-N -1 1 330.384 4.323 20 0 EIADMM COc1cc(-c2nc(-c3cc(C)ccc3F)no2)cc(Cl)c1[O-] ZINC000445452037 1028605027 /nfs/dbraw/zinc/60/50/27/1028605027.db2.gz NUAMSFGURGJDHF-UHFFFAOYSA-N -1 1 334.734 4.219 20 0 EIADMM CCC(CC)n1ncc(-c2nc(-c3ccc([O-])cc3F)no2)c1C ZINC000445458324 1028612364 /nfs/dbraw/zinc/61/23/64/1028612364.db2.gz RZTMGHDEOIATKL-UHFFFAOYSA-N -1 1 330.363 4.114 20 0 EIADMM [O-]c1ccc(-c2noc(-c3csc(Br)c3)n2)c(F)c1 ZINC000445460508 1028615282 /nfs/dbraw/zinc/61/52/82/1028615282.db2.gz AZXWITBGAYLHJP-UHFFFAOYSA-N -1 1 341.161 4.072 20 0 EIADMM [O-]c1ccc(-c2noc(CCCc3cc(F)ccc3F)n2)c(F)c1 ZINC000445459690 1028616270 /nfs/dbraw/zinc/61/62/70/1028616270.db2.gz FXGPCHGLWZZURK-UHFFFAOYSA-N -1 1 334.297 4.035 20 0 EIADMM COc1cc(OC)cc(-c2noc(-c3ccc4ccccc4c3[O-])n2)c1 ZINC000445459262 1028616431 /nfs/dbraw/zinc/61/64/31/1028616431.db2.gz ZIYHDXIWGMHFQE-UHFFFAOYSA-N -1 1 348.358 4.280 20 0 EIADMM [O-]c1ccc(-c2noc(Cc3cccc(C(F)(F)F)c3)n2)c(F)c1 ZINC000445461315 1028618684 /nfs/dbraw/zinc/61/86/84/1028618684.db2.gz GERZPPPDGCHUFA-UHFFFAOYSA-N -1 1 338.260 4.191 20 0 EIADMM [O-]c1ccc(-c2noc(/C=C/c3cccc4cccnc34)n2)c(F)c1 ZINC000445461123 1028618827 /nfs/dbraw/zinc/61/88/27/1028618827.db2.gz FOFRIDFWYFTRCH-RMKNXTFCSA-N -1 1 333.322 4.300 20 0 EIADMM [O-]c1ccc(-c2noc(-c3csc(-c4cccs4)n3)n2)c(F)c1 ZINC000445462605 1028619348 /nfs/dbraw/zinc/61/93/48/1028619348.db2.gz LEWUVYZLEGXQNQ-UHFFFAOYSA-N -1 1 345.380 4.433 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cccc(Oc4ccncc4)c3)n2)cc1F ZINC000445480636 1028626945 /nfs/dbraw/zinc/62/69/45/1028626945.db2.gz MERRTPVSDMRZJQ-UHFFFAOYSA-N -1 1 349.321 4.436 20 0 EIADMM [O-]c1ccc(-c2noc(Cc3c[nH]c4ccc(Cl)cc34)n2)cc1F ZINC000445478990 1028627400 /nfs/dbraw/zinc/62/74/00/1028627400.db2.gz ULGQQWYBYAFUOQ-UHFFFAOYSA-N -1 1 343.745 4.307 20 0 EIADMM [O-]c1ccc(-c2noc(Cc3c[nH]c4cc(Cl)ccc34)n2)cc1F ZINC000445480110 1028627654 /nfs/dbraw/zinc/62/76/54/1028627654.db2.gz YNRPCELPZGAJEE-UHFFFAOYSA-N -1 1 343.745 4.307 20 0 EIADMM [O-]c1ccc(-c2noc([C@@H]3C[C@@]34CCCc3ccccc34)n2)cc1F ZINC000445482651 1028631243 /nfs/dbraw/zinc/63/12/43/1028631243.db2.gz SXLSZTIEEKKONR-MGPUTAFESA-N -1 1 336.366 4.343 20 0 EIADMM [O-]c1ccc(-c2noc(CCCOc3ccccc3Cl)n2)cc1F ZINC000445486502 1028635645 /nfs/dbraw/zinc/63/56/45/1028635645.db2.gz NODATBFDTGSBSF-UHFFFAOYSA-N -1 1 348.761 4.246 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cc(-c4ccccc4)ns3)n2)cc1F ZINC000445485132 1028636105 /nfs/dbraw/zinc/63/61/05/1028636105.db2.gz YDZFTQIXWMXGRR-UHFFFAOYSA-N -1 1 339.351 4.372 20 0 EIADMM COc1ccc(C)cc1/C=C/c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445473076 1028645404 /nfs/dbraw/zinc/64/54/04/1028645404.db2.gz MIXKAXWHLRPMOE-VMPITWQZSA-N -1 1 326.327 4.069 20 0 EIADMM [O-]c1ccc(-c2noc(-c3ccccc3Br)n2)cc1F ZINC000445476910 1028646908 /nfs/dbraw/zinc/64/69/08/1028646908.db2.gz JVBYHXRYCKNQJA-UHFFFAOYSA-N -1 1 335.132 4.011 20 0 EIADMM c1csc([C@H]([N-]c2noc(-c3ccccc3)n2)c2ccccc2)n1 ZINC000157407578 1029061888 /nfs/dbraw/zinc/06/18/88/1029061888.db2.gz OBFQGRADMUVQLZ-OAHLLOKOSA-N -1 1 334.404 4.395 20 0 EIADMM Cc1oc(-c2ccsc2)nc1CSc1nc(C2CC2)cc(=O)[n-]1 ZINC000583909867 1029356700 /nfs/dbraw/zinc/35/67/00/1029356700.db2.gz FQLAWWWEERXWTO-UHFFFAOYSA-N -1 1 345.449 4.377 20 0 EIADMM CCOc1ccc2cc(-c3nc(-c4ccc([O-])c(F)c4)no3)[nH]c2c1 ZINC000445478523 1029395344 /nfs/dbraw/zinc/39/53/44/1029395344.db2.gz RSVPFTYCNOVJLF-UHFFFAOYSA-N -1 1 339.326 4.128 20 0 EIADMM O=C([O-])c1cc(CN2CCC(c3cccc(F)c3F)CC2)cs1 ZINC000583939858 1029399755 /nfs/dbraw/zinc/39/97/55/1029399755.db2.gz GHCPCISXDNILHQ-UHFFFAOYSA-N -1 1 337.391 4.104 20 0 EIADMM Cc1cnc(S[C@H](C)C(=O)c2ccc(C(C)(C)C)cc2)[n-]c1=O ZINC000583945716 1029403349 /nfs/dbraw/zinc/40/33/49/1029403349.db2.gz DMCKYXYRSYDOAC-GFCCVEGCSA-N -1 1 330.453 4.152 20 0 EIADMM Cc1nc(C(C)(C)C)[n-]c(=O)c1C(=O)NCC1(CC(C)C)CCCC1 ZINC000446528013 1029437005 /nfs/dbraw/zinc/43/70/05/1029437005.db2.gz SRMRCQNHBGBXAL-UHFFFAOYSA-N -1 1 347.503 4.124 20 0 EIADMM Cc1ccccc1[C@@H]1CN(C(=O)c2cc3ccccc3cc2[O-])CCO1 ZINC000525253617 1029547951 /nfs/dbraw/zinc/54/79/51/1029547951.db2.gz TTYBALBTAJIICR-NRFANRHFSA-N -1 1 347.414 4.068 20 0 EIADMM Cc1ccc2nc(-c3ccc(Br)cc3F)[n-]c(=O)c2c1 ZINC000447001057 1029662965 /nfs/dbraw/zinc/66/29/65/1029662965.db2.gz PDCVNTXUTYDMET-UHFFFAOYSA-N -1 1 333.160 4.212 20 0 EIADMM Cc1nc(-c2ccc(N[C@@H](C)[C@H](C)c3ccccc3)nc2)[n-]c(=O)c1C ZINC000080687971 1029713949 /nfs/dbraw/zinc/71/39/49/1029713949.db2.gz NAGVUZJILRKFKO-ZFWWWQNUSA-N -1 1 348.450 4.053 20 0 EIADMM Cc1nc(-c2ccc(NC[C@H]3CCC[C@H](C)C3)nc2)[n-]c(=O)c1C ZINC000301348394 1029714136 /nfs/dbraw/zinc/71/41/36/1029714136.db2.gz HXWIFTSQVPCEFA-WFASDCNBSA-N -1 1 326.444 4.099 20 0 EIADMM CC(=O)Nc1ccc(C)cc1NC(=O)c1ccc2ccccc2c1[O-] ZINC000170805312 1029880346 /nfs/dbraw/zinc/88/03/46/1029880346.db2.gz NPGAJRZLDHIANQ-UHFFFAOYSA-N -1 1 334.375 4.065 20 0 EIADMM Cc1c(=O)[n-]c(SC[C@@H]2CCO[C@H](C)C2)nc1-c1ccccc1 ZINC000447284281 1029962954 /nfs/dbraw/zinc/96/29/54/1029962954.db2.gz FCYOOEIKUAGYJY-TZMCWYRMSA-N -1 1 330.453 4.065 20 0 EIADMM O=C([N-]c1nnc(C(F)F)s1)c1ccc(-c2ccccc2F)o1 ZINC000144526644 1030077981 /nfs/dbraw/zinc/07/79/81/1030077981.db2.gz QEOYMYHMEQDZPR-UHFFFAOYSA-N -1 1 339.298 4.127 20 0 EIADMM CCc1cc(=O)[n-]c(SCc2cc(Br)ccc2C)n1 ZINC000450908547 1030101289 /nfs/dbraw/zinc/10/12/89/1030101289.db2.gz MCSQOIMZKJMBDH-UHFFFAOYSA-N -1 1 339.258 4.108 20 0 EIADMM COc1cc(C(=O)Nc2cccc(CSC)c2)cc(Cl)c1[O-] ZINC000525954507 1030124518 /nfs/dbraw/zinc/12/45/18/1030124518.db2.gz JAZHQNHKYOQELZ-UHFFFAOYSA-N -1 1 337.828 4.170 20 0 EIADMM C[C@@H]1CC(C(=O)[O-])C[C@@H](C)N1Cc1nc(C2CCCCC2)cs1 ZINC000530175868 1030197100 /nfs/dbraw/zinc/19/71/00/1030197100.db2.gz QFRHDRZEAQPXHN-CHWSQXEVSA-N -1 1 336.501 4.264 20 0 EIADMM CCOc1cc(C(=O)N(C)[C@@H]2CCC[C@@H](C)C2)cc(Cl)c1[O-] ZINC000186579389 1030288580 /nfs/dbraw/zinc/28/85/80/1030288580.db2.gz SPRIWVODJVIHNO-DGCLKSJQSA-N -1 1 325.836 4.095 20 0 EIADMM CC(C)(C)OCc1ccc(NC(=O)c2c(F)ccc([O-])c2F)cc1 ZINC000685446690 1030329109 /nfs/dbraw/zinc/32/91/09/1030329109.db2.gz XYRLZCHPJHBDAJ-UHFFFAOYSA-N -1 1 335.350 4.238 20 0 EIADMM O=C(Nc1cnc(-c2ccccc2)s1)c1c(F)ccc([O-])c1F ZINC000685458658 1030333774 /nfs/dbraw/zinc/33/37/74/1030333774.db2.gz QNLKVQQGACBLRG-UHFFFAOYSA-N -1 1 332.331 4.046 20 0 EIADMM C[N@@H+](Cc1cccc(O)c1Cl)[C@@H]1CCCN(c2ccccc2)C1 ZINC000508645793 1030510177 /nfs/dbraw/zinc/51/01/77/1030510177.db2.gz PEJNVNZVPSJLDS-QGZVFWFLSA-N -1 1 330.859 4.146 20 0 EIADMM CCC(CC)c1cc(C(=O)[N-]c2cc(C3(C)CCCC3)on2)on1 ZINC000448415210 1030778637 /nfs/dbraw/zinc/77/86/37/1030778637.db2.gz QJKKDIYENOPJKI-UHFFFAOYSA-N -1 1 331.416 4.072 20 0 EIADMM C[C@H]1CC[C@@H](C(=O)[O-])CN1Cc1ccc(Cl)c(C(F)(F)F)c1 ZINC000263311173 1030823723 /nfs/dbraw/zinc/82/37/23/1030823723.db2.gz HZMWCCTYOGJBKV-GXSJLCMTSA-N -1 1 335.753 4.044 20 0 EIADMM O=C(Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)C1CC2(C1)CCCCC2 ZINC000666315159 1030837888 /nfs/dbraw/zinc/83/78/88/1030837888.db2.gz TXZLFKLHQICBKE-UHFFFAOYSA-N -1 1 325.412 4.081 20 0 EIADMM O=C([O-])c1ccccc1C1CCN(Cc2ccsc2Cl)CC1 ZINC000666586704 1031047025 /nfs/dbraw/zinc/04/70/25/1031047025.db2.gz URGYUGLWRMFWRX-UHFFFAOYSA-N -1 1 335.856 4.479 20 0 EIADMM CCC[C@@H]1CCCC[N@H+]1Cc1ccc(C(=O)[O-])cc1Br ZINC000226736318 1031102564 /nfs/dbraw/zinc/10/25/64/1031102564.db2.gz CVDZESXHJWHKDC-CQSZACIVSA-N -1 1 340.261 4.302 20 0 EIADMM C[C@@H]1CC[C@H](c2noc(-c3cc(Oc4ccccc4)ccc3[O-])n2)O1 ZINC000528232968 1031279288 /nfs/dbraw/zinc/27/92/88/1031279288.db2.gz IKUNXFAAELZUMU-SJKOYZFVSA-N -1 1 338.363 4.475 20 0 EIADMM COC(=O)c1c(F)cccc1Nc1ccc(Cl)c(Cl)c1[O-] ZINC001214055420 1033931710 /nfs/dbraw/zinc/93/17/10/1033931710.db2.gz OCDHRXFPZLEIJX-UHFFFAOYSA-N -1 1 330.142 4.368 20 0 EIADMM CCC(CC)n1ccc(CSc2nc(C(F)(F)F)cc(=O)[n-]2)n1 ZINC000433388186 1034314870 /nfs/dbraw/zinc/31/48/70/1034314870.db2.gz IXUYAIAUUGRABG-UHFFFAOYSA-N -1 1 346.378 4.051 20 0 EIADMM Cc1ccc(C)c(S(=O)(=O)[N-]c2ccc(C)c(OC(F)F)c2)c1 ZINC000513363747 1034893775 /nfs/dbraw/zinc/89/37/75/1034893775.db2.gz KMSQFTMAYTYVGM-UHFFFAOYSA-N -1 1 341.379 4.014 20 0 EIADMM CC(C)[C@H](NCc1ccc(-c2ccc(C(C)(C)C)cc2)o1)C(=O)[O-] ZINC000262723593 1034970198 /nfs/dbraw/zinc/97/01/98/1034970198.db2.gz XDLIFBKIYBCOPF-SFHVURJKSA-N -1 1 329.440 4.443 20 0 EIADMM CCCc1nnc([N-]C(=O)c2c(C)onc2-c2ccccc2C)s1 ZINC000280554030 1035288569 /nfs/dbraw/zinc/28/85/69/1035288569.db2.gz KJGXFHNZCMCVFK-UHFFFAOYSA-N -1 1 342.424 4.015 20 0 EIADMM CCOC(=O)c1cnc(C(C)=Cc2cccc(C(C)C)c2)[n-]c1=O ZINC000596011129 1035809949 /nfs/dbraw/zinc/80/99/49/1035809949.db2.gz DEAHCOGKAXIOCO-UKTHLTGXSA-N -1 1 326.396 4.043 20 0 EIADMM CC(C)(NCc1ccc(C(=O)[O-])cn1)c1ccc(Cl)c(Cl)c1 ZINC000905725516 1035875475 /nfs/dbraw/zinc/87/54/75/1035875475.db2.gz WENLQBAOPBYMNJ-UHFFFAOYSA-N -1 1 339.222 4.112 20 0 EIADMM C[C@@H](CN1CCOc2c(cccc2C(=O)[O-])C1)c1cccc(Cl)c1 ZINC000905737240 1035879039 /nfs/dbraw/zinc/87/90/39/1035879039.db2.gz DCBPBEWAMFBBOT-ZDUSSCGKSA-N -1 1 345.826 4.036 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cc(-c4cccc(F)c4)no3)n2)c(F)c1 ZINC000571014025 1035916591 /nfs/dbraw/zinc/91/65/91/1035916591.db2.gz YAGNIGWNBZKSRW-UHFFFAOYSA-N -1 1 341.273 4.042 20 0 EIADMM COc1ccc2oc(-c3nc(-c4ccc([O-])cc4F)no3)c(C)c2c1 ZINC000571386856 1036037464 /nfs/dbraw/zinc/03/74/64/1036037464.db2.gz IGNDUBPOEWPDCL-UHFFFAOYSA-N -1 1 340.310 4.312 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1cnc2c(F)ccc(F)c2c1 ZINC000485656878 1036126263 /nfs/dbraw/zinc/12/62/63/1036126263.db2.gz KPHRMSNDOXIPQW-UHFFFAOYSA-N -1 1 334.709 4.124 20 0 EIADMM CC(C)c1ccc(C(=O)Nc2ccc(Oc3cccnn3)cc2)c([O-])c1 ZINC001167945309 1036251308 /nfs/dbraw/zinc/25/13/08/1036251308.db2.gz MCWWTXGVCHPPAX-UHFFFAOYSA-N -1 1 349.390 4.350 20 0 EIADMM CC(=O)c1csc([N-]c2ncnc3oc(-c4ccccc4)cc32)n1 ZINC000502707890 1036526963 /nfs/dbraw/zinc/52/69/63/1036526963.db2.gz NJUVQEFUTYIHGP-UHFFFAOYSA-N -1 1 336.376 4.293 20 0 EIADMM O=C(Nc1ccc(-n2cccn2)c(F)c1)Nc1ccc([O-])c(Cl)c1 ZINC000486236889 1036584570 /nfs/dbraw/zinc/58/45/70/1036584570.db2.gz VAOGDXYDXBCBFF-UHFFFAOYSA-N -1 1 346.749 4.014 20 0 EIADMM Cc1sc2[n-]c(-c3cncs3)nc(=O)c2c1-c1ccccc1 ZINC000486632682 1036790985 /nfs/dbraw/zinc/79/09/85/1036790985.db2.gz DRCRMTXMJHYWKA-UHFFFAOYSA-N -1 1 325.418 4.496 20 0 EIADMM CCc1c(C(=O)Nc2cc([O-])c(F)cc2F)cnn1C(CC)CC ZINC000909986200 1037227347 /nfs/dbraw/zinc/22/73/47/1037227347.db2.gz CHMPGCOYIHFYAJ-UHFFFAOYSA-N -1 1 337.370 4.043 20 0 EIADMM Cc1cccnc1[C@H](NC(=O)c1cc2ccccc2cc1[O-])C(C)C ZINC000604244774 1037296651 /nfs/dbraw/zinc/29/66/51/1037296651.db2.gz CRJRCFJHFBRPJP-LJQANCHMSA-N -1 1 334.419 4.376 20 0 EIADMM CCOc1c(Cl)cc(-c2nc3cccc(F)c3c(=O)[n-]2)cc1OC ZINC000591727091 1037561400 /nfs/dbraw/zinc/56/14/00/1037561400.db2.gz WQFNPFOICHOEGY-UHFFFAOYSA-N -1 1 348.761 4.202 20 0 EIADMM Cc1cccc(CN(C)c2ccc(-c3nc(C)c(C)c(=O)[n-]3)cn2)c1C ZINC000488436013 1037592926 /nfs/dbraw/zinc/59/29/26/1037592926.db2.gz BNPVCDIBFNZVJZ-UHFFFAOYSA-N -1 1 348.450 4.114 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1CCS[C@H](c2ccccc2)C1 ZINC000605108508 1037677060 /nfs/dbraw/zinc/67/70/60/1037677060.db2.gz WVAINOZXUXQFRL-FQEVSTJZSA-N -1 1 349.455 4.476 20 0 EIADMM COc1ccc(-c2ccc(-c3nc4cccc(F)c4c(=O)[n-]3)cc2)cc1 ZINC000608102967 1038610577 /nfs/dbraw/zinc/61/05/77/1038610577.db2.gz LIBZXGJZEOVCKJ-UHFFFAOYSA-N -1 1 346.361 4.405 20 0 EIADMM C[C@@H](Oc1cccc(Cl)c1Cl)C(=O)Nc1ccc(F)cc1[O-] ZINC000533971729 1038740222 /nfs/dbraw/zinc/74/02/22/1038740222.db2.gz ZYKQVCXUSGPZMF-MRVPVSSYSA-N -1 1 344.169 4.244 20 0 EIADMM O=C(Nc1c([O-])cccc1F)c1csc(-c2ccc(F)cc2)n1 ZINC000608366799 1038804263 /nfs/dbraw/zinc/80/42/63/1038804263.db2.gz ZNAGDNBDKHKCHI-UHFFFAOYSA-N -1 1 332.331 4.046 20 0 EIADMM CC(C)[C@@H](NCc1n[nH]c(=O)[n-]1)c1ccc(C2CCCCC2)cc1 ZINC000539247844 1038894328 /nfs/dbraw/zinc/89/43/28/1038894328.db2.gz FKDCIJGFLNABCN-GOSISDBHSA-N -1 1 328.460 4.045 20 0 EIADMM CSCc1ccc([N-]S(=O)(=O)c2ccc(Cl)cc2)cc1 ZINC000608955970 1038977734 /nfs/dbraw/zinc/97/77/34/1038977734.db2.gz YXCVPCCPLRINDI-UHFFFAOYSA-N -1 1 327.858 4.004 20 0 EIADMM O=S(=O)([N-]c1ccc(-c2ccc[nH]2)cc1)c1cccc(Cl)c1 ZINC000539359011 1038995726 /nfs/dbraw/zinc/99/57/26/1038995726.db2.gz BCIJEAVXPFBKDF-UHFFFAOYSA-N -1 1 332.812 4.136 20 0 EIADMM CC(C)(C)OC(=O)CCC(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000600135669 1039314629 /nfs/dbraw/zinc/31/46/29/1039314629.db2.gz LBDFMNSHBSKXQR-UHFFFAOYSA-N -1 1 349.814 4.259 20 0 EIADMM O=C(N=c1cc(-c2ccc(Cl)s2)[n-][nH]1)c1ccccc1Cl ZINC000534556658 1039557622 /nfs/dbraw/zinc/55/76/22/1039557622.db2.gz WKYAPWIIQLMHSS-UHFFFAOYSA-N -1 1 338.219 4.119 20 0 EIADMM CC[C@@H](CC(=O)Nc1ccc([O-])c(F)c1F)c1ccc(OC)cc1 ZINC000456786212 1039603336 /nfs/dbraw/zinc/60/33/36/1039603336.db2.gz OCULCMDRBMWPIR-NSHDSACASA-N -1 1 335.350 4.201 20 0 EIADMM Cc1c(Cl)cc(F)c([N-]C(=O)c2cc(C(C)(C)C)on2)c1F ZINC000534926319 1039858574 /nfs/dbraw/zinc/85/85/74/1039858574.db2.gz PHMCZTQHYANTLT-UHFFFAOYSA-N -1 1 328.746 4.464 20 0 EIADMM CCc1cc(C)cc(CC)c1[N-]S(=O)(=O)c1ccc(C(C)=O)cc1 ZINC000481862104 1039863928 /nfs/dbraw/zinc/86/39/28/1039863928.db2.gz AFGOWUUSUMADEZ-UHFFFAOYSA-N -1 1 345.464 4.123 20 0 EIADMM Cc1cc(Cl)c([N-]S(=O)(=O)c2ccccc2F)cc1Cl ZINC000158970173 1040274117 /nfs/dbraw/zinc/27/41/17/1040274117.db2.gz BGXXMHBZNQQEFT-UHFFFAOYSA-N -1 1 334.199 4.242 20 0 EIADMM O=S(=O)([N-]c1cccc(C(F)F)c1)c1ccc2ncsc2c1 ZINC000479516369 1040433865 /nfs/dbraw/zinc/43/38/65/1040433865.db2.gz KNQNOAKKBOLRAA-UHFFFAOYSA-N -1 1 340.376 4.035 20 0 EIADMM C[C@@H](CC(C)(C)c1ccccc1)NC(=O)c1c(F)ccc([O-])c1F ZINC000539447366 1040449491 /nfs/dbraw/zinc/44/94/91/1040449491.db2.gz WBDLTXLLYOYJMJ-LBPRGKRZSA-N -1 1 333.378 4.157 20 0 EIADMM Cc1cc(Br)c([O-])c(NC(=O)c2ccc(Cl)cc2)c1 ZINC000482733819 1040456428 /nfs/dbraw/zinc/45/64/28/1040456428.db2.gz GBAMXZZADVQIKV-UHFFFAOYSA-N -1 1 340.604 4.369 20 0 EIADMM CCCc1cc(=O)[n-]c(S[C@H](C)c2noc(-c3ccccc3)n2)n1 ZINC000477428357 1040486021 /nfs/dbraw/zinc/48/60/21/1040486021.db2.gz OCHHEJNZXLNQOH-LLVKDONJSA-N -1 1 342.424 4.038 20 0 EIADMM O=C(Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)c1ccc(F)c2ccccc12 ZINC000479718323 1040613838 /nfs/dbraw/zinc/61/38/38/1040613838.db2.gz FNKRPYUOGGALRA-UHFFFAOYSA-N -1 1 347.349 4.327 20 0 EIADMM Cc1cc(Cl)ccc1C1=CCN(Cc2cccc(C(=O)[O-])n2)CC1 ZINC000902419432 1040649848 /nfs/dbraw/zinc/64/98/48/1040649848.db2.gz LQEJHSHVYWKEHF-UHFFFAOYSA-N -1 1 342.826 4.031 20 0 EIADMM CC(C)[C@H]1C[C@H](Cc2nc(-c3ccc([O-])cc3Cl)no2)CCO1 ZINC000445455597 1040796374 /nfs/dbraw/zinc/79/63/74/1040796374.db2.gz PZYRKVPGXGANCL-IAQYHMDHSA-N -1 1 336.819 4.089 20 0 EIADMM CCc1cccc(CC)c1[N-]S(=O)(=O)c1ccccc1SC ZINC000436011569 1040805626 /nfs/dbraw/zinc/80/56/26/1040805626.db2.gz COAFODILKLJMRQ-UHFFFAOYSA-N -1 1 335.494 4.334 20 0 EIADMM CSc1ccccc1S(=O)(=O)[N-]c1ccc(F)c(Cl)c1 ZINC000436024356 1040817954 /nfs/dbraw/zinc/81/79/54/1040817954.db2.gz RRWQUPIUGOVCEH-UHFFFAOYSA-N -1 1 331.821 4.002 20 0 EIADMM O=C(c1ccc(F)c([O-])c1)N(CCc1ccccc1F)C1CCCC1 ZINC001142574394 1040889775 /nfs/dbraw/zinc/88/97/75/1040889775.db2.gz OXCGOSRIFPBZNX-UHFFFAOYSA-N -1 1 345.389 4.298 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2cccc(C(C)(F)F)c2)ccc1F ZINC000436184585 1040925026 /nfs/dbraw/zinc/92/50/26/1040925026.db2.gz UDMPTNJLRJXLMU-UHFFFAOYSA-N -1 1 329.343 4.047 20 0 EIADMM Cc1ccc(Cl)cc1S(=O)(=O)[N-]c1cc2[nH]ccc2cc1C ZINC000436172807 1040935764 /nfs/dbraw/zinc/93/57/64/1040935764.db2.gz QZQCNUJKOZIETD-UHFFFAOYSA-N -1 1 334.828 4.239 20 0 EIADMM CCc1cc(=O)[n-]c(SCc2ccc(C)c(Br)c2)n1 ZINC000436209470 1040961307 /nfs/dbraw/zinc/96/13/07/1040961307.db2.gz MJSZCBKJEHKJQL-UHFFFAOYSA-N -1 1 339.258 4.108 20 0 EIADMM Cc1nc(-c2ccc(N(C)C[C@H](C)c3ccccc3)nc2)[n-]c(=O)c1C ZINC000462809973 1040953223 /nfs/dbraw/zinc/95/32/23/1040953223.db2.gz JVIKLPBCZLQVAC-AWEZNQCLSA-N -1 1 348.450 4.101 20 0 EIADMM CCc1cc(=O)[n-]c(S[C@H](C)c2ccccc2Br)n1 ZINC000436192464 1040963088 /nfs/dbraw/zinc/96/30/88/1040963088.db2.gz CQBUVLHHJDYVQF-SECBINFHSA-N -1 1 339.258 4.360 20 0 EIADMM Cc1ccc(-c2nc(CSc3nc(C4CC4)cc(=O)[n-]3)cs2)o1 ZINC000436239640 1040987499 /nfs/dbraw/zinc/98/74/99/1040987499.db2.gz MMBODGGGVGQTNH-UHFFFAOYSA-N -1 1 345.449 4.377 20 0 EIADMM CSCc1ccc([N-]S(=O)(=O)c2cccc(C(C)C)c2)cc1 ZINC000460833544 1040994726 /nfs/dbraw/zinc/99/47/26/1040994726.db2.gz DSKVWZUYRIJQQJ-UHFFFAOYSA-N -1 1 335.494 4.474 20 0 EIADMM Cc1ccc(F)cc1S(=O)(=O)[N-]c1cccc(-c2nccs2)c1 ZINC000515836826 1041173455 /nfs/dbraw/zinc/17/34/55/1041173455.db2.gz YEIDEDOCRADDSN-UHFFFAOYSA-N -1 1 348.424 4.058 20 0 EIADMM CN(Cc1ccc(OC(F)(F)F)cc1)Cc1ccc([O-])c(F)c1F ZINC001205078012 1041232341 /nfs/dbraw/zinc/23/23/41/1041232341.db2.gz XLXINOPGPBEZDB-UHFFFAOYSA-N -1 1 347.283 4.201 20 0 EIADMM CC[C@H](C)[C@@H](C)[N@@H+](Cc1coc(-c2ccc(C(=O)[O-])cc2)n1)C1CC1 ZINC000567359168 1041244814 /nfs/dbraw/zinc/24/48/14/1041244814.db2.gz MEOSWMYEMVIALV-UONOGXRCSA-N -1 1 342.439 4.439 20 0 EIADMM [O-]c1ccc(-c2noc(-c3coc(C4CCCCC4)n3)n2)c(F)c1 ZINC000515916149 1041262280 /nfs/dbraw/zinc/26/22/80/1041262280.db2.gz PYBPPPQLRWVJEA-UHFFFAOYSA-N -1 1 329.331 4.284 20 0 EIADMM C=Cc1ccc(S(=O)(=O)[N-]c2cccc(OC(F)(F)F)c2)cc1 ZINC000436480752 1041266268 /nfs/dbraw/zinc/26/62/68/1041266268.db2.gz XPAUNJGIQLPRNE-UHFFFAOYSA-N -1 1 343.326 4.029 20 0 EIADMM C=Cc1ccc(S(=O)(=O)[N-]c2cccc(CC(F)(F)F)c2)cc1 ZINC000436474877 1041272143 /nfs/dbraw/zinc/27/21/43/1041272143.db2.gz FENADCLCAORJAB-UHFFFAOYSA-N -1 1 341.354 4.235 20 0 EIADMM CN(Cc1ccc(F)cc1Cl)C(=O)c1cc(Cl)ccc1[O-] ZINC000436483577 1041284653 /nfs/dbraw/zinc/28/46/53/1041284653.db2.gz FQSTZXCMTQXLNN-UHFFFAOYSA-N -1 1 328.170 4.110 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1CCc2c([nH]c3ccccc32)C1 ZINC000436527994 1041313390 /nfs/dbraw/zinc/31/33/90/1041313390.db2.gz VPYSCIJHNPSRNU-UHFFFAOYSA-N -1 1 342.398 4.225 20 0 EIADMM CCCOc1cccc(NC(=O)c2cc(Cl)c([O-])c(OCC)c2)c1 ZINC000436533531 1041317440 /nfs/dbraw/zinc/31/74/40/1041317440.db2.gz IWOIWWHRTZOSCX-UHFFFAOYSA-N -1 1 349.814 4.485 20 0 EIADMM Cc1ccc(NC(=O)c2cc(F)ccc2[O-])c(OCC(F)(F)F)c1 ZINC000436547912 1041322514 /nfs/dbraw/zinc/32/25/14/1041322514.db2.gz KQYPZOFPISOTHA-UHFFFAOYSA-N -1 1 343.276 4.033 20 0 EIADMM CCN(C(=O)c1ccc(Cl)cc1[O-])[C@H](C)Cc1ccc(OC)cc1 ZINC000436553652 1041327531 /nfs/dbraw/zinc/32/75/31/1041327531.db2.gz FXNFVNODZUIVSK-CYBMUJFWSA-N -1 1 347.842 4.148 20 0 EIADMM CC[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)c1cc(F)ccc1[O-] ZINC000436539267 1041334352 /nfs/dbraw/zinc/33/43/52/1041334352.db2.gz NBEDYERCYPTCIO-WMZOPIPTSA-N -1 1 327.399 4.330 20 0 EIADMM C[C@@H]1CN(C(=O)c2cc3ccccc3cc2[O-])[C@H](c2ccccc2)CO1 ZINC000436575123 1041339715 /nfs/dbraw/zinc/33/97/15/1041339715.db2.gz NNSKGIGTOYMSKF-QRWLVFNGSA-N -1 1 347.414 4.148 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N1C[C@H](c2ccccc2)[C@@H]2CCC[C@H]21 ZINC000436557197 1041342176 /nfs/dbraw/zinc/34/21/76/1041342176.db2.gz SWXMUMGFGCRSBT-CGTJXYLNSA-N -1 1 341.838 4.454 20 0 EIADMM CC(C)c1ccc(C(=O)Nc2nc3c(s2)CSCC3)c([O-])c1 ZINC000436566471 1041345682 /nfs/dbraw/zinc/34/56/82/1041345682.db2.gz PTQYILIPUNEAQC-UHFFFAOYSA-N -1 1 334.466 4.014 20 0 EIADMM Cc1ccc([C@@H]2CCC[C@@H]2N(C)C(=O)c2cc(F)ccc2[O-])cc1 ZINC000436592558 1041351258 /nfs/dbraw/zinc/35/12/58/1041351258.db2.gz WLWVEPDQYNNPDQ-WMZOPIPTSA-N -1 1 327.399 4.248 20 0 EIADMM CC[C@@H](C)n1ncc(NC(=O)c2ccc(C(F)(F)F)cc2[O-])c1C ZINC000436595310 1041355920 /nfs/dbraw/zinc/35/59/20/1041355920.db2.gz LSHFMCXGSDAPCD-SECBINFHSA-N -1 1 341.333 4.139 20 0 EIADMM CC1(c2ccccc2)CCN(C(=O)c2cc(Cl)ccc2[O-])CC1 ZINC000436579875 1041357986 /nfs/dbraw/zinc/35/79/86/1041357986.db2.gz VFNYTORRDZPXJW-UHFFFAOYSA-N -1 1 329.827 4.240 20 0 EIADMM O=C(NCc1coc(-c2ccccc2)n1)c1cc2ccccc2cc1[O-] ZINC000436580155 1041358969 /nfs/dbraw/zinc/35/89/69/1041358969.db2.gz AJOHWYIFMKZCHB-UHFFFAOYSA-N -1 1 344.370 4.130 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N1CC(Cc2ccccc2Cl)C1 ZINC000436581221 1041361102 /nfs/dbraw/zinc/36/11/02/1041361102.db2.gz FAJZIMZMZPKXKW-UHFFFAOYSA-N -1 1 336.218 4.014 20 0 EIADMM O=C(NC1CCC(c2ccccc2)CC1)c1c(F)ccc([O-])c1F ZINC000540318691 1041366934 /nfs/dbraw/zinc/36/69/34/1041366934.db2.gz QLTBJYQBUXCVIK-UHFFFAOYSA-N -1 1 331.362 4.127 20 0 EIADMM CC(C)Oc1cccc(CN(C)C(=O)c2ccc(Cl)cc2[O-])c1 ZINC000436607454 1041369968 /nfs/dbraw/zinc/36/99/68/1041369968.db2.gz OHZWTGQAUJBQRB-UHFFFAOYSA-N -1 1 333.815 4.105 20 0 EIADMM O=C(c1cc(Cl)ccc1[O-])N1CCC(Cc2ccc(F)cc2)CC1 ZINC000436625354 1041376499 /nfs/dbraw/zinc/37/64/99/1041376499.db2.gz OFKORBLSHYTNGM-UHFFFAOYSA-N -1 1 347.817 4.280 20 0 EIADMM CN(Cc1c(F)cccc1F)C(=O)c1ccc2ccccc2c1[O-] ZINC000436665311 1041405732 /nfs/dbraw/zinc/40/57/32/1041405732.db2.gz NOLBIPVVVJHVDQ-UHFFFAOYSA-N -1 1 327.330 4.096 20 0 EIADMM CC(C)c1occc1C(=O)N=c1cc(-c2ccc(Cl)s2)[n-][nH]1 ZINC000480583014 1041408187 /nfs/dbraw/zinc/40/81/87/1041408187.db2.gz GGNSQRKWCVRQHR-UHFFFAOYSA-N -1 1 335.816 4.182 20 0 EIADMM C[C@H](C1CCCCC1)N(C)C(=O)c1ccc(Br)cc1[O-] ZINC000436679676 1041417651 /nfs/dbraw/zinc/41/76/51/1041417651.db2.gz HHTUVRKXBYAAEM-LLVKDONJSA-N -1 1 340.261 4.196 20 0 EIADMM [O-]c1ccc(-c2nc(Cc3c[nH]c4cc(Cl)ccc34)no2)c(F)c1 ZINC000436692237 1041427731 /nfs/dbraw/zinc/42/77/31/1041427731.db2.gz XEJUPTBRIMHKOE-UHFFFAOYSA-N -1 1 343.745 4.307 20 0 EIADMM C[C@@H]1CN(C(=O)c2ccc(C(F)(F)F)cc2[O-])[C@H]2CCCC[C@@H]12 ZINC000436736007 1041446699 /nfs/dbraw/zinc/44/66/99/1041446699.db2.gz FJEPIBQKYWRXST-OSMZGAPFSA-N -1 1 327.346 4.062 20 0 EIADMM Cc1ccccc1CNc1ccccc1NC(=O)c1ccc(O)cc1[O-] ZINC000436742126 1041448668 /nfs/dbraw/zinc/44/86/68/1041448668.db2.gz VOLZDRKPXVAKOK-UHFFFAOYSA-N -1 1 348.402 4.271 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1CCc2[nH]c3ccccc3c2C1 ZINC000436757244 1041455550 /nfs/dbraw/zinc/45/55/50/1041455550.db2.gz RSABVAOUDOUFKJ-UHFFFAOYSA-N -1 1 342.398 4.225 20 0 EIADMM Cc1cccc(CN(Cc2ccco2)C(=O)c2cc(F)ccc2[O-])c1 ZINC000436759018 1041456428 /nfs/dbraw/zinc/45/64/28/1041456428.db2.gz QFWSRXUVUZFTQA-UHFFFAOYSA-N -1 1 339.366 4.275 20 0 EIADMM O=C(c1ccc(C(F)(F)F)cc1[O-])N1CCC[C@@H]1c1ccsc1 ZINC000436762227 1041460235 /nfs/dbraw/zinc/46/02/35/1041460235.db2.gz DEXLAPMXDRMIHO-CYBMUJFWSA-N -1 1 341.354 4.450 20 0 EIADMM COc1cc(C)c(NC(=O)c2ccc3ccccc3c2[O-])cc1OC ZINC000436747863 1041461354 /nfs/dbraw/zinc/46/13/54/1041461354.db2.gz PBUDGMKKXKPVTA-UHFFFAOYSA-N -1 1 337.375 4.123 20 0 EIADMM COc1ccc(C(=O)Nc2ccccc2-c2cccs2)c([O-])c1 ZINC000436754199 1041465158 /nfs/dbraw/zinc/46/51/58/1041465158.db2.gz HTPAONGEBPONII-UHFFFAOYSA-N -1 1 325.389 4.382 20 0 EIADMM CC[C@]1(C(=O)[O-])CCCN(Cc2ccc(F)c(Cl)c2Cl)C1 ZINC000904400333 1041467343 /nfs/dbraw/zinc/46/73/43/1041467343.db2.gz GMGNVSHUFCFFNH-HNNXBMFYSA-N -1 1 334.218 4.209 20 0 EIADMM O=C(Nc1ccc2c(c1)CCCC(=O)N2)c1cc2ccccc2cc1[O-] ZINC000436767920 1041475765 /nfs/dbraw/zinc/47/57/65/1041475765.db2.gz HDLQEXKAOITTED-UHFFFAOYSA-N -1 1 346.386 4.073 20 0 EIADMM Cn1cc(NC(=O)c2ccc3ccccc3c2[O-])c(-c2ccccc2)n1 ZINC000436817970 1041487014 /nfs/dbraw/zinc/48/70/14/1041487014.db2.gz ZDTACYYGQKANNO-UHFFFAOYSA-N -1 1 343.386 4.198 20 0 EIADMM CN(C(=O)c1ccc(C(F)(F)F)cc1[O-])c1ccc(F)c(Cl)c1 ZINC000436813148 1041493324 /nfs/dbraw/zinc/49/33/24/1041493324.db2.gz CXZAOYHBLFBKMA-UHFFFAOYSA-N -1 1 347.695 4.480 20 0 EIADMM CC(C)[C@@H]1N(C(=O)c2ccc(C(F)(F)F)cc2[O-])CC12CCC2 ZINC000436829689 1041495381 /nfs/dbraw/zinc/49/53/81/1041495381.db2.gz STQBITXSIFHGEW-AWEZNQCLSA-N -1 1 327.346 4.062 20 0 EIADMM CCc1ccc(C(=O)N(C)c2cccc(OC(F)(F)F)c2)c([O-])c1 ZINC000436819370 1041501162 /nfs/dbraw/zinc/50/11/62/1041501162.db2.gz IBSVXZHOBYDWIY-UHFFFAOYSA-N -1 1 339.313 4.130 20 0 EIADMM C[C@H]1C[C@@H]1c1ccc(CN(C(=O)c2ccc([O-])cc2F)C2CC2)o1 ZINC000436864061 1041522423 /nfs/dbraw/zinc/52/24/23/1041522423.db2.gz XDVUGNMKZUZPOG-ZBEGNZNMSA-N -1 1 329.371 4.053 20 0 EIADMM COc1ccc2c(c1)[C@H](c1nc(-c3ccc([O-])cc3Cl)no1)CC2 ZINC000436875898 1041532898 /nfs/dbraw/zinc/53/28/98/1041532898.db2.gz YYDMBTKZOKYGAH-CYBMUJFWSA-N -1 1 342.782 4.182 20 0 EIADMM CCOc1cc(-c2noc([C@H]3CCC(F)(F)C3)n2)cc(Cl)c1[O-] ZINC000436875864 1041533331 /nfs/dbraw/zinc/53/33/31/1041533331.db2.gz FUXRSRYDUOORSB-QMMMGPOBSA-N -1 1 344.745 4.397 20 0 EIADMM C[C@@H](CNC(=O)c1ccc([O-])cc1F)c1c(Cl)cccc1Cl ZINC000436881083 1041537541 /nfs/dbraw/zinc/53/75/41/1041537541.db2.gz QUDUBMWRCFJFKA-VIFPVBQESA-N -1 1 342.197 4.372 20 0 EIADMM C[C@H](Cc1ccc(Cl)cc1Cl)NC(=O)c1ccc([O-])cc1F ZINC000436881568 1041538708 /nfs/dbraw/zinc/53/87/08/1041538708.db2.gz SXVOLTQAVIWCPC-SECBINFHSA-N -1 1 342.197 4.199 20 0 EIADMM Cc1ccc(CN(Cc2ccco2)C(=O)c2ccc([O-])cc2F)s1 ZINC000436880789 1041539174 /nfs/dbraw/zinc/53/91/74/1041539174.db2.gz PXQRKHTXEPCLEJ-UHFFFAOYSA-N -1 1 345.395 4.337 20 0 EIADMM C[C@@H](Cc1cncc2ccccc21)c1nc(-c2ccc([O-])cc2F)no1 ZINC000436880499 1041539281 /nfs/dbraw/zinc/53/92/81/1041539281.db2.gz RHSNSUUJDWWUKX-LBPRGKRZSA-N -1 1 349.365 4.476 20 0 EIADMM [O-]c1ccc(Oc2ccccc2)cc1-c1nc(-c2cccnc2)no1 ZINC000436892737 1041545652 /nfs/dbraw/zinc/54/56/52/1041545652.db2.gz MPNHUOBZTWJRKM-UHFFFAOYSA-N -1 1 331.331 4.297 20 0 EIADMM C/C=C(/C)c1nc(-c2cc(Br)c([O-])c(OCC)c2)no1 ZINC000436907700 1041548672 /nfs/dbraw/zinc/54/86/72/1041548672.db2.gz STWBIQLLHQKVLX-YWEYNIOJSA-N -1 1 339.189 4.027 20 0 EIADMM CC[C@@H](C(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)c1ccc(F)cc1 ZINC000461697973 1041560889 /nfs/dbraw/zinc/56/08/89/1041560889.db2.gz IVUKFSUBIVGPTE-MRXNPFEDSA-N -1 1 339.370 4.054 20 0 EIADMM Cc1cc(Cc2noc(-c3cc(Oc4ccccc4)ccc3[O-])n2)no1 ZINC000436933060 1041563663 /nfs/dbraw/zinc/56/36/63/1041563663.db2.gz SBXVJQCKJXOFKR-UHFFFAOYSA-N -1 1 349.346 4.122 20 0 EIADMM Cc1ccccc1C1=CCN(C(=O)c2ccc3ccccc3c2[O-])C1 ZINC000436955839 1041574862 /nfs/dbraw/zinc/57/48/62/1041574862.db2.gz JAWCZUTUGFILGF-UHFFFAOYSA-N -1 1 329.399 4.393 20 0 EIADMM O=C(Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)c1ccc(-c2ccccc2)o1 ZINC000541522207 1041982602 /nfs/dbraw/zinc/98/26/02/1041982602.db2.gz KKWPXEYIGSYLTN-UHFFFAOYSA-N -1 1 345.358 4.295 20 0 EIADMM CCSCc1cccc([N-]S(=O)(=O)c2cccc(F)c2C)c1 ZINC000438760636 1042336827 /nfs/dbraw/zinc/33/68/27/1042336827.db2.gz LXIQPZIZQSSIJH-UHFFFAOYSA-N -1 1 339.457 4.188 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccccc2CC(F)(F)F)cc1C ZINC000172901109 1042511612 /nfs/dbraw/zinc/51/16/12/1042511612.db2.gz BFEKAKPMWSWSCL-UHFFFAOYSA-N -1 1 343.370 4.209 20 0 EIADMM O=C([O-])c1ccccc1C1CCN(Cc2sccc2Cl)CC1 ZINC000653377637 1042638921 /nfs/dbraw/zinc/63/89/21/1042638921.db2.gz UBXDEHQVACWQBI-UHFFFAOYSA-N -1 1 335.856 4.479 20 0 EIADMM COc1cc(-c2nc([C@H]3CCC(F)(F)C3)no2)cc(Cl)c1[O-] ZINC000439577073 1042697586 /nfs/dbraw/zinc/69/75/86/1042697586.db2.gz UMAHSSMWUMXYQD-ZETCQYMHSA-N -1 1 330.718 4.007 20 0 EIADMM O=S(=O)([N-]c1cc(F)c(F)cc1Cl)c1ccc(Cl)s1 ZINC000176725429 1042816713 /nfs/dbraw/zinc/81/67/13/1042816713.db2.gz DYECUJQBDRWVGD-UHFFFAOYSA-N -1 1 344.191 4.134 20 0 EIADMM CCOc1cc(C(=O)Nc2cnc(Cl)c(C)c2)cc(Cl)c1[O-] ZINC000186844969 1043083339 /nfs/dbraw/zinc/08/33/39/1043083339.db2.gz DXSRVFGXZKEUTR-UHFFFAOYSA-N -1 1 341.194 4.053 20 0 EIADMM Cc1c(=O)[n-]c(SCc2ccccc2F)nc1-c1ccccc1 ZINC000185051013 1043152061 /nfs/dbraw/zinc/15/20/61/1043152061.db2.gz UCLZXWZYIPEWMY-UHFFFAOYSA-N -1 1 326.396 4.177 20 0 EIADMM C[C@H](C(=O)Nc1ccc([O-])c(Cl)c1)c1cn(C)c2ccccc12 ZINC000185403061 1043180068 /nfs/dbraw/zinc/18/00/68/1043180068.db2.gz IXINQKGTDCWRQN-NSHDSACASA-N -1 1 328.799 4.280 20 0 EIADMM Cc1ccc(/C=C\S(=O)(=O)[N-]c2cccc3ccc(C)nc32)cc1 ZINC000727361348 1043205318 /nfs/dbraw/zinc/20/53/18/1043205318.db2.gz KLCYIRBJRBDWFT-SEYXRHQNSA-N -1 1 338.432 4.264 20 0 EIADMM [O-]c1cccc(CN2CCO[C@@H](c3ccccc3Cl)C2)c1Cl ZINC000508209831 1043305346 /nfs/dbraw/zinc/30/53/46/1043305346.db2.gz SCFHBABHTXDVIG-MRXNPFEDSA-N -1 1 338.234 4.273 20 0 EIADMM CC(C)c1ccccc1S(=O)(=O)[N-]c1cccc(-c2cnco2)c1 ZINC000188954961 1043392660 /nfs/dbraw/zinc/39/26/60/1043392660.db2.gz NWOVGLQEUMGMGN-UHFFFAOYSA-N -1 1 342.420 4.266 20 0 EIADMM O=C(c1c([O-])cccc1Cl)N1CCC[C@H](Cc2ccccc2)C1 ZINC000730035907 1043433483 /nfs/dbraw/zinc/43/34/83/1043433483.db2.gz UGKVQSICUDAMES-OAHLLOKOSA-N -1 1 329.827 4.141 20 0 EIADMM C[C@@H](c1ccc(C(=O)[O-])o1)N(C)Cc1ccccc1C(F)(F)F ZINC000521257453 1043670233 /nfs/dbraw/zinc/67/02/33/1043670233.db2.gz JYTUUEOKKLSYBJ-JTQLQIEISA-N -1 1 327.302 4.190 20 0 EIADMM O=C(Nc1cccc(NC(=O)C2CC2)c1)Nc1ccc([O-])c(Cl)c1 ZINC000190931437 1043748858 /nfs/dbraw/zinc/74/88/58/1043748858.db2.gz FMBUDBWKMWFSJH-UHFFFAOYSA-N -1 1 345.786 4.038 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)Nc1ccc(F)cc1OC(F)F ZINC000190970793 1043755619 /nfs/dbraw/zinc/75/56/19/1043755619.db2.gz KXQAPPKELVXDSQ-UHFFFAOYSA-N -1 1 346.692 4.430 20 0 EIADMM COc1c(F)ccc(Nc2ccc(F)c(Br)c2[O-])c1F ZINC001212505391 1043815735 /nfs/dbraw/zinc/81/57/35/1043815735.db2.gz HQRJYOCHARADGY-UHFFFAOYSA-N -1 1 348.118 4.324 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1ccc(-n2cccc2)c(F)c1 ZINC000732309842 1043895083 /nfs/dbraw/zinc/89/50/83/1043895083.db2.gz ZQOHMNNEWOQRBN-UHFFFAOYSA-N -1 1 330.746 4.228 20 0 EIADMM Cc1oc(-c2cccs2)nc1C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000732306672 1043895708 /nfs/dbraw/zinc/89/57/08/1043895708.db2.gz MRHMTMGAXSBTTR-UHFFFAOYSA-N -1 1 334.784 4.323 20 0 EIADMM CCOc1cc(-c2nc(-c3ccc(OC)cc3)no2)cc(Cl)c1[O-] ZINC000443109522 1044023008 /nfs/dbraw/zinc/02/30/08/1044023008.db2.gz ZALPTPBWTPYMCQ-UHFFFAOYSA-N -1 1 346.770 4.170 20 0 EIADMM CSCc1cccc([N-]S(=O)(=O)c2ccc3c(c2)CCCC3)c1 ZINC000521871426 1044039189 /nfs/dbraw/zinc/03/91/89/1044039189.db2.gz FTZYLLTZZFUQLR-UHFFFAOYSA-N -1 1 347.505 4.229 20 0 EIADMM CCOc1cc(-c2nc(-c3cc(C)cc(C)n3)no2)cc(Cl)c1[O-] ZINC000443214028 1044084361 /nfs/dbraw/zinc/08/43/61/1044084361.db2.gz LXAUCTLOHBHECN-UHFFFAOYSA-N -1 1 345.786 4.173 20 0 EIADMM C[C@@H]1C[C@H](NC(=O)c2c([O-])cccc2F)C[C@@H](c2ccccc2)C1 ZINC001299309839 1044346011 /nfs/dbraw/zinc/34/60/11/1044346011.db2.gz QITFSYWIJZSYDJ-BPUTZDHNSA-N -1 1 327.399 4.234 20 0 EIADMM C[C@@H]1C[C@@H](NC(=O)c2c([O-])cccc2F)C[C@H](c2ccccc2)C1 ZINC001299309842 1044347468 /nfs/dbraw/zinc/34/74/68/1044347468.db2.gz QITFSYWIJZSYDJ-NUEKZKHPSA-N -1 1 327.399 4.234 20 0 EIADMM CC(C)(C)OC(=O)Nc1ccc(-c2nc(C(C)(C)C)no2)c([O-])c1 ZINC000495065440 1044631971 /nfs/dbraw/zinc/63/19/71/1044631971.db2.gz HJMHOSPQEIVUGI-UHFFFAOYSA-N -1 1 333.388 4.087 20 0 EIADMM C[C@H]1CCCC[C@H]1OCc1nc(=O)c2c3ccccc3sc2[n-]1 ZINC000070694455 1044700481 /nfs/dbraw/zinc/70/04/81/1044700481.db2.gz BBRHKMDRCNTJNF-WCQYABFASA-N -1 1 328.437 4.233 20 0 EIADMM O=C([N-]c1cnoc1)c1csc(-c2cccc(C(F)(F)F)c2)n1 ZINC000624918950 1044820191 /nfs/dbraw/zinc/82/01/91/1044820191.db2.gz JMJSAMABUQYJAS-UHFFFAOYSA-N -1 1 339.298 4.069 20 0 EIADMM O=C(Nc1ccc(NC(=O)C2CC2)cc1)c1ccc2ccccc2c1[O-] ZINC000012436185 1044835002 /nfs/dbraw/zinc/83/50/02/1044835002.db2.gz GBBFKRIWGNJLFO-UHFFFAOYSA-N -1 1 346.386 4.146 20 0 EIADMM O=C([O-])CCC1CCN(Cc2ncc(-c3ccc(Cl)cc3)o2)CC1 ZINC000391995745 1045005522 /nfs/dbraw/zinc/00/55/22/1045005522.db2.gz GUXSVVBXRRWGRO-UHFFFAOYSA-N -1 1 348.830 4.072 20 0 EIADMM CCCc1cc(=O)[n-]c(SCc2ncc(-c3ccc(F)cc3)o2)n1 ZINC000302641110 1045187224 /nfs/dbraw/zinc/18/72/24/1045187224.db2.gz PJLTXXWBUZVCSA-UHFFFAOYSA-N -1 1 345.399 4.221 20 0 EIADMM Cc1cccc([C@H](C)C(=O)[N-]OCc2ccc(C(F)(F)F)cc2)c1 ZINC000746937433 1045553399 /nfs/dbraw/zinc/55/33/99/1045553399.db2.gz BPRWEIXLZSCOSA-ZDUSSCGKSA-N -1 1 337.341 4.365 20 0 EIADMM O=C(CCOc1ccc(Cl)cc1)Nc1ccc([O-])c(Cl)c1 ZINC000533540662 1045557371 /nfs/dbraw/zinc/55/73/71/1045557371.db2.gz WQCBHNHEUNJCCV-UHFFFAOYSA-N -1 1 326.179 4.107 20 0 EIADMM Cc1cc2cc([N-]S(=O)(=O)c3cc(F)cc(Cl)c3)ccc2[nH]1 ZINC000533692960 1045749222 /nfs/dbraw/zinc/74/92/22/1045749222.db2.gz MVMWEEVGSJJTIC-UHFFFAOYSA-N -1 1 338.791 4.070 20 0 EIADMM C[C@]1(c2noc(-c3cc(Oc4ccccc4)ccc3[O-])n2)CCCO1 ZINC000763314477 1045822088 /nfs/dbraw/zinc/82/20/88/1045822088.db2.gz BZEIAPXLBYIUIB-LJQANCHMSA-N -1 1 338.363 4.260 20 0 EIADMM Cc1ccc([C@@H]2CCN(C(=O)c3c([O-])cccc3Cl)C2)c(C)c1 ZINC000792550011 1045910761 /nfs/dbraw/zinc/91/07/61/1045910761.db2.gz GCYMHLVDIGKXHS-CQSZACIVSA-N -1 1 329.827 4.292 20 0 EIADMM CCCCOc1cc(OC)ccc1C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000769606294 1046031566 /nfs/dbraw/zinc/03/15/66/1046031566.db2.gz QCDRXYWCZBNCCO-UHFFFAOYSA-N -1 1 349.814 4.485 20 0 EIADMM CC(C)(C)OC(=O)Nc1ccccc1NC(=O)c1cc(F)ccc1[O-] ZINC000769760046 1046058718 /nfs/dbraw/zinc/05/87/18/1046058718.db2.gz SISIEAYJKDHYJM-UHFFFAOYSA-N -1 1 346.358 4.131 20 0 EIADMM C[C@@H]1CCCC[C@]1(C)[N-]S(=O)(=O)c1cc(Cl)sc1Cl ZINC001212077127 1046059469 /nfs/dbraw/zinc/05/94/69/1046059469.db2.gz GUZRYMOVVUQBLU-PELKAZGASA-N -1 1 342.313 4.302 20 0 EIADMM C[C@H]1CCCC[C@@]1(C)[N-]S(=O)(=O)c1cc(Cl)sc1Cl ZINC001212077129 1046060105 /nfs/dbraw/zinc/06/01/05/1046060105.db2.gz GUZRYMOVVUQBLU-QPUJVOFHSA-N -1 1 342.313 4.302 20 0 EIADMM CC(C)(C)c1ccc(-c2ccc(CN3CCC[C@@H]3C(=O)[O-])o2)cc1 ZINC000263403427 1046280694 /nfs/dbraw/zinc/28/06/94/1046280694.db2.gz IWNJWFIFVVAAFF-QGZVFWFLSA-N -1 1 327.424 4.293 20 0 EIADMM C[C@@H](CN(C)Cc1c(Cl)cccc1Oc1ccccc1)C(=O)[O-] ZINC000263528452 1046303206 /nfs/dbraw/zinc/30/32/06/1046303206.db2.gz VFJQSAAWWZYSED-ZDUSSCGKSA-N -1 1 333.815 4.285 20 0 EIADMM Cc1cccnc1[C@H]([NH2+]Cc1cccc(O)c1Br)C(C)C ZINC000459416907 1046642565 /nfs/dbraw/zinc/64/25/65/1046642565.db2.gz TYXAGGZSINWLCX-MRXNPFEDSA-N -1 1 349.272 4.345 20 0 EIADMM CCc1ccc(N(CC)C(=O)c2cc(Cl)c([O-])c(OC)c2)cc1 ZINC000785510366 1046712460 /nfs/dbraw/zinc/71/24/60/1046712460.db2.gz LICWHRIBGFHKON-UHFFFAOYSA-N -1 1 333.815 4.283 20 0 EIADMM Cc1c(=O)[n-]c(SCc2cnc(C3CC3)o2)nc1-c1ccccc1 ZINC000917467253 1046908702 /nfs/dbraw/zinc/90/87/02/1046908702.db2.gz CIKIRCRJBRUVOE-UHFFFAOYSA-N -1 1 339.420 4.315 20 0 EIADMM Cc1cccc([N-]S(=O)(=O)c2cc(Cl)ccc2Cl)c1F ZINC000537197793 1047019825 /nfs/dbraw/zinc/01/98/25/1047019825.db2.gz CUTZMYNQZMXTAV-UHFFFAOYSA-N -1 1 334.199 4.242 20 0 EIADMM O=C(Nc1ccc(Cl)c(OC(F)F)c1)c1c(F)ccc([O-])c1F ZINC000537263585 1047070933 /nfs/dbraw/zinc/07/09/33/1047070933.db2.gz CINYQQXTRPGURR-UHFFFAOYSA-N -1 1 349.667 4.178 20 0 EIADMM O=C([N-]c1ccccc1SCc1ccccc1)c1cnns1 ZINC000918215673 1047382040 /nfs/dbraw/zinc/38/20/40/1047382040.db2.gz INGXHHRAWQCRKW-UHFFFAOYSA-N -1 1 327.434 4.083 20 0 EIADMM Cc1nc(C(C)C)[n-]c(=O)c1C(=O)NC[C@@H]1CCCC[C@@H]1C(C)(C)C ZINC000747366119 1047392211 /nfs/dbraw/zinc/39/22/11/1047392211.db2.gz UKNYZUCHFCLKNR-GJZGRUSLSA-N -1 1 347.503 4.196 20 0 EIADMM O=C(Nc1nc(Cl)ccc1[O-])c1cc(C2CC2)nc2ccccc21 ZINC000789930156 1047485870 /nfs/dbraw/zinc/48/58/70/1047485870.db2.gz CGBUIFUKBVHVFQ-UHFFFAOYSA-N -1 1 339.782 4.119 20 0 EIADMM O=C(OCc1cnc(Cl)s1)c1ccc(Cl)c(Cl)c1[O-] ZINC000760516600 1047754971 /nfs/dbraw/zinc/75/49/71/1047754971.db2.gz SRVZAXJVAFAGEK-UHFFFAOYSA-N -1 1 338.599 4.166 20 0 EIADMM Cc1cc(F)cc(S(=O)(=O)[N-]c2cccc(CC(F)(F)F)c2)c1 ZINC000476422251 1047802913 /nfs/dbraw/zinc/80/29/13/1047802913.db2.gz GDQAUJGDNIGIEG-UHFFFAOYSA-N -1 1 347.333 4.040 20 0 EIADMM C[C@H]1CN(C(=O)c2ccc3ccccc3c2[O-])C[C@@H](c2ccccc2)O1 ZINC000130977047 1047818123 /nfs/dbraw/zinc/81/81/23/1047818123.db2.gz VEDQKFOEGWSSPX-YWZLYKJASA-N -1 1 347.414 4.148 20 0 EIADMM C[C@H](Sc1nc(C(F)(F)F)cc(=O)[n-]1)c1ncc(C(C)(C)C)o1 ZINC000476461259 1047819653 /nfs/dbraw/zinc/81/96/53/1047819653.db2.gz OGBFUDUAZUHMHU-ZETCQYMHSA-N -1 1 347.362 4.340 20 0 EIADMM CC[C@H](NC(=O)c1c([O-])cccc1Cl)c1ccc(F)cc1F ZINC001136848647 1047852303 /nfs/dbraw/zinc/85/23/03/1047852303.db2.gz LPPCYMPLEGFZSE-ZDUSSCGKSA-N -1 1 325.742 4.205 20 0 EIADMM Cc1cc(C[N-]C(=O)C(F)(F)F)cc(N[C@@H](C)c2ccccc2)c1 ZINC000825011693 1048010823 /nfs/dbraw/zinc/01/08/23/1048010823.db2.gz TUKGKACFJIWXGU-ZDUSSCGKSA-N -1 1 336.357 4.347 20 0 EIADMM CC[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)c1ccc(F)c([O-])c1 ZINC001137007912 1048056303 /nfs/dbraw/zinc/05/63/03/1048056303.db2.gz UMRNEPALRITMEG-AEFFLSMTSA-N -1 1 327.399 4.330 20 0 EIADMM COc1ccccc1C[C@H](C)N(C)C(=O)c1cc2ccccc2cc1[O-] ZINC000131957548 1048173498 /nfs/dbraw/zinc/17/34/98/1048173498.db2.gz OVJFWOHSUVMSOU-HNNXBMFYSA-N -1 1 349.430 4.257 20 0 EIADMM COc1c(Cl)cccc1[N-]S(=O)(=O)/C=C\c1ccc(C)cc1 ZINC000919959946 1048345099 /nfs/dbraw/zinc/34/50/99/1048345099.db2.gz IFRULTHAFKVDFR-KHPPLWFESA-N -1 1 337.828 4.070 20 0 EIADMM [O-]c1cccc(CNc2cnn(-c3ccccc3Cl)c2)c1Cl ZINC000815133840 1048360678 /nfs/dbraw/zinc/36/06/78/1048360678.db2.gz YOZKMBXDZJILHI-UHFFFAOYSA-N -1 1 334.206 4.497 20 0 EIADMM O=S(=O)([N-]c1ccc2scnc2c1)c1ccc2ccccc2c1 ZINC000499229619 1048458291 /nfs/dbraw/zinc/45/82/91/1048458291.db2.gz PMVUEPGDHASKTO-UHFFFAOYSA-N -1 1 340.429 4.250 20 0 EIADMM Cc1c(Cl)cccc1S(=O)(=O)[N-]c1ccc2scnc2c1 ZINC000499236851 1048468099 /nfs/dbraw/zinc/46/80/99/1048468099.db2.gz ZSLFYKONSMBMTO-UHFFFAOYSA-N -1 1 338.841 4.059 20 0 EIADMM [O-]c1ccc(F)cc1-c1nc(-c2ccccc2Br)no1 ZINC000132987897 1048556891 /nfs/dbraw/zinc/55/68/91/1048556891.db2.gz RHPQTINKULZMDJ-UHFFFAOYSA-N -1 1 335.132 4.011 20 0 EIADMM O=C(N[C@@H]1CCSc2c(F)cccc21)c1c([O-])cccc1Cl ZINC000920431492 1048678714 /nfs/dbraw/zinc/67/87/14/1048678714.db2.gz GZMKRHCQNSGZBM-GFCCVEGCSA-N -1 1 337.803 4.152 20 0 EIADMM [O-]c1cc(F)c(CN(Cc2ccccc2)Cc2ccncc2)c(F)c1 ZINC001144541683 1048719112 /nfs/dbraw/zinc/71/91/12/1048719112.db2.gz JTSMTXUSINLRPA-UHFFFAOYSA-N -1 1 340.373 4.268 20 0 EIADMM [O-]c1cc(F)c(CN2CCC[C@@H]2c2ccc(F)cc2F)c(F)c1 ZINC001144561849 1048731196 /nfs/dbraw/zinc/73/11/96/1048731196.db2.gz OXAQQUSCOQIQLB-QGZVFWFLSA-N -1 1 325.305 4.286 20 0 EIADMM O=C([N-]c1nc(-c2ccccc2)cs1)c1ocnc1C(F)(F)F ZINC001135607859 1048821654 /nfs/dbraw/zinc/82/16/54/1048821654.db2.gz UWTAHOUFQJSRDJ-UHFFFAOYSA-N -1 1 339.298 4.069 20 0 EIADMM Cc1cc([C@H]2CCCN2Cc2c3ccccc3sc2C(=O)[O-])no1 ZINC000846236607 1048845998 /nfs/dbraw/zinc/84/59/98/1048845998.db2.gz UXVLHIVJWSDXFZ-OAHLLOKOSA-N -1 1 342.420 4.233 20 0 EIADMM CCOc1cccc2cc([C@H](C)NC(=O)c3ccc([O-])cc3F)oc21 ZINC001135662392 1048853317 /nfs/dbraw/zinc/85/33/17/1048853317.db2.gz RPBYSSKXXXKDJA-NSHDSACASA-N -1 1 343.354 4.167 20 0 EIADMM CC[C@H]([N-]C(=O)C(F)(F)c1ccccc1OC(C)C)C(F)(F)F ZINC000846994011 1048971741 /nfs/dbraw/zinc/97/17/41/1048971741.db2.gz QFGYEBKAHZBDKW-LBPRGKRZSA-N -1 1 339.304 4.023 20 0 EIADMM C[C@H](OCCCNC(=O)c1cc2ccccc2cc1[O-])c1ccccc1 ZINC001135954193 1049021377 /nfs/dbraw/zinc/02/13/77/1049021377.db2.gz NOTIGYBGNNWJIT-INIZCTEOSA-N -1 1 349.430 4.443 20 0 EIADMM O=C(N[C@@H]1CC[C@@H]2CCCC[C@H]2C1)c1ccc(C(F)(F)F)c([O-])c1 ZINC001136019207 1049041428 /nfs/dbraw/zinc/04/14/28/1049041428.db2.gz MNHISFTYHAMCPG-SGMGOOAPSA-N -1 1 341.373 4.500 20 0 EIADMM O=C(NCCCCc1ccccc1)c1ccc(C(F)(F)F)c([O-])c1 ZINC001136110205 1049088199 /nfs/dbraw/zinc/08/81/99/1049088199.db2.gz BYUNPCGLBJYSDL-UHFFFAOYSA-N -1 1 337.341 4.164 20 0 EIADMM CC[C@H](C)c1ccc([C@@H](NC(=O)c2cncc([O-])c2)C(C)C)cc1 ZINC001136136771 1049146370 /nfs/dbraw/zinc/14/63/70/1049146370.db2.gz UAWGWEUJWDELMZ-LIRRHRJNSA-N -1 1 326.440 4.428 20 0 EIADMM Cc1ccc(O[C@@H](C)CNC(=O)c2ccc3ccccc3c2[O-])cc1 ZINC001148075764 1049258509 /nfs/dbraw/zinc/25/85/09/1049258509.db2.gz JOBCHSFRVZXRBX-HNNXBMFYSA-N -1 1 335.403 4.051 20 0 EIADMM CC[C@H](NC(=O)c1ccc(F)c([O-])c1)c1ccccc1OC(F)F ZINC001136191608 1049270265 /nfs/dbraw/zinc/27/02/65/1049270265.db2.gz UJWMSYKOCLJRDZ-ZDUSSCGKSA-N -1 1 339.313 4.014 20 0 EIADMM O=S(=O)(/C=C\c1ccccc1Cl)[N-]c1cc(C2CC2)ccn1 ZINC000811837762 1049287377 /nfs/dbraw/zinc/28/73/77/1049287377.db2.gz COKKNIKOHVATQI-NTMALXAHSA-N -1 1 334.828 4.025 20 0 EIADMM COc1cncc(C(=O)Nc2cc(Cl)c([O-])c3ccccc23)c1C ZINC001148251807 1049288601 /nfs/dbraw/zinc/28/86/01/1049288601.db2.gz BSXZWKBMSUAFEZ-UHFFFAOYSA-N -1 1 342.782 4.163 20 0 EIADMM Cc1ccc(CC(=O)Nc2cc(Cl)c([O-])c3ccccc23)cc1O ZINC001148251690 1049290149 /nfs/dbraw/zinc/29/01/49/1049290149.db2.gz AHTXOPOGTMCHGC-UHFFFAOYSA-N -1 1 341.794 4.394 20 0 EIADMM CC(C)(C)[C@@H]1CCCN1C(=O)c1cc(-c2ccc(C=O)o2)ccc1[O-] ZINC001148541257 1049330981 /nfs/dbraw/zinc/33/09/81/1049330981.db2.gz LDRAVVIBRSUAAS-SFHVURJKSA-N -1 1 341.407 4.115 20 0 EIADMM O=C(NCCc1cccc(-c2ccccc2)c1)c1cc(F)ccc1[O-] ZINC001148733024 1049363234 /nfs/dbraw/zinc/36/32/34/1049363234.db2.gz JHSNPXMDNNXGCI-UHFFFAOYSA-N -1 1 335.378 4.171 20 0 EIADMM Cc1cnc(Cl)c(NC(=O)c2ccc(C(F)(F)F)cc2[O-])c1 ZINC001148790482 1049372966 /nfs/dbraw/zinc/37/29/66/1049372966.db2.gz LYLWLTDMPZMGAE-UHFFFAOYSA-N -1 1 330.693 4.020 20 0 EIADMM Nc1cccc2cccc(NC(=O)c3ccc(C(F)(F)F)cc3[O-])c12 ZINC001148801293 1049382484 /nfs/dbraw/zinc/38/24/84/1049382484.db2.gz XXMRKLALUOZGSB-UHFFFAOYSA-N -1 1 346.308 4.399 20 0 EIADMM O=C(Nc1cc(O)cc(Cl)c1)c1ccc(C(F)(F)F)cc1[O-] ZINC001148800531 1049382848 /nfs/dbraw/zinc/38/28/48/1049382848.db2.gz FUGINYWGTTVROS-UHFFFAOYSA-N -1 1 331.677 4.022 20 0 EIADMM O=C(N[C@@H]1CCCc2cccnc21)c1cccc(-c2ccccc2)c1[O-] ZINC001148873479 1049386794 /nfs/dbraw/zinc/38/67/94/1049386794.db2.gz WCEFWCFUSPZMKK-LJQANCHMSA-N -1 1 344.414 4.262 20 0 EIADMM O=Cc1ccc(-c2ccc([O-])c(C(=O)N(C3CCC3)C3CCC3)c2)o1 ZINC000820356289 1049485262 /nfs/dbraw/zinc/48/52/62/1049485262.db2.gz ZQOADNCYEDGNDU-UHFFFAOYSA-N -1 1 339.391 4.012 20 0 EIADMM CCc1cc2c(CN3C[C@H](C)c4ccccc43)cc(=O)oc2cc1[O-] ZINC001171352133 1049506684 /nfs/dbraw/zinc/50/66/84/1049506684.db2.gz BJPGGFFSVPQUHP-ZDUSSCGKSA-N -1 1 335.403 4.185 20 0 EIADMM Brc1ccc2c(c1)C=CN1C=C(NC3=CC=C[CH]3)C=CN21 ZINC001171363007 1049511832 /nfs/dbraw/zinc/51/18/32/1049511832.db2.gz JFPJUOJBAFIGAG-UHFFFAOYSA-N -1 1 339.216 4.073 20 0 EIADMM O=C(Nc1cccc(COCc2ccco2)c1)c1cc(F)ccc1[O-] ZINC000080003456 1049542198 /nfs/dbraw/zinc/54/21/98/1049542198.db2.gz CJBFNUGCVMQNRF-UHFFFAOYSA-N -1 1 341.338 4.093 20 0 EIADMM CC1(C)CN(C(=O)c2ncc3ccccc3c2[O-])[C@@H]1c1ccccc1 ZINC001136400947 1049585115 /nfs/dbraw/zinc/58/51/15/1049585115.db2.gz FSDSOFLLABJWEQ-LJQANCHMSA-N -1 1 332.403 4.164 20 0 EIADMM O=C(Cc1csc(C2CCCC2)n1)Nc1ccc([O-])c(Cl)c1 ZINC000821148442 1049608887 /nfs/dbraw/zinc/60/88/87/1049608887.db2.gz RKPWAWXUNZBHEW-UHFFFAOYSA-N -1 1 336.844 4.341 20 0 EIADMM CCCN(C(=O)c1ccc([O-])cc1F)[C@H](C)c1ccccc1OC ZINC001136437589 1049626436 /nfs/dbraw/zinc/62/64/36/1049626436.db2.gz LQLQECGJJLZNDS-CYBMUJFWSA-N -1 1 331.387 4.153 20 0 EIADMM CC(C)[C@H]1CC[C@@H](C)C[C@@H]1CNC(=O)Cc1ccc([O-])c(Cl)c1 ZINC001136488291 1049676180 /nfs/dbraw/zinc/67/61/80/1049676180.db2.gz KEKCURNHOTXDGB-FVQBIDKESA-N -1 1 337.891 4.413 20 0 EIADMM CC(C)c1ccc(C(=O)Nc2ccc(OC3CCCC3)nc2)c([O-])c1 ZINC001136547758 1049737213 /nfs/dbraw/zinc/73/72/13/1049737213.db2.gz JOEXQPIDRBKZMT-UHFFFAOYSA-N -1 1 340.423 4.484 20 0 EIADMM O=C(C[C@H](c1ccccc1)C(F)(F)F)Nc1cccc(F)c1[O-] ZINC001171632938 1049763404 /nfs/dbraw/zinc/76/34/04/1049763404.db2.gz XVQYDNTWFLQWKE-LLVKDONJSA-N -1 1 327.277 4.206 20 0 EIADMM CCC[C@H](NC(=O)c1ccc(C(F)(F)F)c([O-])c1)c1ccccn1 ZINC001136680798 1049827853 /nfs/dbraw/zinc/82/78/53/1049827853.db2.gz UJVYBVWNIFJXIC-AWEZNQCLSA-N -1 1 338.329 4.077 20 0 EIADMM CCC[C@@H](NC(=O)c1ccc(C(F)(F)F)c([O-])c1)c1ccccn1 ZINC001136680799 1049828136 /nfs/dbraw/zinc/82/81/36/1049828136.db2.gz UJVYBVWNIFJXIC-CQSZACIVSA-N -1 1 338.329 4.077 20 0 EIADMM O=C(c1ccc(F)c([O-])c1)N1CCCC[C@@H]1c1cc2ccccc2[nH]1 ZINC001136733787 1049858567 /nfs/dbraw/zinc/85/85/67/1049858567.db2.gz GYASANIENLYGNK-GOSISDBHSA-N -1 1 338.382 4.380 20 0 EIADMM CC[C@H]1CC[C@@H](C)N1C(=O)c1ccc(NC(=O)OC(C)(C)C)cc1[O-] ZINC000772872442 1049859766 /nfs/dbraw/zinc/85/97/66/1049859766.db2.gz MWFKYSNSDKBXGV-OCCSQVGLSA-N -1 1 348.443 4.142 20 0 EIADMM Cc1ccc(-c2noc(-c3n[n-]nc3C(F)(F)F)n2)c2ccccc12 ZINC001212652977 1049881635 /nfs/dbraw/zinc/88/16/35/1049881635.db2.gz RDFWNIFZUDDNTG-UHFFFAOYSA-N -1 1 345.284 4.002 20 0 EIADMM O=C([N-]c1c(F)cc(Cl)cc1F)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000180347665 1049883594 /nfs/dbraw/zinc/88/35/94/1049883594.db2.gz QFMGGEOXUXUVAP-UHFFFAOYSA-N -1 1 347.104 4.432 20 0 EIADMM CCOc1cc(C(=O)N2[C@H](C)C[C@H]3CCCC[C@H]32)cc(Cl)c1[O-] ZINC000248853438 1050081029 /nfs/dbraw/zinc/08/10/29/1050081029.db2.gz BYTHZKBAGAOGIN-LALPHHSUSA-N -1 1 337.847 4.238 20 0 EIADMM CCc1onc(C)c1[N-]C(=O)c1cc(-c2cccc(Cl)c2)on1 ZINC000089445485 1050118860 /nfs/dbraw/zinc/11/88/60/1050118860.db2.gz ZEAOMMHYVSCMCL-UHFFFAOYSA-N -1 1 331.759 4.106 20 0 EIADMM Cc1c(F)cccc1S(=O)(=O)[N-]c1ccc(F)c2ccccc12 ZINC001185837025 1050168471 /nfs/dbraw/zinc/16/84/71/1050168471.db2.gz QIQBXUTUKDVIAJ-UHFFFAOYSA-N -1 1 333.359 4.227 20 0 EIADMM O=C(Nc1cc(-c2ccc(Cl)s2)on1)c1ccc([O-])c(F)c1 ZINC001186208390 1050272838 /nfs/dbraw/zinc/27/28/38/1050272838.db2.gz CPLKKGCUPOPFSM-UHFFFAOYSA-N -1 1 338.747 4.154 20 0 EIADMM O=C(Nc1ccccc1-c1ccc(Cl)cn1)c1ccc([O-])cc1F ZINC001186329181 1050287919 /nfs/dbraw/zinc/28/79/19/1050287919.db2.gz NLZRODABVQTBGB-UHFFFAOYSA-N -1 1 342.757 4.499 20 0 EIADMM CC(=O)OCc1cccc(Cl)c1Nc1cc(F)c([O-])c(F)c1 ZINC001212777671 1050290589 /nfs/dbraw/zinc/29/05/89/1050290589.db2.gz XNKXRPSSZFHVIM-UHFFFAOYSA-N -1 1 327.714 4.131 20 0 EIADMM C[C@@H](NC(=O)Nc1cccc([O-])c1Br)C1CCCCC1 ZINC001186347527 1050305405 /nfs/dbraw/zinc/30/54/05/1050305405.db2.gz KKDPUEVGZYTVMB-SNVBAGLBSA-N -1 1 341.249 4.245 20 0 EIADMM CC(C)[C@@H](Cc1ccccc1)NC(=O)c1ccc2ccc(O)cc2c1[O-] ZINC001177910896 1050323709 /nfs/dbraw/zinc/32/37/09/1050323709.db2.gz DAIXHSJZENWWIF-HXUWFJFHSA-N -1 1 349.430 4.248 20 0 EIADMM [O-]c1cnccc1-c1nc(-c2ccc(C(F)(F)F)cc2Cl)no1 ZINC001212721534 1050433945 /nfs/dbraw/zinc/43/39/45/1050433945.db2.gz VWAUSCXTYFKYJU-UHFFFAOYSA-N -1 1 341.676 4.176 20 0 EIADMM CCC(C)(C)c1ccccc1C(=O)NCCc1c(F)cc([O-])cc1F ZINC001178784671 1050554200 /nfs/dbraw/zinc/55/42/00/1050554200.db2.gz AXZZGQZVKPSMAK-UHFFFAOYSA-N -1 1 347.405 4.331 20 0 EIADMM CS(=O)(=O)c1ccc([O-])c(Nc2cccc(-c3ccccc3)c2)c1 ZINC001173912200 1050623206 /nfs/dbraw/zinc/62/32/06/1050623206.db2.gz SWBXREHPFGRJFR-UHFFFAOYSA-N -1 1 339.416 4.206 20 0 EIADMM COc1ccc(C(C)C)cc1Nc1cc2ccc([O-])cc2oc1=O ZINC001173915720 1050627052 /nfs/dbraw/zinc/62/70/52/1050627052.db2.gz CYXWWDSQKYUJCU-UHFFFAOYSA-N -1 1 325.364 4.374 20 0 EIADMM Cc1ccc([S@](C)(=O)=NC(=O)c2cc3sccc3c([O-])c2)cc1 ZINC001179389845 1050689585 /nfs/dbraw/zinc/68/95/85/1050689585.db2.gz VFHFMLFFADTCDT-QHCPKHFHSA-N -1 1 345.445 4.212 20 0 EIADMM C[C@@H](CC(=O)Nc1cc(F)c([O-])cc1Cl)c1ccc(F)cc1 ZINC001179655624 1050738026 /nfs/dbraw/zinc/73/80/26/1050738026.db2.gz IPBWFQGWAXCBOK-VIFPVBQESA-N -1 1 325.742 4.456 20 0 EIADMM O=C(CCCc1ccc(F)cc1)Nc1cc(F)c([O-])cc1Cl ZINC001179660354 1050739995 /nfs/dbraw/zinc/73/99/95/1050739995.db2.gz QWQMHVRCASUDRD-UHFFFAOYSA-N -1 1 325.742 4.285 20 0 EIADMM O=C(Nc1cc(F)c([O-])cc1Cl)c1nc(Cl)sc1Cl ZINC001179660330 1050740086 /nfs/dbraw/zinc/74/00/86/1050740086.db2.gz QEIRFNWYQITJOJ-UHFFFAOYSA-N -1 1 341.578 4.200 20 0 EIADMM COc1ccc(NC(=O)Nc2ccc(Cl)cc2[O-])cc1Cl ZINC001188472662 1050781923 /nfs/dbraw/zinc/78/19/23/1050781923.db2.gz LBKWVPSKCSLYQG-UHFFFAOYSA-N -1 1 327.167 4.352 20 0 EIADMM CC1CCN(C(=O)c2ccc(Nc3ccnc(Cl)c3[O-])cc2)CC1 ZINC001174159530 1050798634 /nfs/dbraw/zinc/79/86/34/1050798634.db2.gz LWXZNNNGBFVSCN-UHFFFAOYSA-N -1 1 345.830 4.056 20 0 EIADMM Nc1cccc2cccc(NC(=O)c3ccc([O-])c(C(F)(F)F)c3)c12 ZINC001188587358 1050808971 /nfs/dbraw/zinc/80/89/71/1050808971.db2.gz TTZJTWQZQDZRKL-UHFFFAOYSA-N -1 1 346.308 4.399 20 0 EIADMM COc1ccccc1C/C(C)=C/C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000182872397 1050867920 /nfs/dbraw/zinc/86/79/20/1050867920.db2.gz RVVWVEMMBJOADG-ZRDIBKRKSA-N -1 1 331.799 4.182 20 0 EIADMM Cc1c(=O)[n-]c(SCc2ncccc2Cl)nc1-c1ccccc1 ZINC001189102748 1050909505 /nfs/dbraw/zinc/90/95/05/1050909505.db2.gz DKMKCKLWORTYSY-UHFFFAOYSA-N -1 1 343.839 4.498 20 0 EIADMM CC(=O)c1cccc(S(=O)(=O)[N-]c2ccc(C(C)C)c(C)c2)c1 ZINC001189229646 1050930946 /nfs/dbraw/zinc/93/09/46/1050930946.db2.gz SPOXRQHVBFCXON-UHFFFAOYSA-N -1 1 331.437 4.122 20 0 EIADMM Cc1cc(NCc2ccc([O-])c(F)c2F)cnc1N1CCCC[C@H]1C ZINC001180301643 1050945145 /nfs/dbraw/zinc/94/51/45/1050945145.db2.gz OKPFDFZLBZVRQM-CYBMUJFWSA-N -1 1 347.409 4.365 20 0 EIADMM CC(C)(C)[C@H]1CCC[C@H]([N-]S(=O)(=O)c2cc(F)ccc2F)CC1 ZINC001189289491 1050948822 /nfs/dbraw/zinc/94/88/22/1050948822.db2.gz OLTXCRUHWSBHGI-JSGCOSHPSA-N -1 1 345.455 4.238 20 0 EIADMM O=S(=O)([N-]c1ccc(Cl)cc1)c1ccc(F)c2ccccc21 ZINC001189347452 1050957425 /nfs/dbraw/zinc/95/74/25/1050957425.db2.gz GISPZUKTHCEDKK-UHFFFAOYSA-N -1 1 335.787 4.433 20 0 EIADMM Cc1cc(F)cc([N-]S(=O)(=O)c2ccc(F)c3ccccc32)c1 ZINC001189385312 1050976460 /nfs/dbraw/zinc/97/64/60/1050976460.db2.gz KBNYJQLCFJPMNL-UHFFFAOYSA-N -1 1 333.359 4.227 20 0 EIADMM C=Cc1ccc([N-]S(=O)(=O)c2ccc(F)c3ccccc32)cc1 ZINC001189387730 1050977256 /nfs/dbraw/zinc/97/72/56/1050977256.db2.gz AEHXKIAEAXKKJW-UHFFFAOYSA-N -1 1 327.380 4.423 20 0 EIADMM [O-]c1c(Br)ccc(Cl)c1Nc1ccnc2[nH]ccc21 ZINC001174413331 1050988513 /nfs/dbraw/zinc/98/85/13/1050988513.db2.gz WALMHUMFULQNEV-UHFFFAOYSA-N -1 1 338.592 4.380 20 0 EIADMM CCCCc1ccc(C(=O)CSc2nc(CC)c(C)c(=O)[n-]2)cc1 ZINC001189495077 1051000901 /nfs/dbraw/zinc/00/09/01/1051000901.db2.gz CXHQOCOSDXIIMK-UHFFFAOYSA-N -1 1 344.480 4.371 20 0 EIADMM CNc1ncc2cc(Nc3cc(Cl)c([O-])cc3Cl)ccc2n1 ZINC001174534776 1051029020 /nfs/dbraw/zinc/02/90/20/1051029020.db2.gz BLHMEBJZDUFYJW-UHFFFAOYSA-N -1 1 335.194 4.428 20 0 EIADMM COc1ccc(-c2nc3ccc(Oc4ccccc4)cc3c(=O)[n-]2)cc1 ZINC000620127596 1051030997 /nfs/dbraw/zinc/03/09/97/1051030997.db2.gz VVEAPCAUQMHDRJ-UHFFFAOYSA-N -1 1 344.370 4.391 20 0 EIADMM [O-]c1c(Cl)c(Cl)ccc1Nc1cnn([C@H]2CCCCO2)c1 ZINC001174603768 1051102915 /nfs/dbraw/zinc/10/29/15/1051102915.db2.gz FOMAQSLRNVGHPQ-GFCCVEGCSA-N -1 1 328.199 4.338 20 0 EIADMM O=C(NCc1ccc(Cl)cc1Cl)Nc1cc(F)cc(F)c1[O-] ZINC001190098749 1051113605 /nfs/dbraw/zinc/11/36/05/1051113605.db2.gz SELRVBRMJHRWJD-UHFFFAOYSA-N -1 1 347.148 4.299 20 0 EIADMM O=C(CSc1nc(-c2ccccc2)cc(=O)[n-]1)C1CCCCCC1 ZINC001190201623 1051136780 /nfs/dbraw/zinc/13/67/80/1051136780.db2.gz VBZOJIMQORCIGS-UHFFFAOYSA-N -1 1 342.464 4.481 20 0 EIADMM CCC(C)(C)c1ccc(S(=O)(=O)[N-]c2cccc([C@@H](C)O)c2)cc1 ZINC001190423354 1051180974 /nfs/dbraw/zinc/18/09/74/1051180974.db2.gz SLBRFGIQEPFPQS-CQSZACIVSA-N -1 1 347.480 4.228 20 0 EIADMM Cc1cc([N-]S(=O)(=O)c2ccc(C3CC3)cc2)c2ccsc2n1 ZINC001190480233 1051184814 /nfs/dbraw/zinc/18/48/14/1051184814.db2.gz FFHMCSTXLXXSQR-UHFFFAOYSA-N -1 1 344.461 4.283 20 0 EIADMM Cc1nc2cc([N-]S(=O)(=O)c3ccc(C4CC4)cc3)ccc2s1 ZINC001190463634 1051192392 /nfs/dbraw/zinc/19/23/92/1051192392.db2.gz HYIYUXCLCVBOCE-UHFFFAOYSA-N -1 1 344.461 4.283 20 0 EIADMM Cc1ccc2c([N-]S(=O)(=O)c3ccc(C4CC4)cc3)cccc2n1 ZINC001190499823 1051196153 /nfs/dbraw/zinc/19/61/53/1051196153.db2.gz KGUSUGNVIYAGAW-UHFFFAOYSA-N -1 1 338.432 4.221 20 0 EIADMM COc1cc(F)c(Nc2ccc(F)c(Br)c2[O-])cc1F ZINC001174930658 1051231775 /nfs/dbraw/zinc/23/17/75/1051231775.db2.gz NFNYNUZYFNAMIS-UHFFFAOYSA-N -1 1 348.118 4.324 20 0 EIADMM Cc1cc(C)c(NC(=O)Nc2ccc(-n3ccc(=O)[n-]3)cc2)c(C)c1 ZINC001181726436 1051285126 /nfs/dbraw/zinc/28/51/26/1051285126.db2.gz QGYRWDAGHYFERI-UHFFFAOYSA-N -1 1 336.395 4.147 20 0 EIADMM COc1cc(Nc2ccc(F)c(Br)c2[O-])cc(OC)c1 ZINC001175109714 1051354228 /nfs/dbraw/zinc/35/42/28/1051354228.db2.gz ZKAJDWXFNKONOQ-UHFFFAOYSA-N -1 1 342.164 4.055 20 0 EIADMM CCOc1ccc(C)cc1NC(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC001191147454 1051364184 /nfs/dbraw/zinc/36/41/84/1051364184.db2.gz RBYCVBMGKWPWNU-UHFFFAOYSA-N -1 1 335.787 4.014 20 0 EIADMM Cc1nsc([N-]c2c(F)cc(OCc3ccccc3)cc2F)n1 ZINC001175147758 1051413913 /nfs/dbraw/zinc/41/39/13/1051413913.db2.gz WGULJHAMEBXVIS-UHFFFAOYSA-N -1 1 333.363 4.447 20 0 EIADMM Cc1ccc(-c2nc(C(=O)[N-]c3c(C)noc3C3CC3)cs2)o1 ZINC000156550722 1051539637 /nfs/dbraw/zinc/53/96/37/1051539637.db2.gz NUQMCUBRAPUGEX-UHFFFAOYSA-N -1 1 329.381 4.138 20 0 EIADMM CC(C)(C)Oc1cccc(CCC(=O)Nc2ccc([O-])c(Cl)c2)n1 ZINC000156556723 1051542649 /nfs/dbraw/zinc/54/26/49/1051542649.db2.gz RMBIGSRRWDEGQC-UHFFFAOYSA-N -1 1 348.830 4.189 20 0 EIADMM Cc1noc(C2CC2)c1[N-]C(=O)c1csc(-c2cccs2)n1 ZINC000156613835 1051548272 /nfs/dbraw/zinc/54/82/72/1051548272.db2.gz CMZAJQQBMWLTJH-UHFFFAOYSA-N -1 1 331.422 4.298 20 0 EIADMM COc1ccc2cc(S(=O)(=O)[N-]c3cccc(F)c3C)ccc2c1 ZINC001191932516 1051585670 /nfs/dbraw/zinc/58/56/70/1051585670.db2.gz QXHKHHWPJIAYJE-UHFFFAOYSA-N -1 1 345.395 4.097 20 0 EIADMM COc1cc(C(=O)Nc2ccc([O-])c(Cl)c2)cc(OC)c1C(C)C ZINC000781348972 1051661064 /nfs/dbraw/zinc/66/10/64/1051661064.db2.gz RAWNCVMVNGKZLB-UHFFFAOYSA-N -1 1 349.814 4.439 20 0 EIADMM O=C(Nc1cccc2c(Cl)ccnc12)c1c(F)ccc([O-])c1F ZINC001192540279 1051763276 /nfs/dbraw/zinc/76/32/76/1051763276.db2.gz UJCRTCALFSFQHC-UHFFFAOYSA-N -1 1 334.709 4.124 20 0 EIADMM Cc1c(NC(=O)c2cc([O-])cc(F)c2F)snc1-c1ccccc1 ZINC001192661371 1051794715 /nfs/dbraw/zinc/79/47/15/1051794715.db2.gz UUOKTHUDIIUXDC-UHFFFAOYSA-N -1 1 346.358 4.355 20 0 EIADMM O=C(Nc1nc(Cl)ccc1[O-])C1(Cc2ccccc2Cl)CC1 ZINC001183217478 1051807204 /nfs/dbraw/zinc/80/72/04/1051807204.db2.gz DBQNVRMJHGVLTG-UHFFFAOYSA-N -1 1 337.206 4.055 20 0 EIADMM C[C@H](Oc1cccc(C(C)(C)C)c1)C(=O)Nc1nc(Cl)ccc1[O-] ZINC001183210281 1051810759 /nfs/dbraw/zinc/81/07/59/1051810759.db2.gz UGVWIKRJEPNAJF-NSHDSACASA-N -1 1 348.830 4.144 20 0 EIADMM O=C(Nc1ccc([C@H](F)C(F)(F)F)cc1)c1cc(F)ccc1[O-] ZINC001175873949 1051831562 /nfs/dbraw/zinc/83/15/62/1051831562.db2.gz SEZGEYCNSGOCLL-ZDUSSCGKSA-N -1 1 331.240 4.357 20 0 EIADMM CCCCCc1nnc([N-]C(=O)c2c(F)ccc(F)c2Cl)s1 ZINC000621429831 1051862892 /nfs/dbraw/zinc/86/28/92/1051862892.db2.gz CYRNGYFWGGBRSC-UHFFFAOYSA-N -1 1 345.802 4.455 20 0 EIADMM [O-]c1c(Br)ccc(Cl)c1Nc1cccc2c1OCC2 ZINC001176077348 1051888303 /nfs/dbraw/zinc/88/83/03/1051888303.db2.gz OKLCKQLHWOFNLU-UHFFFAOYSA-N -1 1 340.604 4.487 20 0 EIADMM C[C@H](SCCC[N-]C(=O)C(F)(F)F)c1cccc(Cl)c1 ZINC000774675043 1051891360 /nfs/dbraw/zinc/89/13/60/1051891360.db2.gz IKUCDLVZTLVMEP-VIFPVBQESA-N -1 1 325.783 4.203 20 0 EIADMM CN(C)C(=O)c1ccc(F)c(Nc2cc(Cl)c([O-])cc2Cl)c1 ZINC001176047360 1051894595 /nfs/dbraw/zinc/89/45/95/1051894595.db2.gz ZNNIQFRJSUQAII-UHFFFAOYSA-N -1 1 343.185 4.284 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2cc(O)cc(Cl)c2)c2ccccc12 ZINC001193865260 1052019133 /nfs/dbraw/zinc/01/91/33/1052019133.db2.gz WCKFZHNASFCRJH-UHFFFAOYSA-N -1 1 347.823 4.308 20 0 EIADMM [O-]c1c(F)cc(F)c(Nc2c(F)cccc2Br)c1F ZINC001176671439 1052159360 /nfs/dbraw/zinc/15/93/60/1052159360.db2.gz DCKHDBCVLIYEHW-UHFFFAOYSA-N -1 1 336.082 4.455 20 0 EIADMM COc1ccc([N-]S(=O)(=O)c2ccc3c(Cl)cccc3c2)cc1 ZINC001194215440 1052105690 /nfs/dbraw/zinc/10/56/90/1052105690.db2.gz CWDXPRHXRYXXPJ-UHFFFAOYSA-N -1 1 347.823 4.303 20 0 EIADMM COc1ccccc1-n1ncc(C)c1Nc1c(F)cc(F)c([O-])c1F ZINC001176670470 1052157160 /nfs/dbraw/zinc/15/71/60/1052157160.db2.gz WBBWOMNNQGSTFC-UHFFFAOYSA-N -1 1 349.312 4.056 20 0 EIADMM Cc1ccc(Nc2c(F)cc(F)c([O-])c2F)c(Br)n1 ZINC001176664435 1052157291 /nfs/dbraw/zinc/15/72/91/1052157291.db2.gz ZRVUCYDLMAFCME-UHFFFAOYSA-N -1 1 333.107 4.019 20 0 EIADMM COC(=O)c1cc(Nc2c(F)cc(F)c([O-])c2F)c(F)cc1Cl ZINC001176670845 1052158039 /nfs/dbraw/zinc/15/80/39/1052158039.db2.gz NHBQEAAVAIUZFQ-UHFFFAOYSA-N -1 1 349.667 4.132 20 0 EIADMM CC1(C)COC(c2ccccc2Nc2c(F)cc(F)c([O-])c2F)=N1 ZINC001176672926 1052159394 /nfs/dbraw/zinc/15/93/94/1052159394.db2.gz BLFNIQSJEOXGTP-UHFFFAOYSA-N -1 1 336.313 4.109 20 0 EIADMM [O-]c1c(F)cc(F)c(Nc2cccc(Br)c2F)c1F ZINC001176673252 1052159472 /nfs/dbraw/zinc/15/94/72/1052159472.db2.gz QKIAFPIRZOKHJG-UHFFFAOYSA-N -1 1 336.082 4.455 20 0 EIADMM O=C(Nc1cc([O-])c(F)cc1F)Oc1ccc(Br)cc1 ZINC001194598762 1052173991 /nfs/dbraw/zinc/17/39/91/1052173991.db2.gz DTBDENWNVFWCBJ-UHFFFAOYSA-N -1 1 344.111 4.044 20 0 EIADMM Cc1cccc(C)c1S(=O)(=O)[N-]c1ccccc1C(F)(F)F ZINC001194603006 1052176260 /nfs/dbraw/zinc/17/62/60/1052176260.db2.gz MWTQYVHWKVSDAC-UHFFFAOYSA-N -1 1 329.343 4.123 20 0 EIADMM Cc1cccc(C)c1S(=O)(=O)[N-]c1ccc2cc(Cl)cnc2c1 ZINC001194644506 1052185204 /nfs/dbraw/zinc/18/52/04/1052185204.db2.gz UOSVVERAEAELHA-UHFFFAOYSA-N -1 1 346.839 4.306 20 0 EIADMM CCOc1ccc(C(F)(F)F)cc1NC(=O)c1cc(F)ccc1[O-] ZINC000622329042 1052210052 /nfs/dbraw/zinc/21/00/52/1052210052.db2.gz WVJMCUILLOMCGV-UHFFFAOYSA-N -1 1 343.276 4.201 20 0 EIADMM O=C(NCc1ccc([O-])c(Cl)c1)c1ncsc1-c1ccccc1 ZINC001176994492 1052217246 /nfs/dbraw/zinc/21/72/46/1052217246.db2.gz VMNGJGBHFWKVDO-UHFFFAOYSA-N -1 1 344.823 4.099 20 0 EIADMM COc1c(Cl)cc(NC(=O)c2cc(F)ccc2[O-])cc1Cl ZINC000622343888 1052218159 /nfs/dbraw/zinc/21/81/59/1052218159.db2.gz RPIFHRAXJUTVCF-UHFFFAOYSA-N -1 1 330.142 4.099 20 0 EIADMM Cc1cnc(Cl)c([N-]S(=O)(=O)c2cc3ccccc3s2)c1 ZINC001185426855 1052235011 /nfs/dbraw/zinc/23/50/11/1052235011.db2.gz UHTYXQKREOIEIU-UHFFFAOYSA-N -1 1 338.841 4.059 20 0 EIADMM CC[C@H](Cc1ccc(C)cc1)N(CC)C(=O)c1cc(F)ccc1[O-] ZINC000622395627 1052252084 /nfs/dbraw/zinc/25/20/84/1052252084.db2.gz SJWXFAQFHJYSGS-QGZVFWFLSA-N -1 1 329.415 4.323 20 0 EIADMM O=C(c1cc(F)ccc1[O-])N(Cc1cc(F)ccc1F)C1CCCC1 ZINC000622419677 1052257775 /nfs/dbraw/zinc/25/77/75/1052257775.db2.gz SZUBATVWNKDTHL-UHFFFAOYSA-N -1 1 349.352 4.395 20 0 EIADMM CCCN(CC(=O)[O-])Cc1cnc(-c2ccc(C(C)C)cc2)s1 ZINC000184916858 1052308176 /nfs/dbraw/zinc/30/81/76/1052308176.db2.gz XWBWOUZHYIWNQI-UHFFFAOYSA-N -1 1 332.469 4.230 20 0 EIADMM O=C([N-]c1c(F)cc(Cl)cc1F)c1cc(F)c(F)c(F)c1F ZINC000180347186 1052795459 /nfs/dbraw/zinc/79/54/59/1052795459.db2.gz UHEFSOXLDQPEEN-UHFFFAOYSA-N -1 1 339.622 4.427 20 0 EIADMM C[C@@H]1CC(=O)N(C)c2ccc(NCc3cccc([O-])c3Cl)cc21 ZINC000623792546 1052805425 /nfs/dbraw/zinc/80/54/25/1052805425.db2.gz WRUGIHIVJHEFJM-LLVKDONJSA-N -1 1 330.815 4.128 20 0 EIADMM COc1cc(C(=O)[N-]c2ccccc2SC2CCCC2)sn1 ZINC000623981133 1052846861 /nfs/dbraw/zinc/84/68/61/1052846861.db2.gz ZFBUDJFLJNOENN-UHFFFAOYSA-N -1 1 334.466 4.439 20 0 EIADMM CCCCc1nnc([N-]C(=O)c2nc(C)oc2-c2ccccc2)s1 ZINC000183717690 1052982612 /nfs/dbraw/zinc/98/26/12/1052982612.db2.gz CNBMAVSUDWUOCO-UHFFFAOYSA-N -1 1 342.424 4.096 20 0 EIADMM Cc1nc(C(F)(F)F)c(CSc2nc(C3CC3)cc(=O)[n-]2)s1 ZINC000195082580 1053051168 /nfs/dbraw/zinc/05/11/68/1053051168.db2.gz AJKDKYYRVHPYJY-UHFFFAOYSA-N -1 1 347.387 4.136 20 0 EIADMM C[C@@H](NC(=O)c1c([O-])cnc2c(F)cccc21)c1ccc(Cl)cc1 ZINC001626032575 1053685285 /nfs/dbraw/zinc/68/52/85/1053685285.db2.gz YXSQYXACOKFJKE-SNVBAGLBSA-N -1 1 344.773 4.224 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1ccc(OC(F)(F)F)cc1 ZINC000111667794 1053719487 /nfs/dbraw/zinc/71/94/87/1053719487.db2.gz RXYJZCMZDCRLBI-UHFFFAOYSA-N -1 1 331.677 4.197 20 0 EIADMM COc1cc(C(=O)Nc2ccc([O-])c(Cl)c2)ccc1OC(C)C ZINC000111666836 1053720235 /nfs/dbraw/zinc/72/02/35/1053720235.db2.gz FUPMNOUIZLYZMK-UHFFFAOYSA-N -1 1 335.787 4.094 20 0 EIADMM O=C(Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)[C@H](F)CC1CCCCC1 ZINC000794926304 1053753567 /nfs/dbraw/zinc/75/35/67/1053753567.db2.gz KXGHCAZKLKBIJW-OAHLLOKOSA-N -1 1 331.391 4.029 20 0 EIADMM O=C(Nc1cc(F)c([O-])cc1Cl)[C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000885674346 1053787510 /nfs/dbraw/zinc/78/75/10/1053787510.db2.gz LZIAEALDUDBVIX-JGVFFNPUSA-N -1 1 339.716 4.492 20 0 EIADMM O=C(Nc1ccc([O-])c(F)c1F)[C@H](Cc1cccnc1)C1CCCC1 ZINC000868787686 1053935379 /nfs/dbraw/zinc/93/53/79/1053935379.db2.gz HXGXFETZFAUADF-CQSZACIVSA-N -1 1 346.377 4.053 20 0 EIADMM CCN(Cc1ccc(Cl)s1)C(=O)c1cc(Cl)ccc1[O-] ZINC000026855629 1053946845 /nfs/dbraw/zinc/94/68/45/1053946845.db2.gz PCRUKAGCGVMBBW-UHFFFAOYSA-N -1 1 330.236 4.423 20 0 EIADMM CCc1cccc(CC)c1NC(=O)NCCc1c(F)cc([O-])cc1F ZINC001197588159 1053949276 /nfs/dbraw/zinc/94/92/76/1053949276.db2.gz DWWNGGIJXSHFFG-UHFFFAOYSA-N -1 1 348.393 4.159 20 0 EIADMM O=S(=O)(Cc1ccc(Cl)c(F)c1)[N-]c1cccc2occc21 ZINC001197685391 1053974321 /nfs/dbraw/zinc/97/43/21/1053974321.db2.gz PAFAJRUWKTXTJW-UHFFFAOYSA-N -1 1 339.775 4.167 20 0 EIADMM [O-]c1ccc(NC(=S)Nc2cccc(C(F)(F)F)c2)c(F)c1F ZINC001198057863 1054054651 /nfs/dbraw/zinc/05/46/51/1054054651.db2.gz LPQPZUYXSIYLTR-UHFFFAOYSA-N -1 1 348.296 4.498 20 0 EIADMM O=S(=O)(/C=C/c1ccc(Cl)cc1)[N-]c1cccc2cccnc21 ZINC000018996251 1054214052 /nfs/dbraw/zinc/21/40/52/1054214052.db2.gz OFBJSVWUFKNIJP-ZRDIBKRKSA-N -1 1 344.823 4.301 20 0 EIADMM CCCC(C)(C)NC(=O)c1ccc(NC(=O)OC(C)(C)C)cc1[O-] ZINC000857443951 1054243568 /nfs/dbraw/zinc/24/35/68/1054243568.db2.gz TXHGLIMQQMOFDV-UHFFFAOYSA-N -1 1 336.432 4.048 20 0 EIADMM O=C([N-]Cc1cc(F)c(Cl)cc1F)C(F)(F)c1ccccc1 ZINC000857498421 1054280953 /nfs/dbraw/zinc/28/09/53/1054280953.db2.gz FEWBWJMRODWPSZ-UHFFFAOYSA-N -1 1 331.696 4.026 20 0 EIADMM CCc1cccc(CC)c1[N-]S(=O)(=O)c1ccc2occc2c1 ZINC001198858583 1054285068 /nfs/dbraw/zinc/28/50/68/1054285068.db2.gz FLOYGJMHENXHAM-UHFFFAOYSA-N -1 1 329.421 4.358 20 0 EIADMM CON(Cc1ccccc1Cl)C(=O)c1cc2ccccc2cc1[O-] ZINC000857509322 1054287663 /nfs/dbraw/zinc/28/76/63/1054287663.db2.gz AKQFHXVNIMCLDU-UHFFFAOYSA-N -1 1 341.794 4.403 20 0 EIADMM O=C(Nc1ccc(Cl)c(C(F)(F)F)c1)Nc1ncccc1[O-] ZINC000082157883 1054370531 /nfs/dbraw/zinc/37/05/31/1054370531.db2.gz WUMXJFOYZAORBK-UHFFFAOYSA-N -1 1 331.681 4.103 20 0 EIADMM CSc1ccc(NC(=S)Nc2cc([O-])c(F)cc2F)cc1 ZINC001201185192 1054708574 /nfs/dbraw/zinc/70/85/74/1054708574.db2.gz JJLXRUXKHGFXTD-UHFFFAOYSA-N -1 1 326.393 4.201 20 0 EIADMM O=C1[N-]C(=O)C(=Cc2cccc(OCCCc3ccccc3)c2)S1 ZINC000874928872 1054743833 /nfs/dbraw/zinc/74/38/33/1054743833.db2.gz XAGAVNNQUONXCK-GHRIWEEISA-N -1 1 339.416 4.022 20 0 EIADMM O=C(Nc1ccc(Nc2ccnc(Cl)c2[O-])cc1)c1ccccc1 ZINC001201311086 1054750926 /nfs/dbraw/zinc/75/09/26/1054750926.db2.gz OKUZWRHXVNALIZ-UHFFFAOYSA-N -1 1 339.782 4.437 20 0 EIADMM [O-]c1ccc(Cl)c(Nc2cnn(Cc3ccccn3)c2)c1Cl ZINC001201421801 1054794101 /nfs/dbraw/zinc/79/41/01/1054794101.db2.gz CPCZRLQRVDDALG-UHFFFAOYSA-N -1 1 335.194 4.082 20 0 EIADMM C[C@@H](NC(=O)c1c([O-])cccc1Cl)c1ccc2ncsc2c1 ZINC000777208458 1054968523 /nfs/dbraw/zinc/96/85/23/1054968523.db2.gz OCPFXFNGOJEGPH-SECBINFHSA-N -1 1 332.812 4.146 20 0 EIADMM CCOC1CC(CC(=O)Nc2cc(Cl)c([O-])c3ccccc23)C1 ZINC000862295607 1055048064 /nfs/dbraw/zinc/04/80/64/1055048064.db2.gz OETUUBCMOSBAIA-UHFFFAOYSA-N -1 1 333.815 4.343 20 0 EIADMM O=C(Nc1ccccc1C(F)(F)F)Nc1cc(F)cc(F)c1[O-] ZINC001202169299 1055066574 /nfs/dbraw/zinc/06/65/74/1055066574.db2.gz UJKTZDQQAKUPIM-UHFFFAOYSA-N -1 1 332.228 4.333 20 0 EIADMM O=C(Nc1cccc(C(F)(F)F)c1)Nc1ccc([O-])c(F)c1F ZINC001202297335 1055129665 /nfs/dbraw/zinc/12/96/65/1055129665.db2.gz ZYQNSCSDQIKXDO-UHFFFAOYSA-N -1 1 332.228 4.333 20 0 EIADMM O=C(Nc1cccc(F)c1[O-])[C@@H](OC1CCCC1)c1ccccc1 ZINC000863009971 1055137252 /nfs/dbraw/zinc/13/72/52/1055137252.db2.gz LRJSJFPGIOZWRD-SFHVURJKSA-N -1 1 329.371 4.170 20 0 EIADMM O=C(Nc1cccc(F)c1[O-])[C@H](OC1CCCC1)c1ccccc1 ZINC000863009970 1055137718 /nfs/dbraw/zinc/13/77/18/1055137718.db2.gz LRJSJFPGIOZWRD-GOSISDBHSA-N -1 1 329.371 4.170 20 0 EIADMM Cc1nc(C(C)C)[n-]c(=O)c1C(=O)N1CC[C@H](C)C2(CCCCC2)C1 ZINC000765845033 1055844306 /nfs/dbraw/zinc/84/43/06/1055844306.db2.gz ZSYGASRORYXMQD-AWEZNQCLSA-N -1 1 345.487 4.047 20 0 EIADMM Cc1onc(OC(F)F)c1[N-]C(=O)c1c(Cl)oc2ccccc21 ZINC001128101565 1055872342 /nfs/dbraw/zinc/87/23/42/1055872342.db2.gz UQZDJGXOJCNFBI-UHFFFAOYSA-N -1 1 342.685 4.236 20 0 EIADMM Cc1noc([N-]C(=O)c2sc3cc(Cl)ccc3c2Cl)n1 ZINC000056911788 1055950078 /nfs/dbraw/zinc/95/00/78/1055950078.db2.gz LMPAWMNQOXPVNA-UHFFFAOYSA-N -1 1 328.180 4.152 20 0 EIADMM C[C@@H]1CCCCN(C(=O)c2ccc(NC(=O)OC(C)(C)C)cc2[O-])C1 ZINC000186476971 1056550931 /nfs/dbraw/zinc/55/09/31/1056550931.db2.gz MVDKEJZSLBVZDF-CYBMUJFWSA-N -1 1 348.443 4.001 20 0 EIADMM [O-]c1c(F)cc(Nc2cc(Br)cnc2F)cc1Cl ZINC001214480155 1056706095 /nfs/dbraw/zinc/70/60/95/1056706095.db2.gz MOPAMAQAAWHTEX-UHFFFAOYSA-N -1 1 335.535 4.225 20 0 EIADMM CC(C)(C)CCCCC(=O)N1CCC(C(=O)c2ccc([O-])cc2)CC1 ZINC000672212575 1056775687 /nfs/dbraw/zinc/77/56/87/1056775687.db2.gz OKAIOZNMHMCJLJ-UHFFFAOYSA-N -1 1 345.483 4.420 20 0 EIADMM CCc1nc2cc(S(=O)(=O)[N-]c3c(C)cc(C)cc3C)ccc2o1 ZINC000542930137 1056784987 /nfs/dbraw/zinc/78/49/87/1056784987.db2.gz MFSJAJRVCHNRTA-UHFFFAOYSA-N -1 1 344.436 4.116 20 0 EIADMM O=C(Cc1ccccc1C(F)(F)F)Nc1ccc([O-])c(Cl)c1 ZINC000111666940 1056811913 /nfs/dbraw/zinc/81/19/13/1056811913.db2.gz HVWVXGPMKSCRGF-UHFFFAOYSA-N -1 1 329.705 4.246 20 0 EIADMM CCCn1ccc2cc([N-]S(=O)(=O)c3ccc(C)cc3)ccc21 ZINC000063476157 1056811950 /nfs/dbraw/zinc/81/19/50/1056811950.db2.gz PLOKYLCMZKDNLC-UHFFFAOYSA-N -1 1 328.437 4.161 20 0 EIADMM O=C(Nc1c([O-])cccc1F)c1ccc(C2SCCS2)cc1 ZINC000743415877 1058989029 /nfs/dbraw/zinc/98/90/29/1058989029.db2.gz MSPBWEROTGRXDX-UHFFFAOYSA-N -1 1 335.425 4.262 20 0 EIADMM C[C@@H](Sc1ccc(Cl)cc1)C(=O)Nc1c([O-])cccc1F ZINC000743416681 1058990170 /nfs/dbraw/zinc/99/01/70/1058990170.db2.gz RMSPRZAXQLSOCZ-SECBINFHSA-N -1 1 325.792 4.304 20 0 EIADMM CC(=O)c1ccc([O-])c(CCOC(=O)C=Cc2ccccc2Cl)c1 ZINC000744488676 1059553282 /nfs/dbraw/zinc/55/32/82/1059553282.db2.gz BSXKPOMCDTVLPH-CLFYSBASSA-N -1 1 344.794 4.047 20 0 EIADMM O=C(C[C@@H](Cc1ccccc1)c1ccccc1)[N-]OCC(F)(F)F ZINC000766762067 1060868336 /nfs/dbraw/zinc/86/83/36/1060868336.db2.gz IIFLLTRPZJPFHJ-MRXNPFEDSA-N -1 1 337.341 4.013 20 0 EIADMM CC(C)(C)c1ccc(CCCCC(=O)[N-]OCC(F)(F)F)cc1 ZINC000766771529 1060882376 /nfs/dbraw/zinc/88/23/76/1060882376.db2.gz NBIFERYEELBLPX-UHFFFAOYSA-N -1 1 331.378 4.307 20 0 EIADMM Cc1nc(CCC(=O)Nc2ccc(F)cc2[O-])oc1-c1ccccc1 ZINC000532267546 1032126349 /nfs/dbraw/zinc/12/63/49/1032126349.db2.gz ZDSFKMJJDLWDNI-UHFFFAOYSA-N -1 1 340.354 4.066 20 0 EIADMM C[C@H](Sc1ccc(Cl)cc1)C(=O)Nc1ccc(F)cc1[O-] ZINC000532267118 1032126487 /nfs/dbraw/zinc/12/64/87/1032126487.db2.gz HSFCGNPMBQWSQD-VIFPVBQESA-N -1 1 325.792 4.304 20 0 EIADMM CC(C)c1nnc([N-]C(=O)c2ncoc2-c2ccccc2Cl)s1 ZINC000172705140 1032329113 /nfs/dbraw/zinc/32/91/13/1032329113.db2.gz DYRFRZHFQHVGFF-UHFFFAOYSA-N -1 1 348.815 4.222 20 0 EIADMM C[C@H]1O[C@@H](C)[C@H](C)[C@@H]1C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000529539116 1032429206 /nfs/dbraw/zinc/42/92/06/1032429206.db2.gz PRIQFSXOOQLXKE-DJQAVVSRSA-N -1 1 333.815 4.197 20 0 EIADMM CO[C@H]1CCCC[C@H]1C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000529539293 1032444150 /nfs/dbraw/zinc/44/41/50/1032444150.db2.gz QEIUWIYTDSBOQQ-CJNGLKHVSA-N -1 1 333.815 4.343 20 0 EIADMM CCc1noc(C)c1[N-]C(=O)c1cnc(-c2ccccc2F)s1 ZINC000121027705 1032509035 /nfs/dbraw/zinc/50/90/35/1032509035.db2.gz OZTIGLFMWGZZSI-UHFFFAOYSA-N -1 1 331.372 4.060 20 0 EIADMM CCOc1cc(C(=O)Nc2ccc3oc(C)nc3c2)cc(Cl)c1[O-] ZINC000178124286 1032529050 /nfs/dbraw/zinc/52/90/50/1032529050.db2.gz BTMXVFBAVZTHDN-UHFFFAOYSA-N -1 1 346.770 4.146 20 0 EIADMM Cc1c(F)cccc1S(=O)(=O)[N-]c1cccc(C(F)(F)F)c1C ZINC000471127373 1019028042 /nfs/dbraw/zinc/02/80/42/1019028042.db2.gz MCFUZWQQEGJJOJ-UHFFFAOYSA-N -1 1 347.333 4.262 20 0 EIADMM CC(C)c1ccc([C@H](CC(=O)[O-])NCc2nc3c(s2)CCC3)cc1 ZINC000683172175 1019090798 /nfs/dbraw/zinc/09/07/98/1019090798.db2.gz ALPLIYMHBJYJHZ-INIZCTEOSA-N -1 1 344.480 4.061 20 0 EIADMM O=C([O-])c1cccc(CNCc2ccc(-c3cccc(F)c3F)o2)c1 ZINC000683175877 1019102125 /nfs/dbraw/zinc/10/21/25/1019102125.db2.gz CBNQRSUVQYPEML-UHFFFAOYSA-N -1 1 343.329 4.213 20 0 EIADMM Cc1nc(-c2ccc([N-]S(=O)(=O)c3ccc(C)c(C)c3)cc2)co1 ZINC000029433350 1019215343 /nfs/dbraw/zinc/21/53/43/1019215343.db2.gz IBLOPWJJDXKSKT-UHFFFAOYSA-N -1 1 342.420 4.068 20 0 EIADMM CC[C@@H](C)c1ccc(S(=O)(=O)[N-]c2cccc(COC)c2)cc1 ZINC000026547197 1019232301 /nfs/dbraw/zinc/23/23/01/1019232301.db2.gz UNYPHFRDNNYFJF-CQSZACIVSA-N -1 1 333.453 4.147 20 0 EIADMM CCc1cc(=O)[n-]c(SCc2csc(C3CCCCC3)n2)n1 ZINC000188117380 1019862149 /nfs/dbraw/zinc/86/21/49/1019862149.db2.gz OFSWPBYVAAOPQQ-UHFFFAOYSA-N -1 1 335.498 4.129 20 0 EIADMM CC[C@@H](C(=O)[N-]OCCC(F)(F)F)c1cccc(C(F)(F)F)c1 ZINC000154900306 1020100797 /nfs/dbraw/zinc/10/07/97/1020100797.db2.gz RXPLVRWSDZZJDW-LLVKDONJSA-N -1 1 343.267 4.199 20 0 EIADMM CCOc1cc(C(=O)N(C)Cc2ccccc2C)cc(Cl)c1[O-] ZINC000339988274 1020223135 /nfs/dbraw/zinc/22/31/35/1020223135.db2.gz HFSAHSZHWPDGAW-UHFFFAOYSA-N -1 1 333.815 4.025 20 0 EIADMM CCc1c(=O)n([C@@H](C)c2ccncc2)[n-]c1-c1ccc(F)cc1Cl ZINC000634626545 1020348952 /nfs/dbraw/zinc/34/89/52/1020348952.db2.gz GVQHYPGHHQAKKW-SMDDNHRTSA-N -1 1 345.805 4.208 20 0 EIADMM CC(C)CCc1nc(CN2CCC[C@H](C(C)(C)C(=O)[O-])C2)cs1 ZINC000652499794 1020537654 /nfs/dbraw/zinc/53/76/54/1020537654.db2.gz MOIJSUWSIZLKJU-AWEZNQCLSA-N -1 1 338.517 4.055 20 0 EIADMM C[S@@](=O)(=NC(=O)c1cc2cc(Cl)sc2[n-]1)C1CCCCC1 ZINC000926030233 1020836480 /nfs/dbraw/zinc/83/64/80/1020836480.db2.gz DOQSCPSPSMWFGF-NRFANRHFSA-N -1 1 344.889 4.454 20 0 EIADMM COC[C@@H]([N-]c1nc(-c2ccccc2)no1)c1ccc(Cl)cc1 ZINC000683755894 1021337480 /nfs/dbraw/zinc/33/74/80/1021337480.db2.gz BMGPWQONGPXRSS-OAHLLOKOSA-N -1 1 329.787 4.190 20 0 EIADMM O=C(NC1CCC(C2CCC2)CC1)c1ccc(C(F)(F)F)c([O-])c1 ZINC001167352230 1021637293 /nfs/dbraw/zinc/63/72/93/1021637293.db2.gz FUVXGWFHFBSVFE-UHFFFAOYSA-N -1 1 341.373 4.500 20 0 EIADMM Cc1nc(-c2ccsc2)ccc1C(=O)Nc1c([O-])cccc1F ZINC000089541224 1021907076 /nfs/dbraw/zinc/90/70/76/1021907076.db2.gz PIOJBVAQZNAHBH-UHFFFAOYSA-N -1 1 328.368 4.216 20 0 EIADMM CCOC1(C)CCN([C@@H](C(=O)[O-])c2cccc(Cl)c2Cl)CC1 ZINC000580451523 1022035411 /nfs/dbraw/zinc/03/54/11/1022035411.db2.gz GWKGGCDCJMPHLQ-CQSZACIVSA-N -1 1 346.254 4.010 20 0 EIADMM Cc1ccccc1S(=O)(=O)[N-]c1ccc(OC2CCCC2)c(F)c1 ZINC000460829852 1022246094 /nfs/dbraw/zinc/24/60/94/1022246094.db2.gz PFNZFHKPDYYOQN-UHFFFAOYSA-N -1 1 349.427 4.256 20 0 EIADMM CCOC(=O)c1ncoc1-c1cccc(-c2cc(F)c([O-])cc2F)c1 ZINC001211351814 1022537890 /nfs/dbraw/zinc/53/78/90/1022537890.db2.gz DMYIMHMHYWTFPZ-UHFFFAOYSA-N -1 1 345.301 4.169 20 0 EIADMM CCc1cc(=O)[nH]c(SCc2cnc(-c3ccc(Cl)cc3)[nH]2)n1 ZINC000376425581 1022558629 /nfs/dbraw/zinc/55/86/29/1022558629.db2.gz IPXBGUBONOZFNB-UHFFFAOYSA-N -1 1 346.843 4.080 20 0 EIADMM CCc1cc(=O)[n-]c(SCc2c[nH]c(-c3ccc(Cl)cc3)n2)n1 ZINC000376425581 1022558658 /nfs/dbraw/zinc/55/86/58/1022558658.db2.gz IPXBGUBONOZFNB-UHFFFAOYSA-N -1 1 346.843 4.080 20 0 EIADMM Cc1c2ccccc2oc1C(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC000339120628 1022610232 /nfs/dbraw/zinc/61/02/32/1022610232.db2.gz NDSKHMBSXXZUQQ-UHFFFAOYSA-N -1 1 333.347 4.089 20 0 EIADMM Cc1cnc(F)c(Nc2cc(Br)cc(Cl)c2[O-])c1 ZINC001211510547 1022895231 /nfs/dbraw/zinc/89/52/31/1022895231.db2.gz UGHNIVNUDWCJSS-UHFFFAOYSA-N -1 1 331.572 4.394 20 0 EIADMM CN(C)c1cccc2sc(C(=O)Nc3cc([O-])c(F)cc3F)cc21 ZINC001625896167 1023079235 /nfs/dbraw/zinc/07/92/35/1023079235.db2.gz GVLMQCBVIUAZEZ-UHFFFAOYSA-N -1 1 348.374 4.203 20 0 EIADMM CC[C@H](NC(=O)c1ccc(Br)c([O-])c1)c1cccs1 ZINC000179146942 1023208344 /nfs/dbraw/zinc/20/83/44/1023208344.db2.gz NPEKDITYCGBCLS-NSHDSACASA-N -1 1 340.242 4.097 20 0 EIADMM CCOc1cc(-c2nc(C3CCSCC3)no2)cc(Cl)c1[O-] ZINC000584759721 1023290454 /nfs/dbraw/zinc/29/04/54/1023290454.db2.gz CBMWKHGBHXLDIZ-UHFFFAOYSA-N -1 1 340.832 4.105 20 0 EIADMM Cc1ccc(-c2ccc(CN[C@@H](COC(C)(C)C)C(=O)[O-])s2)cc1 ZINC000417588066 1023366448 /nfs/dbraw/zinc/36/64/48/1023366448.db2.gz BTKZOFZIBCLLTP-INIZCTEOSA-N -1 1 347.480 4.081 20 0 EIADMM O=C(Nc1cc([O-])c(F)cc1F)c1cc2sccc2nc1Cl ZINC001625897322 1023445133 /nfs/dbraw/zinc/44/51/33/1023445133.db2.gz YUUCLFBRCUCEDB-UHFFFAOYSA-N -1 1 340.738 4.186 20 0 EIADMM O=C(Nc1cnn(Cc2ccccc2)c1)c1ccc2ccccc2c1[O-] ZINC000390336830 1023463538 /nfs/dbraw/zinc/46/35/38/1023463538.db2.gz MLHPKSZIZAJNKW-UHFFFAOYSA-N -1 1 343.386 4.043 20 0 EIADMM O=C(Cc1ccc2ccccc2c1)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC000613665032 1023474239 /nfs/dbraw/zinc/47/42/39/1023474239.db2.gz PPFYNZPZJTYNEA-UHFFFAOYSA-N -1 1 343.386 4.117 20 0 EIADMM C[C@H](Nc1ccc(NC(=O)c2cncc([O-])c2)cc1)c1ccccc1 ZINC000109955815 1023848238 /nfs/dbraw/zinc/84/82/38/1023848238.db2.gz ONZGGASIZDVLHE-AWEZNQCLSA-N -1 1 333.391 4.213 20 0 EIADMM CC(C)(c1ccc([N-]S(=O)(=O)c2ccccc2)cc1)C(F)(F)F ZINC000432076885 1023861627 /nfs/dbraw/zinc/86/16/27/1023861627.db2.gz MNKZCQLRKOCSPB-UHFFFAOYSA-N -1 1 343.370 4.327 20 0 EIADMM CSc1ccc([N-]S(=O)(=O)c2cc(F)cc(Cl)c2)cc1 ZINC000535890581 1025213294 /nfs/dbraw/zinc/21/32/94/1025213294.db2.gz CTXQDXJIPZSACK-UHFFFAOYSA-N -1 1 331.821 4.002 20 0 EIADMM Cc1noc(-c2ccccc2)c1[N-]C(=O)c1c(F)ccc(C)c1F ZINC000472028771 1025433665 /nfs/dbraw/zinc/43/36/65/1025433665.db2.gz GSYAAMOKOQWJBN-UHFFFAOYSA-N -1 1 328.318 4.489 20 0 EIADMM O=c1nc(-c2cscn2)[n-]c2scc(-c3ccc(F)cc3)c21 ZINC000432500817 1026205223 /nfs/dbraw/zinc/20/52/23/1026205223.db2.gz NTWGDWZLKMNAKH-UHFFFAOYSA-N -1 1 329.381 4.327 20 0 EIADMM Cc1c(C(=O)Nc2ccc([O-])c(Cl)c2)cnn1-c1ccccc1C ZINC000111666476 1026313849 /nfs/dbraw/zinc/31/38/49/1026313849.db2.gz YNNWBAMQDWKUTK-UHFFFAOYSA-N -1 1 341.798 4.100 20 0 EIADMM O=C([O-])CC[C@H]1CCCN(Cc2coc(-c3cccc(Cl)c3)n2)C1 ZINC000261605172 1026514192 /nfs/dbraw/zinc/51/41/92/1026514192.db2.gz AFOOQBLKGIBDMN-CYBMUJFWSA-N -1 1 348.830 4.072 20 0 EIADMM O=C([O-])CC[C@@H]1CCCN(Cc2coc(-c3cccc(Cl)c3)n2)C1 ZINC000261605175 1026514427 /nfs/dbraw/zinc/51/44/27/1026514427.db2.gz AFOOQBLKGIBDMN-ZDUSSCGKSA-N -1 1 348.830 4.072 20 0 EIADMM CC1([C@@H](NCc2ccc(-c3ccccc3)o2)C(=O)[O-])CCCCC1 ZINC000426734484 1026517388 /nfs/dbraw/zinc/51/73/88/1026517388.db2.gz APRQCFCBXNZGSF-SFHVURJKSA-N -1 1 327.424 4.460 20 0 EIADMM C[C@@H](C(=O)[O-])[C@@H](NCc1ccccc1Br)c1ccccc1 ZINC000426740545 1026522896 /nfs/dbraw/zinc/52/28/96/1026522896.db2.gz BFGUESGJYPWPGP-MLGOLLRUSA-N -1 1 348.240 4.001 20 0 EIADMM Cc1cc([C@@H](NCc2cc(Cl)ccc2F)C(=O)[O-])ccc1Cl ZINC000426780029 1026555034 /nfs/dbraw/zinc/55/50/34/1026555034.db2.gz NNPYERIIXKUHOE-OAHLLOKOSA-N -1 1 342.197 4.356 20 0 EIADMM Cc1ccc([C@H](CC(=O)[O-])NCc2cnc(-c3ccsc3)s2)o1 ZINC000426794895 1026567518 /nfs/dbraw/zinc/56/75/18/1026567518.db2.gz WAZAILDWHGRXCJ-ZDUSSCGKSA-N -1 1 348.449 4.079 20 0 EIADMM Cc1cc([C@@H](NCc2ccc(F)cc2Cl)C(=O)[O-])ccc1Cl ZINC000426803311 1026571816 /nfs/dbraw/zinc/57/18/16/1026571816.db2.gz LPPKQCJAFVIVLF-OAHLLOKOSA-N -1 1 342.197 4.356 20 0 EIADMM O=C([O-])C[C@@H](NCc1cc(F)c(F)c(F)c1)c1cccc(Cl)c1 ZINC000426829441 1026573635 /nfs/dbraw/zinc/57/36/35/1026573635.db2.gz PHSHQSNCHBHGNA-CQSZACIVSA-N -1 1 343.732 4.063 20 0 EIADMM O=C(Nc1cccc(OC(F)F)c1)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684871288 1026634992 /nfs/dbraw/zinc/63/49/92/1026634992.db2.gz DHFQZKDMKJGYFP-UHFFFAOYSA-N -1 1 347.239 4.265 20 0 EIADMM CCOc1ccccc1N(C)C(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684877451 1026656393 /nfs/dbraw/zinc/65/63/93/1026656393.db2.gz QADZCPZLWVKNIX-UHFFFAOYSA-N -1 1 339.313 4.086 20 0 EIADMM COC(=O)c1c[n-]c(SCCCSc2ccccc2Cl)n1 ZINC000432671008 1026702536 /nfs/dbraw/zinc/70/25/36/1026702536.db2.gz OGYQOIXBEJSLJH-UHFFFAOYSA-N -1 1 342.873 4.124 20 0 EIADMM CC[C@@H](C)c1ccc(S(=O)(=O)[N-]c2ccc(F)c(C(C)=O)c2)cc1 ZINC000507630155 1026859102 /nfs/dbraw/zinc/85/91/02/1026859102.db2.gz NXXNAIAFWNRYRA-GFCCVEGCSA-N -1 1 349.427 4.343 20 0 EIADMM CC[C@H](C)c1ccc(S(=O)(=O)[N-]c2ccc(F)c(C(C)=O)c2)cc1 ZINC000507630156 1026859302 /nfs/dbraw/zinc/85/93/02/1026859302.db2.gz NXXNAIAFWNRYRA-LBPRGKRZSA-N -1 1 349.427 4.343 20 0 EIADMM CC(C)(Oc1cccc(Cl)c1)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000440945990 1027129211 /nfs/dbraw/zinc/12/92/11/1027129211.db2.gz DHEZEAYUDPZXBJ-UHFFFAOYSA-N -1 1 340.206 4.495 20 0 EIADMM Cc1nc(=O)[n-]c(O[C@@H](C)c2ccccc2Br)c1Cl ZINC001227111328 1027269677 /nfs/dbraw/zinc/26/96/77/1027269677.db2.gz KCJXRDULHXMSKZ-QMMMGPOBSA-N -1 1 343.608 4.047 20 0 EIADMM Cc1ccc(CNC(=O)c2c(C)nc(C(C)C)[n-]c2=O)c2ccccc12 ZINC000840492881 1027362942 /nfs/dbraw/zinc/36/29/42/1027362942.db2.gz HGUXAEHKVTVESN-UHFFFAOYSA-N -1 1 349.434 4.006 20 0 EIADMM COCCC1(c2noc(-c3cc(SC)ccc3[O-])n2)CCCC1 ZINC000896624628 1027705898 /nfs/dbraw/zinc/70/58/98/1027705898.db2.gz VRHNHQGFGBFGIJ-UHFFFAOYSA-N -1 1 334.441 4.012 20 0 EIADMM Cc1cc(Br)c([O-])c(NC(=O)c2occc2C(C)C)c1 ZINC000550399296 1027763322 /nfs/dbraw/zinc/76/33/22/1027763322.db2.gz RDXGXWFVCHDYOK-UHFFFAOYSA-N -1 1 338.201 4.432 20 0 EIADMM COc1ccc(C(=O)Nc2ccc(OC(C)C)cc2Cl)c([O-])c1 ZINC000444521225 1027855712 /nfs/dbraw/zinc/85/57/12/1027855712.db2.gz LSZWUCQYHHUZBB-UHFFFAOYSA-N -1 1 335.787 4.094 20 0 EIADMM COc1cc(C(=O)N(C2CC2)C2CCC(C)CC2)cc(Cl)c1[O-] ZINC000153682641 1027869434 /nfs/dbraw/zinc/86/94/34/1027869434.db2.gz LSECRHDMPGTOCI-UHFFFAOYSA-N -1 1 337.847 4.238 20 0 EIADMM Cc1ccccc1[C@H](CC(F)(F)F)NC(=O)c1ccc([O-])cc1F ZINC000444629890 1027909049 /nfs/dbraw/zinc/90/90/49/1027909049.db2.gz XVIYQPBRTDTKGC-HNNXBMFYSA-N -1 1 341.304 4.263 20 0 EIADMM CC1(C)CC[C@H](NC(=O)c2c(F)ccc([O-])c2F)c2ccccc21 ZINC000343269471 1028108132 /nfs/dbraw/zinc/10/81/32/1028108132.db2.gz JEIKOYMLUMNADX-AWEZNQCLSA-N -1 1 331.362 4.213 20 0 EIADMM Cc1ncc(-c2ccc([N-]S(=O)(=O)c3ccc(C)c(C)c3)cc2)o1 ZINC000029433198 1028199104 /nfs/dbraw/zinc/19/91/04/1028199104.db2.gz CTVBGWILLKZDJS-UHFFFAOYSA-N -1 1 342.420 4.068 20 0 EIADMM CC1CCN(c2ccc(NC(=O)c3c(F)ccc([O-])c3F)cc2)CC1 ZINC000280969454 1028292929 /nfs/dbraw/zinc/29/29/29/1028292929.db2.gz OCUNOKXPVKJERY-UHFFFAOYSA-N -1 1 346.377 4.159 20 0 EIADMM CCC(=O)c1ccc(-c2nc(-c3ccc([O-])cc3Cl)no2)cc1 ZINC000445449570 1028539999 /nfs/dbraw/zinc/53/99/99/1028539999.db2.gz VSXXRFOHYPTXAV-UHFFFAOYSA-N -1 1 328.755 4.355 20 0 EIADMM [O-]c1ccc(-c2noc(C3=Cc4cc(F)ccc4OC3)n2)c(Cl)c1 ZINC000445450740 1028540274 /nfs/dbraw/zinc/54/02/74/1028540274.db2.gz VXPMNMRIKCBCJY-UHFFFAOYSA-N -1 1 344.729 4.168 20 0 EIADMM Cc1nc(CCCc2nc(-c3ccc([O-])cc3Cl)no2)cs1 ZINC000445451842 1028545161 /nfs/dbraw/zinc/54/51/61/1028545161.db2.gz LBDDQXHTQQFJGX-UHFFFAOYSA-N -1 1 335.816 4.036 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cc(-c4cccs4)on3)n2)c(Cl)c1 ZINC000445444503 1028571746 /nfs/dbraw/zinc/57/17/46/1028571746.db2.gz GHIJBVZOGOHVMI-UHFFFAOYSA-N -1 1 345.767 4.479 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cc(-c4ccccc4)no3)n2)c(Cl)c1 ZINC000445445620 1028574884 /nfs/dbraw/zinc/57/48/84/1028574884.db2.gz AKIUPZQVXDLYPN-UHFFFAOYSA-N -1 1 339.738 4.418 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cc4c(cccc4F)[nH]3)n2)c(Cl)c1 ZINC000445444052 1028575320 /nfs/dbraw/zinc/57/53/20/1028575320.db2.gz DSGUCZYZXAXPSM-UHFFFAOYSA-N -1 1 329.718 4.383 20 0 EIADMM [O-]c1ccc(-c2noc(COc3ccc(Cl)cc3)n2)c(Cl)c1 ZINC000445446765 1028576376 /nfs/dbraw/zinc/57/63/76/1028576376.db2.gz FSMBVCLVAWXAHI-UHFFFAOYSA-N -1 1 337.162 4.328 20 0 EIADMM COCc1c2ccccc2oc1-c1nc(-c2ccc([O-])cc2F)no1 ZINC000445454117 1028607059 /nfs/dbraw/zinc/60/70/59/1028607059.db2.gz KKNUZLXNJJZYBL-UHFFFAOYSA-N -1 1 340.310 4.141 20 0 EIADMM C[C@H](CSc1ccccc1)c1nc(-c2ccc([O-])cc2F)no1 ZINC000445456736 1028610309 /nfs/dbraw/zinc/61/03/09/1028610309.db2.gz PXLGFCXDBXMZFE-LLVKDONJSA-N -1 1 330.384 4.477 20 0 EIADMM Cc1c(-c2nc(-c3ccc([O-])cc3F)no2)sc2nccc(C)c12 ZINC000445456048 1028610481 /nfs/dbraw/zinc/61/04/81/1028610481.db2.gz MSRUWOKHNPLKQQ-UHFFFAOYSA-N -1 1 341.367 4.475 20 0 EIADMM Cc1ccc(C)c(C(=O)CCc2nc(-c3ccc([O-])cc3F)no2)c1 ZINC000445461676 1028619050 /nfs/dbraw/zinc/61/90/50/1028619050.db2.gz HIOWARWSLNPICY-UHFFFAOYSA-N -1 1 340.354 4.014 20 0 EIADMM C[C@@H](Oc1cccc(Cl)c1)c1nc(-c2ccc([O-])cc2F)no1 ZINC000445461720 1028619306 /nfs/dbraw/zinc/61/93/06/1028619306.db2.gz HXWZLFCBROKIFA-SECBINFHSA-N -1 1 334.734 4.375 20 0 EIADMM CCc1cccc2c(Cc3nc(-c4ccc([O-])c(F)c4)no3)c[nH]c21 ZINC000445478014 1028623550 /nfs/dbraw/zinc/62/35/50/1028623550.db2.gz FSWPMQNTXISGCU-UHFFFAOYSA-N -1 1 337.354 4.216 20 0 EIADMM C[C@H](CCOc1ccccc1)c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445477529 1028624916 /nfs/dbraw/zinc/62/49/16/1028624916.db2.gz CPYXZZADRYONFS-GFCCVEGCSA-N -1 1 328.343 4.154 20 0 EIADMM [O-]c1ccc(-c2noc(CCc3ccc(-c4ccccc4)[nH]3)n2)cc1F ZINC000445482912 1028630753 /nfs/dbraw/zinc/63/07/53/1028630753.db2.gz RNGBFAURTOVFJH-UHFFFAOYSA-N -1 1 349.365 4.362 20 0 EIADMM COc1ccc(C2(c3nc(-c4ccc([O-])c(F)c4)no3)CCC2)cc1 ZINC000445484202 1028632277 /nfs/dbraw/zinc/63/22/77/1028632277.db2.gz XXACQATVRSLSMO-UHFFFAOYSA-N -1 1 340.354 4.060 20 0 EIADMM CC[C@H](Oc1ccccc1C)c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445485324 1028636737 /nfs/dbraw/zinc/63/67/37/1028636737.db2.gz ZELCSXCSNZVTLV-HNNXBMFYSA-N -1 1 328.343 4.420 20 0 EIADMM COc1cc(-c2nc(-c3ccc([O-])c(F)c3)no2)ccc1OC(C)C ZINC000445474922 1028644970 /nfs/dbraw/zinc/64/49/70/1028644970.db2.gz RWDIALUUDZMKTM-UHFFFAOYSA-N -1 1 344.342 4.044 20 0 EIADMM COc1ccccc1C/C(C)=C\c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445476571 1028647322 /nfs/dbraw/zinc/64/73/22/1028647322.db2.gz DZLWFHLGFQGCFC-BENRWUELSA-N -1 1 340.354 4.236 20 0 EIADMM C[C@@H](C(=O)[N-][C@H](c1ccc(Cl)cc1)C(F)(F)F)C(F)(F)F ZINC000080440480 1028783021 /nfs/dbraw/zinc/78/30/21/1028783021.db2.gz CVBFUWGTKNNSOI-IMTBSYHQSA-N -1 1 333.659 4.258 20 0 EIADMM CCOc1cc(-c2nc(CCCSCC)no2)cc(Cl)c1[O-] ZINC000445760537 1028882864 /nfs/dbraw/zinc/88/28/64/1028882864.db2.gz UZMZJYZONANAQK-UHFFFAOYSA-N -1 1 342.848 4.180 20 0 EIADMM Cc1ocnc1-c1noc(-c2cc(Oc3ccccc3)ccc2[O-])n1 ZINC000445813174 1028904723 /nfs/dbraw/zinc/90/47/23/1028904723.db2.gz DVBILUGIOVTDHH-UHFFFAOYSA-N -1 1 335.319 4.198 20 0 EIADMM CCOc1cc(C(=O)N[C@@H](C)Cc2ccccc2C)cc(Cl)c1[O-] ZINC000545169945 1029079294 /nfs/dbraw/zinc/07/92/94/1029079294.db2.gz MPUKZSLWBPLVMZ-ZDUSSCGKSA-N -1 1 347.842 4.114 20 0 EIADMM CCc1cc(=O)[n-]c(SCCc2cc(Cl)cc(Cl)c2)n1 ZINC000446071887 1029131413 /nfs/dbraw/zinc/13/14/13/1029131413.db2.gz NNRBTTTYECUGAZ-UHFFFAOYSA-N -1 1 329.252 4.386 20 0 EIADMM C[C@@H](CC(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)C1CCCCC1 ZINC000511243508 1029189162 /nfs/dbraw/zinc/18/91/62/1029189162.db2.gz WGNBKWBRGJVONS-ZDUSSCGKSA-N -1 1 327.428 4.327 20 0 EIADMM Cc1ccccc1S(=O)(=O)[N-]c1ccccc1Cc1ccccc1 ZINC000325145619 1029614745 /nfs/dbraw/zinc/61/47/45/1029614745.db2.gz HFTUZSQKZHNLOC-UHFFFAOYSA-N -1 1 337.444 4.387 20 0 EIADMM COc1cc(C(=O)N(C)[C@@H](C)Cc2ccccc2C)cc(Cl)c1[O-] ZINC000447073541 1029687855 /nfs/dbraw/zinc/68/78/55/1029687855.db2.gz WOEHISHTFGZYEN-ZDUSSCGKSA-N -1 1 347.842 4.066 20 0 EIADMM Cc1ccc([C@@H](C)Nc2ccc(-c3nc(C)c(C)c(=O)[n-]3)cn2)cc1 ZINC000301375227 1029719750 /nfs/dbraw/zinc/71/97/50/1029719750.db2.gz RDORNHMGEZTHSH-OAHLLOKOSA-N -1 1 334.423 4.343 20 0 EIADMM Cc1ccc([C@H](C)N(C)c2ccc(-c3nc(C)c(C)c(=O)[n-]3)cn2)cc1 ZINC000301525076 1029748875 /nfs/dbraw/zinc/74/88/75/1029748875.db2.gz MXDWQBXDJNKGBN-INIZCTEOSA-N -1 1 348.450 4.367 20 0 EIADMM Cc1nc(-c2ccc(NCC(C)(C)C3CCCC3)nc2)[n-]c(=O)c1C ZINC000301768731 1029805751 /nfs/dbraw/zinc/80/57/51/1029805751.db2.gz IYIPFFYRDCADNF-UHFFFAOYSA-N -1 1 340.471 4.489 20 0 EIADMM Cc1ncoc1C(=O)[N-]c1cccc(Cl)c1SCC(F)F ZINC000081786336 1029813060 /nfs/dbraw/zinc/81/30/60/1029813060.db2.gz IAIPHYZTQDWLHP-UHFFFAOYSA-N -1 1 332.759 4.246 20 0 EIADMM Cc1nc(-c2ccc(N[C@@H]3CC[C@H]4CCC[C@H]4C3)nc2)[n-]c(=O)c1C ZINC000525706931 1029941909 /nfs/dbraw/zinc/94/19/09/1029941909.db2.gz LTRFLBKLPXPZGF-HLLBOEOZSA-N -1 1 338.455 4.242 20 0 EIADMM Cc1cc([N-]S(=O)(=O)c2ccc(Cl)s2)c(Cl)cc1F ZINC000107556799 1030030771 /nfs/dbraw/zinc/03/07/71/1030030771.db2.gz XRSUTQIZNGRZHA-UHFFFAOYSA-N -1 1 340.228 4.303 20 0 EIADMM CCOc1cc(C(=O)Nc2ccc3ncccc3c2)cc(Cl)c1[O-] ZINC000186627729 1030290087 /nfs/dbraw/zinc/29/00/87/1030290087.db2.gz RTHRJOVNRHFTMU-UHFFFAOYSA-N -1 1 342.782 4.245 20 0 EIADMM CCOc1cc(C(=O)N2CCCC[C@H]2C(C)C)cc(Cl)c1[O-] ZINC000186817319 1030307263 /nfs/dbraw/zinc/30/72/63/1030307263.db2.gz YNIFUUWJRIMICC-AWEZNQCLSA-N -1 1 325.836 4.095 20 0 EIADMM CCC[C@@H]1CCCC[C@H]1NC(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC000527487389 1030699570 /nfs/dbraw/zinc/69/95/70/1030699570.db2.gz PRCHMHPUZDNHSX-BXUZGUMPSA-N -1 1 325.836 4.143 20 0 EIADMM O=S(=O)([N-]Cc1ccc2ccccc2c1)c1cc2ccccc2o1 ZINC000530770880 1030704933 /nfs/dbraw/zinc/70/49/33/1030704933.db2.gz FCOHDTNGKKOAFN-UHFFFAOYSA-N -1 1 337.400 4.065 20 0 EIADMM COCCC1(C(=O)Nc2cc(Cl)c([O-])c3ccccc23)CCC1 ZINC000628233398 1030731910 /nfs/dbraw/zinc/73/19/10/1030731910.db2.gz ZSCXMKDPBWEKRI-UHFFFAOYSA-N -1 1 333.815 4.344 20 0 EIADMM Cc1ccc(Cl)cc1S(=O)(=O)[N-]c1cccc(OC(F)F)c1 ZINC000614813243 1030760281 /nfs/dbraw/zinc/76/02/81/1030760281.db2.gz KNFHXMYVWHIDEX-UHFFFAOYSA-N -1 1 347.770 4.051 20 0 EIADMM CC(C)Oc1ccc(S(=O)(=O)[N-]c2ccccc2)c2ccccc12 ZINC000032590633 1030809214 /nfs/dbraw/zinc/80/92/14/1030809214.db2.gz OBEAZMQUYOHYFO-UHFFFAOYSA-N -1 1 341.432 4.428 20 0 EIADMM CCCOc1cccc([N-]S(=O)(=O)c2ccc(F)c(Cl)c2)c1 ZINC000032599856 1030812959 /nfs/dbraw/zinc/81/29/59/1030812959.db2.gz LZFGSDCZYWKCEC-UHFFFAOYSA-N -1 1 343.807 4.069 20 0 EIADMM CCC(=O)c1ccc(Cl)c([N-]S(=O)(=O)c2sccc2C)c1 ZINC000475837784 1030864428 /nfs/dbraw/zinc/86/44/28/1030864428.db2.gz WNHXOBIRCDRVCJ-UHFFFAOYSA-N -1 1 343.857 4.103 20 0 EIADMM CCOc1cc(-c2noc(C[C@H](C)c3ccco3)n2)cc(Cl)c1[O-] ZINC000528166425 1031198245 /nfs/dbraw/zinc/19/82/45/1031198245.db2.gz KOFCJNPDQBKHOG-JTQLQIEISA-N -1 1 348.786 4.434 20 0 EIADMM C[C@@H](Sc1ccccc1Cl)C(=O)Nc1ccc(F)cc1[O-] ZINC000532621060 1031429991 /nfs/dbraw/zinc/42/99/91/1031429991.db2.gz NZUHSTBMPIXJMN-SECBINFHSA-N -1 1 325.792 4.304 20 0 EIADMM Cc1cc(C(=O)Nc2ccc(F)cc2[O-])cc(C)c1OC(F)F ZINC000532620915 1031430738 /nfs/dbraw/zinc/43/07/38/1031430738.db2.gz FMNUDQFLIAUKIQ-UHFFFAOYSA-N -1 1 325.286 4.002 20 0 EIADMM O=C(Nc1ccc(F)cc1[O-])c1cc(-c2cccc(Cl)c2)on1 ZINC000531756425 1031535045 /nfs/dbraw/zinc/53/50/45/1031535045.db2.gz HANCSKYPUCORSF-UHFFFAOYSA-N -1 1 332.718 4.092 20 0 EIADMM O=C([N-]c1nnc(-c2ccccc2)s1)c1coc(C2CCCC2)n1 ZINC000548935018 1031587178 /nfs/dbraw/zinc/58/71/78/1031587178.db2.gz LUQUFGOQYRSFHO-UHFFFAOYSA-N -1 1 340.408 4.103 20 0 EIADMM CC(C)CCOC1CCN(C(=O)c2cc3ccccc3cc2[O-])CC1 ZINC000193363065 1031752129 /nfs/dbraw/zinc/75/21/29/1031752129.db2.gz BMRGZXBGKYESMQ-UHFFFAOYSA-N -1 1 341.451 4.213 20 0 EIADMM COc1nccc(Nc2ccc(F)c(Br)c2[O-])c1Cl ZINC001211955833 1032011889 /nfs/dbraw/zinc/01/18/89/1032011889.db2.gz WJBZMAWTTAFACN-UHFFFAOYSA-N -1 1 347.571 4.094 20 0 EIADMM CCCC(CCC)C(=O)N1CCC(C(=O)c2ccc([O-])cc2)CC1 ZINC000134204316 1031994836 /nfs/dbraw/zinc/99/48/36/1031994836.db2.gz OWYVBAICLNIQDL-UHFFFAOYSA-N -1 1 331.456 4.030 20 0 EIADMM COCCCOc1ccc(-c2nc3sc(C)c(C)c3c(=O)[n-]2)cc1 ZINC000473443195 1033301889 /nfs/dbraw/zinc/30/18/89/1033301889.db2.gz LFUFUKPSJZRPTG-UHFFFAOYSA-N -1 1 344.436 4.096 20 0 EIADMM CCN(C(=O)c1cc(Br)ccc1[O-])[C@H]1CCCC[C@@H]1C ZINC001143552876 1033786114 /nfs/dbraw/zinc/78/61/14/1033786114.db2.gz GHAMQURGSXAQQK-FZMZJTMJSA-N -1 1 340.261 4.196 20 0 EIADMM Cc1cccc(S(=O)(=O)[N-]c2c(C)c(F)ccc2Cl)c1F ZINC000433126517 1033897987 /nfs/dbraw/zinc/89/79/87/1033897987.db2.gz ORHQDHQHHYMXEL-UHFFFAOYSA-N -1 1 331.771 4.036 20 0 EIADMM O=S(=O)(CCC1CC1)[N-]c1ccc(-c2ccc(Cl)s2)cn1 ZINC000433174620 1033991860 /nfs/dbraw/zinc/99/18/60/1033991860.db2.gz NOZIOOINAWFVPB-UHFFFAOYSA-N -1 1 342.873 4.005 20 0 EIADMM Cc1ccc([C@@H]2CC[N@@H+](Cc3nc(=O)c4sccc4[n-]3)C2)c(C)c1 ZINC000280643770 1035310887 /nfs/dbraw/zinc/31/08/87/1035310887.db2.gz ZQGUBGOHCGKZLV-CQSZACIVSA-N -1 1 339.464 4.003 20 0 EIADMM Cc1ccc([C@@H]2CCN(Cc3nc(=O)c4sccc4[n-]3)C2)c(C)c1 ZINC000280643770 1035310893 /nfs/dbraw/zinc/31/08/93/1035310893.db2.gz ZQGUBGOHCGKZLV-CQSZACIVSA-N -1 1 339.464 4.003 20 0 EIADMM CCOc1cc(-c2noc(-c3[nH]ccc3C3CC3)n2)cc(Cl)c1[O-] ZINC000420492228 1035645056 /nfs/dbraw/zinc/64/50/56/1035645056.db2.gz KMTNHELIDLPZKR-UHFFFAOYSA-N -1 1 345.786 4.367 20 0 EIADMM C[C@@H](CN1CCOc2cc(C(=O)[O-])ccc2C1)c1cccc(Cl)c1 ZINC000905798791 1035896273 /nfs/dbraw/zinc/89/62/73/1035896273.db2.gz OQOBRDOKPGBYCI-ZDUSSCGKSA-N -1 1 345.826 4.036 20 0 EIADMM CCc1oc(CN2CC=C(c3cccc(C)c3C)CC2)cc1C(=O)[O-] ZINC000905819033 1035921551 /nfs/dbraw/zinc/92/15/51/1035921551.db2.gz HUTSTNZQVJBOSY-UHFFFAOYSA-N -1 1 339.435 4.446 20 0 EIADMM Cc1oc(-c2cccs2)nc1C(=O)[N-]c1nnc(C(C)(C)C)s1 ZINC000055977246 1036348778 /nfs/dbraw/zinc/34/87/78/1036348778.db2.gz UFIQMFSBXPPLDI-UHFFFAOYSA-N -1 1 348.453 4.113 20 0 EIADMM COc1cc(O)cc(-c2nc3ccc(-c4ccccc4)cc3c(=O)[n-]2)c1 ZINC000485889827 1036355393 /nfs/dbraw/zinc/35/53/93/1036355393.db2.gz SCDJZIXLAJFXTE-UHFFFAOYSA-N -1 1 344.370 4.384 20 0 EIADMM COc1ccc2nc(NC(=O)Nc3ccc([O-])c(Cl)c3)sc2c1 ZINC000486085795 1036469675 /nfs/dbraw/zinc/46/96/75/1036469675.db2.gz GAMRXAUBORDSJG-UHFFFAOYSA-N -1 1 349.799 4.308 20 0 EIADMM CO[C@H](C)c1cccc([N-]S(=O)(=O)c2ccc(C(C)C)cc2)c1 ZINC000588833866 1036542913 /nfs/dbraw/zinc/54/29/13/1036542913.db2.gz VIXSSPSYAWVSMH-CQSZACIVSA-N -1 1 333.453 4.318 20 0 EIADMM CC(C)c1ccc(S(=O)(=O)[N-]c2cccc3c2ccn3C)cc1 ZINC000588834388 1036542993 /nfs/dbraw/zinc/54/29/93/1036542993.db2.gz JVUKFFYFUNONTR-UHFFFAOYSA-N -1 1 328.437 4.103 20 0 EIADMM CO[C@@H](C)c1cccc([N-]S(=O)(=O)c2ccc(C)c(Cl)c2)c1 ZINC000588833496 1036543987 /nfs/dbraw/zinc/54/39/87/1036543987.db2.gz MTOZPZDHDSNEPO-LBPRGKRZSA-N -1 1 339.844 4.157 20 0 EIADMM CC(C)(C)C[C@@H]1CCCN1C(=O)c1ccc(Br)c([O-])c1 ZINC000486657627 1036797590 /nfs/dbraw/zinc/79/75/90/1036797590.db2.gz ZSVUQMAOKCMREJ-LBPRGKRZSA-N -1 1 340.261 4.196 20 0 EIADMM Cc1oc(C(C)C)cc1C(=O)Nc1cccc([O-])c1Br ZINC000908708323 1036920664 /nfs/dbraw/zinc/92/06/64/1036920664.db2.gz SLJWTMXZMIDCAZ-UHFFFAOYSA-N -1 1 338.201 4.432 20 0 EIADMM CC(C)(C)OCc1ccccc1C(=O)Nc1cc([O-])c(F)cc1F ZINC000909985311 1037225502 /nfs/dbraw/zinc/22/55/02/1037225502.db2.gz ILZKRWQLGSNSQG-UHFFFAOYSA-N -1 1 335.350 4.238 20 0 EIADMM O=C([N-]c1cc(F)c(F)cc1F)c1cc(-c2cccc(F)c2)no1 ZINC000591248941 1037340054 /nfs/dbraw/zinc/34/00/54/1037340054.db2.gz SLUCNJUYQPOQRP-UHFFFAOYSA-N -1 1 336.244 4.150 20 0 EIADMM Cc1ccccc1[C@H](C)CC(=O)N=c1cc(-c2cccs2)[n-][nH]1 ZINC000604789319 1037518986 /nfs/dbraw/zinc/51/89/86/1037518986.db2.gz WCUILRZPTRMDDN-CYBMUJFWSA-N -1 1 325.437 4.001 20 0 EIADMM C[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1c([O-])cccc1F ZINC000605434699 1037788657 /nfs/dbraw/zinc/78/86/57/1037788657.db2.gz BEKGULJPHZWKQB-LBPRGKRZSA-N -1 1 331.387 4.235 20 0 EIADMM CCOc1cc(C(=O)Nc2ccc3c(c2)CCCN3)cc(Cl)c1[O-] ZINC000422810536 1037837595 /nfs/dbraw/zinc/83/75/95/1037837595.db2.gz NMXVSKUIEWXEHY-UHFFFAOYSA-N -1 1 346.814 4.055 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1CC2(CCC2)[C@H]1c1cccnc1 ZINC000912040764 1037875735 /nfs/dbraw/zinc/87/57/35/1037875735.db2.gz IYDUZXOPUPGFMF-HXUWFJFHSA-N -1 1 344.414 4.308 20 0 EIADMM O=C(Nc1ncc(C(F)(F)F)s1)Nc1ccc([O-])c(Cl)c1 ZINC000554943893 1038783870 /nfs/dbraw/zinc/78/38/70/1038783870.db2.gz FYDMZSNFQUGAMC-UHFFFAOYSA-N -1 1 337.710 4.165 20 0 EIADMM O=C(Nc1c([O-])cccc1F)c1cc(-c2ccc(Cl)s2)on1 ZINC000608366825 1038804693 /nfs/dbraw/zinc/80/46/93/1038804693.db2.gz NTQYCJHASAGIBM-UHFFFAOYSA-N -1 1 338.747 4.154 20 0 EIADMM CCCCOc1ccc(C(=O)Nc2c([O-])cccc2F)cc1OCC ZINC000608366658 1038804578 /nfs/dbraw/zinc/80/45/78/1038804578.db2.gz VPEFSNOAWQHOLK-UHFFFAOYSA-N -1 1 347.386 4.361 20 0 EIADMM C[C@H](Cc1cccc(C(F)(F)F)c1)C(=O)Nc1c([O-])cccc1F ZINC000608365892 1038804654 /nfs/dbraw/zinc/80/46/54/1038804654.db2.gz COPPTGUSTVHFOT-SNVBAGLBSA-N -1 1 341.304 4.367 20 0 EIADMM [O-]c1ccc(-c2noc(-c3ccc4c(n3)CCCC4)n2)c(Cl)c1 ZINC000445448012 1038825223 /nfs/dbraw/zinc/82/52/23/1038825223.db2.gz KCKOICHXEMZUHY-UHFFFAOYSA-N -1 1 327.771 4.036 20 0 EIADMM CC(C)n1ncc2cc(S(=O)(=O)[N-]c3ccc(Cl)cc3)ccc21 ZINC000476506671 1038888916 /nfs/dbraw/zinc/88/89/16/1038888916.db2.gz NMMXEEZGGAJIAM-UHFFFAOYSA-N -1 1 349.843 4.071 20 0 EIADMM CSCc1ccc([N-]S(=O)(=O)c2cc(Cl)ccc2C)cc1 ZINC000608955591 1038989337 /nfs/dbraw/zinc/98/93/37/1038989337.db2.gz BWMMXJGCKRNCEB-UHFFFAOYSA-N -1 1 341.885 4.312 20 0 EIADMM CC(C)c1ccccc1[N-]S(=O)(=O)c1cccc2ncccc21 ZINC000120005512 1039028133 /nfs/dbraw/zinc/02/81/33/1039028133.db2.gz DOYHMHZRCZPDCO-UHFFFAOYSA-N -1 1 326.421 4.159 20 0 EIADMM CCSc1cccc([N-]S(=O)(=O)c2ccc(C)c(F)c2)c1 ZINC000505274700 1039183810 /nfs/dbraw/zinc/18/38/10/1039183810.db2.gz OQBITKVIJHAOAZ-UHFFFAOYSA-N -1 1 325.430 4.047 20 0 EIADMM CC(C)C(=O)c1ccc([C@H](C)C(=O)Nc2ccc([O-])c(F)c2F)cc1 ZINC000456780860 1039599363 /nfs/dbraw/zinc/59/93/63/1039599363.db2.gz IZVHJMDFWXFASG-NSHDSACASA-N -1 1 347.361 4.251 20 0 EIADMM CSc1ccc(S(=O)(=O)[N-]c2ccc(C)c3ncccc23)cc1 ZINC000481863887 1039865376 /nfs/dbraw/zinc/86/53/76/1039865376.db2.gz RVWYOACGESZPCL-UHFFFAOYSA-N -1 1 344.461 4.066 20 0 EIADMM Cc1cc(-c2nc(-c3ccc([O-])cc3Cl)no2)nn1C(C)(C)C ZINC000445450126 1039905134 /nfs/dbraw/zinc/90/51/34/1039905134.db2.gz QXMHJLWQPVBPRV-UHFFFAOYSA-N -1 1 332.791 4.023 20 0 EIADMM Cc1oc([C@@H](C)[N@H+]2CC[C@H](C(F)(F)F)C3(CCC3)C2)cc1C(=O)[O-] ZINC000518201346 1040084679 /nfs/dbraw/zinc/08/46/79/1040084679.db2.gz WNZILTIDIOPEED-YGRLFVJLSA-N -1 1 345.361 4.402 20 0 EIADMM Cc1oc([C@@H](C)N2CC[C@H](C(F)(F)F)C3(CCC3)C2)cc1C(=O)[O-] ZINC000518201346 1040084699 /nfs/dbraw/zinc/08/46/99/1040084699.db2.gz WNZILTIDIOPEED-YGRLFVJLSA-N -1 1 345.361 4.402 20 0 EIADMM CC(C)[C@@H](Cc1ccccc1)C(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC000477131987 1040251419 /nfs/dbraw/zinc/25/14/19/1040251419.db2.gz IXLPITVYJSPZOI-GOSISDBHSA-N -1 1 349.434 4.236 20 0 EIADMM CCc1ccccc1C(=O)Nc1cc(C)cc(Br)c1[O-] ZINC000482608874 1040378987 /nfs/dbraw/zinc/37/89/87/1040378987.db2.gz SBXDIDUGIOQGEE-UHFFFAOYSA-N -1 1 334.213 4.278 20 0 EIADMM Cc1cc(Br)c([O-])c(NC(=O)c2ccc(F)cc2C)c1 ZINC000482706954 1040433083 /nfs/dbraw/zinc/43/30/83/1040433083.db2.gz KMDVMUNSXOSMGH-UHFFFAOYSA-N -1 1 338.176 4.163 20 0 EIADMM CCCc1ccccc1[N-]S(=O)(=O)c1ccc2ncsc2c1 ZINC000479532685 1040458147 /nfs/dbraw/zinc/45/81/47/1040458147.db2.gz YQYISKPLOPUSMY-UHFFFAOYSA-N -1 1 332.450 4.050 20 0 EIADMM C[C@@H](Sc1nc(C2CC2)cc(=O)[n-]1)c1nccn1-c1ccccc1 ZINC000553769862 1040503774 /nfs/dbraw/zinc/50/37/74/1040503774.db2.gz KMZFRCZAVGYQNF-GFCCVEGCSA-N -1 1 338.436 4.099 20 0 EIADMM Cc1ccc2c(c1)CC[C@H]2Nc1ccc(-c2nc(C)c(C)c(=O)[n-]2)cn1 ZINC000462386399 1040552953 /nfs/dbraw/zinc/55/29/53/1040552953.db2.gz DHIHTURGYGWJRF-GOSISDBHSA-N -1 1 346.434 4.269 20 0 EIADMM CSCc1ccc([N-]S(=O)(=O)c2ccc(C(F)F)cc2)cc1 ZINC000567100237 1040662039 /nfs/dbraw/zinc/66/20/39/1040662039.db2.gz YACJEQFBKDNJMA-UHFFFAOYSA-N -1 1 343.420 4.288 20 0 EIADMM C[C@@H](C(=O)N=c1cc(-c2cccs2)[n-][nH]1)c1cc2ccccc2o1 ZINC000483224816 1040767083 /nfs/dbraw/zinc/76/70/83/1040767083.db2.gz ZDQYUYIJKYIGCK-LLVKDONJSA-N -1 1 337.404 4.049 20 0 EIADMM [O-]c1ccc(-c2noc(CCCOc3ccccc3Cl)n2)c(F)c1 ZINC000445454614 1040791887 /nfs/dbraw/zinc/79/18/87/1040791887.db2.gz GULHKJCJAORRGV-UHFFFAOYSA-N -1 1 348.761 4.246 20 0 EIADMM O=C([O-])c1ccoc1CN(Cc1ccccc1C(F)(F)F)C1CC1 ZINC000515490377 1040811210 /nfs/dbraw/zinc/81/12/10/1040811210.db2.gz MTCLPLKIGCZLSV-UHFFFAOYSA-N -1 1 339.313 4.161 20 0 EIADMM CSc1ccccc1S(=O)(=O)[N-]c1ccc(C(F)(F)F)cc1 ZINC000436030145 1040822415 /nfs/dbraw/zinc/82/24/15/1040822415.db2.gz ZQLJLKHKWLRYKU-UHFFFAOYSA-N -1 1 347.383 4.228 20 0 EIADMM COc1ccc(CCc2nc(-c3ccc([O-])cc3F)no2)cc1Cl ZINC000445463412 1040899791 /nfs/dbraw/zinc/89/97/91/1040899791.db2.gz ORQMPTQFOIAKSK-UHFFFAOYSA-N -1 1 348.761 4.029 20 0 EIADMM Cc1cc2cc[nH]c2cc1[N-]S(=O)(=O)c1ccc(CC(C)C)cc1 ZINC000436186232 1040929703 /nfs/dbraw/zinc/92/97/03/1040929703.db2.gz GDDXEPGKBGAUKY-UHFFFAOYSA-N -1 1 342.464 4.476 20 0 EIADMM Cc1nc(-c2ccc(N[C@H](C)C3CCC(F)CC3)nc2)[n-]c(=O)c1C ZINC000664540566 1041073556 /nfs/dbraw/zinc/07/35/56/1041073556.db2.gz XLEWSJMHKQFIEM-VQCLRJIVSA-N -1 1 344.434 4.190 20 0 EIADMM C/C(=C/c1ccc(Cl)cc1)CN[C@H](C)c1ncc(C(=O)[O-])s1 ZINC000904021613 1041265648 /nfs/dbraw/zinc/26/56/48/1041265648.db2.gz ZFOMOSNYIXKLOC-ZJRUKIMVSA-N -1 1 336.844 4.249 20 0 EIADMM COC(=O)c1ccc([O-])c(NC(=O)[C@H](C)c2ccc3ccccc3c2)c1 ZINC000436515671 1041299544 /nfs/dbraw/zinc/29/95/44/1041299544.db2.gz SOINAFDVFNOUQN-CYBMUJFWSA-N -1 1 349.386 4.074 20 0 EIADMM C[C@H](NC(=O)c1ccc(Cl)cc1[O-])c1ncc(-c2ccccc2)o1 ZINC000436531875 1041315899 /nfs/dbraw/zinc/31/58/99/1041315899.db2.gz QDNSKSHUZGGVQE-NSHDSACASA-N -1 1 342.782 4.192 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1CC[C@H](Cc2ccc(F)cc2)C1 ZINC000436534918 1041317656 /nfs/dbraw/zinc/31/76/56/1041317656.db2.gz JCXARIBHMOJPIG-MRXNPFEDSA-N -1 1 349.405 4.389 20 0 EIADMM Cc1ccccc1[C@@]1(F)CCN(C(=O)c2cc(Cl)ccc2[O-])C1 ZINC000436516034 1041320137 /nfs/dbraw/zinc/32/01/37/1041320137.db2.gz TWRSCDULNIXNFP-GOSISDBHSA-N -1 1 333.790 4.065 20 0 EIADMM C[C@@H]1C[C@@H](c2ccc(F)cc2)CN1C(=O)c1ccc(Cl)cc1[O-] ZINC000436536505 1041320466 /nfs/dbraw/zinc/32/04/66/1041320466.db2.gz MOARQGDRSDEJOV-DGCLKSJQSA-N -1 1 333.790 4.203 20 0 EIADMM Cc1ccccc1C[C@@H]1CCCN1C(=O)c1ccc(Cl)cc1[O-] ZINC000436551648 1041324792 /nfs/dbraw/zinc/32/47/92/1041324792.db2.gz QIIZCFATSBFYDF-INIZCTEOSA-N -1 1 329.827 4.201 20 0 EIADMM C[C@@H]1[C@H](Cc2ccccc2)CCN1C(=O)c1ccc(Cl)cc1[O-] ZINC000436576273 1041340195 /nfs/dbraw/zinc/34/01/95/1041340195.db2.gz PBFUWOACWFWKHO-HIFRSBDPSA-N -1 1 329.827 4.139 20 0 EIADMM O=C(Nc1ccc(-c2cnco2)cc1)c1ccc2ccccc2c1[O-] ZINC000436562752 1041342935 /nfs/dbraw/zinc/34/29/35/1041342935.db2.gz KAZDIJQVXMDLCK-UHFFFAOYSA-N -1 1 330.343 4.453 20 0 EIADMM C[C@H]1CN(C(=O)c2ccc3ccccc3c2[O-])[C@H](c2ccccc2)CO1 ZINC000436577321 1041344405 /nfs/dbraw/zinc/34/44/05/1041344405.db2.gz TVRSFVFKGKEEOT-YWZLYKJASA-N -1 1 347.414 4.148 20 0 EIADMM Cc1csc([C@@H](NC(=O)c2cc3ccccc3cc2[O-])C2CC2)n1 ZINC000436592663 1041351177 /nfs/dbraw/zinc/35/11/77/1041351177.db2.gz XIXYWVOYEXHWHU-KRWDZBQOSA-N -1 1 338.432 4.191 20 0 EIADMM C[C@H]1CN(C(=O)c2cc(Cl)ccc2[O-])CC[C@H]1c1ccccc1 ZINC000436592117 1041352503 /nfs/dbraw/zinc/35/25/03/1041352503.db2.gz ZOYZSBRDFWMXCX-XJKSGUPXSA-N -1 1 329.827 4.311 20 0 EIADMM CC(C)c1csc(CNC(=O)c2cc3ccccc3cc2[O-])n1 ZINC000436596833 1041353807 /nfs/dbraw/zinc/35/38/07/1041353807.db2.gz NUSBUBRGFQDDCY-UHFFFAOYSA-N -1 1 326.421 4.055 20 0 EIADMM O=C(N[C@H]1CCOC2(CCCCC2)C1)c1cc2ccccc2cc1[O-] ZINC000436598499 1041354975 /nfs/dbraw/zinc/35/49/75/1041354975.db2.gz ZNRANRICWWECIJ-KRWDZBQOSA-N -1 1 339.435 4.157 20 0 EIADMM CC[C@H]1CCCC[C@@H]1c1noc(-c2cc(NC(C)=O)ccc2[O-])n1 ZINC000436596170 1041355420 /nfs/dbraw/zinc/35/54/20/1041355420.db2.gz PJBRUDKWKSUTTO-JSGCOSHPSA-N -1 1 329.400 4.084 20 0 EIADMM Cc1c[nH]c(-c2ccccc2NC(=O)c2ccc3ccccc3c2[O-])n1 ZINC000436594373 1041355449 /nfs/dbraw/zinc/35/54/49/1041355449.db2.gz IUCSEIYXTRFMFU-UHFFFAOYSA-N -1 1 343.386 4.496 20 0 EIADMM O=C(Nc1c[nH]nc1-c1ccccc1)c1cc2ccccc2cc1[O-] ZINC000436600479 1041366338 /nfs/dbraw/zinc/36/63/38/1041366338.db2.gz FOIWATHCDYXHGB-UHFFFAOYSA-N -1 1 329.359 4.188 20 0 EIADMM O=C(c1cc(F)ccc1[O-])N1CCCC[C@H]1CCc1ccccc1 ZINC000436609815 1041370469 /nfs/dbraw/zinc/37/04/69/1041370469.db2.gz WMHVGDCQZKNBMX-KRWDZBQOSA-N -1 1 327.399 4.159 20 0 EIADMM CC1=C(c2ccco2)CN(C(=O)c2cc3ccccc3cc2[O-])CC1 ZINC000436628959 1041378718 /nfs/dbraw/zinc/37/87/18/1041378718.db2.gz HEXMIBYDGIAVGJ-UHFFFAOYSA-N -1 1 333.387 4.458 20 0 EIADMM Cc1ccc(Cc2ccccn2)cc1NC(=O)c1cc(F)ccc1[O-] ZINC000436682588 1041419792 /nfs/dbraw/zinc/41/97/92/1041419792.db2.gz QXFVSHVPSBRJQY-UHFFFAOYSA-N -1 1 336.366 4.078 20 0 EIADMM CCOc1cc(-c2nc(Cc3cccc(F)c3)no2)cc(Cl)c1[O-] ZINC000436687146 1041420772 /nfs/dbraw/zinc/42/07/72/1041420772.db2.gz JVLMNKVZRBMFGV-UHFFFAOYSA-N -1 1 348.761 4.224 20 0 EIADMM CCOc1cc(NC(=O)c2ccc(C(C)C)cc2[O-])ccc1OC ZINC000436708394 1041425551 /nfs/dbraw/zinc/42/55/51/1041425551.db2.gz JVALQBDAYUMDFF-UHFFFAOYSA-N -1 1 329.396 4.175 20 0 EIADMM CN(Cc1cccc2ccccc21)C(=O)c1cc(Cl)ccc1[O-] ZINC000436714807 1041438879 /nfs/dbraw/zinc/43/88/79/1041438879.db2.gz VFTZXJWGFOROGK-UHFFFAOYSA-N -1 1 325.795 4.471 20 0 EIADMM Cc1ccc(-c2cc(C(=O)Nc3ccc([O-])c(Cl)c3)n[nH]2)c(C)c1 ZINC000436741886 1041449939 /nfs/dbraw/zinc/44/99/39/1041449939.db2.gz DGNXUHIRVOJPQP-UHFFFAOYSA-N -1 1 341.798 4.305 20 0 EIADMM O=C(Nc1cccc(Cl)c1OCC(F)F)c1ccc([O-])cc1F ZINC000436750439 1041463745 /nfs/dbraw/zinc/46/37/45/1041463745.db2.gz WXPZHJOWKUHCFT-UHFFFAOYSA-N -1 1 345.704 4.081 20 0 EIADMM O=C(Nc1cc(Cl)c([O-])c2ccccc12)[C@H]1CCOC2(CCC2)C1 ZINC000899051601 1041504294 /nfs/dbraw/zinc/50/42/94/1041504294.db2.gz YYCIYRLUOWIIAT-LBPRGKRZSA-N -1 1 345.826 4.487 20 0 EIADMM CCc1c(C)sc2nc(-c3cccc(C(F)(F)F)n3)[n-]c(=O)c21 ZINC000540507737 1041505744 /nfs/dbraw/zinc/50/57/44/1041505744.db2.gz FUEFSVINRGQLDE-UHFFFAOYSA-N -1 1 339.342 4.349 20 0 EIADMM CC(C)n1nc2c(c1NC(=O)c1ccc3ccccc3c1[O-])CCC2 ZINC000436856576 1041506776 /nfs/dbraw/zinc/50/67/76/1041506776.db2.gz MKQJFIYDXWCPNT-UHFFFAOYSA-N -1 1 335.407 4.064 20 0 EIADMM O=C(Nc1ncc(-c2cccnc2)s1)c1cc2ccccc2cc1[O-] ZINC000436839841 1041508362 /nfs/dbraw/zinc/50/83/62/1041508362.db2.gz NIVOYWZUWOEWOB-UHFFFAOYSA-N -1 1 347.399 4.316 20 0 EIADMM CC[C@H](c1ccccc1OC)N(C)C(=O)c1cc(Cl)ccc1[O-] ZINC000436848389 1041515730 /nfs/dbraw/zinc/51/57/30/1041515730.db2.gz OHIJJCKRGGZBAZ-OAHLLOKOSA-N -1 1 333.815 4.278 20 0 EIADMM Cc1ccc([C@@H]2CCN(C(=O)c3cc(Cl)ccc3[O-])C2)c(C)c1 ZINC000436851155 1041517991 /nfs/dbraw/zinc/51/79/91/1041517991.db2.gz KAZZELZBAOPYHK-CQSZACIVSA-N -1 1 329.827 4.292 20 0 EIADMM [O-]c1ccc(-c2noc(C3CCC(OC(F)F)CC3)n2)c(Cl)c1 ZINC000436869822 1041526988 /nfs/dbraw/zinc/52/69/88/1041526988.db2.gz FHHXABSRTUCPFK-UHFFFAOYSA-N -1 1 344.745 4.361 20 0 EIADMM [O-]c1ccc(-c2noc(CCCc3ccc(O)c(F)c3)n2)c(Cl)c1 ZINC000436874367 1041533243 /nfs/dbraw/zinc/53/32/43/1041533243.db2.gz UDDVJUXYCRSYAD-UHFFFAOYSA-N -1 1 348.761 4.116 20 0 EIADMM COC(=O)c1ccc(-c2noc(-c3ccc4ccccc4c3[O-])n2)cc1 ZINC000436895237 1041534389 /nfs/dbraw/zinc/53/43/89/1041534389.db2.gz WBZSCMCOWXCCIC-UHFFFAOYSA-N -1 1 346.342 4.049 20 0 EIADMM Cc1ccc(C(=O)CCCc2nc(-c3ccc([O-])c(F)c3)no2)cc1 ZINC000436877873 1041536165 /nfs/dbraw/zinc/53/61/65/1041536165.db2.gz IBLRSAWATVDEFV-UHFFFAOYSA-N -1 1 340.354 4.095 20 0 EIADMM [O-]c1ccc(-c2noc([C@H]3C[C@@H]3c3ccc(F)cc3F)n2)cc1F ZINC000436877481 1041537561 /nfs/dbraw/zinc/53/75/61/1041537561.db2.gz GOYHEGCDKAHCMC-NEPJUHHUSA-N -1 1 332.281 4.131 20 0 EIADMM CN(C)c1ccc(-c2noc(-c3ccc4ccccc4c3[O-])n2)cc1 ZINC000436891414 1041544933 /nfs/dbraw/zinc/54/49/33/1041544933.db2.gz IKCNPSIBOQZNDI-UHFFFAOYSA-N -1 1 331.375 4.328 20 0 EIADMM CC(C)COc1ccccc1-c1noc(-c2cc(F)ccc2[O-])n1 ZINC000436913060 1041550471 /nfs/dbraw/zinc/55/04/71/1041550471.db2.gz YNUIEWPBFZLZJR-UHFFFAOYSA-N -1 1 328.343 4.283 20 0 EIADMM Cc1ccc(C(=O)Nc2c([O-])cc(Br)cc2Cl)cc1 ZINC000552025858 1041555425 /nfs/dbraw/zinc/55/54/25/1041555425.db2.gz NWNBOKRGGBNVKM-UHFFFAOYSA-N -1 1 340.604 4.369 20 0 EIADMM CCOc1ncccc1-c1noc(-c2ccc3ccccc3c2[O-])n1 ZINC000436914823 1041556443 /nfs/dbraw/zinc/55/64/43/1041556443.db2.gz LJFHVRKORGBUSR-UHFFFAOYSA-N -1 1 333.347 4.056 20 0 EIADMM Cc1cc(-c2noc(-c3ccc4ccccc4c3[O-])n2)cc2[nH]cnc21 ZINC000436932948 1041563492 /nfs/dbraw/zinc/56/34/92/1041563492.db2.gz RNKJOLSLJQKKTM-UHFFFAOYSA-N -1 1 342.358 4.447 20 0 EIADMM CCn1ncc2ccc(NC(=O)c3ccc4ccccc4c3[O-])cc21 ZINC000436941822 1041568662 /nfs/dbraw/zinc/56/86/62/1041568662.db2.gz GEFJSPJZCUFCHZ-UHFFFAOYSA-N -1 1 331.375 4.167 20 0 EIADMM C[C@@]1(c2ccccc2)CCCN(C(=O)c2ccc(Cl)cc2[O-])C1 ZINC000436946275 1041568686 /nfs/dbraw/zinc/56/86/86/1041568686.db2.gz AFEHVVDSAWZLJP-LJQANCHMSA-N -1 1 329.827 4.240 20 0 EIADMM Cc1ccccc1C1=CCN(C(=O)c2cc3ccccc3cc2[O-])C1 ZINC000436954992 1041574680 /nfs/dbraw/zinc/57/46/80/1041574680.db2.gz BRCKSSZFUYLDIH-UHFFFAOYSA-N -1 1 329.399 4.393 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2cc(C)c(C)c3ncccc23)cc1C ZINC000437323335 1041755857 /nfs/dbraw/zinc/75/58/57/1041755857.db2.gz BLUWRFNLMGKGJW-UHFFFAOYSA-N -1 1 340.448 4.269 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccccc2SC(F)F)cc1C ZINC000007055892 1042143563 /nfs/dbraw/zinc/14/35/63/1042143563.db2.gz SKYVNCMMQYPXAO-UHFFFAOYSA-N -1 1 343.420 4.419 20 0 EIADMM Cc1cc(O[C@H](C)C(=O)Nc2ccc([O-])c(Cl)c2)ccc1Cl ZINC000541887483 1042165610 /nfs/dbraw/zinc/16/56/10/1042165610.db2.gz VAUXZBWINIKOGI-SNVBAGLBSA-N -1 1 340.206 4.413 20 0 EIADMM Cc1cc(O[C@@H](C)C(=O)Nc2ccc([O-])c(Cl)c2)ccc1Cl ZINC000541887482 1042166167 /nfs/dbraw/zinc/16/61/67/1042166167.db2.gz VAUXZBWINIKOGI-JTQLQIEISA-N -1 1 340.206 4.413 20 0 EIADMM O=C(c1ccc(C(F)(F)F)cc1[O-])N1CCCC2(CCCC2)C1 ZINC000438688320 1042310090 /nfs/dbraw/zinc/31/00/90/1042310090.db2.gz VJFLIYQANBRHAP-UHFFFAOYSA-N -1 1 327.346 4.207 20 0 EIADMM CCc1ccc(S(=O)(=O)[N-]c2cccc(CC(F)(F)F)c2)cc1 ZINC000438776123 1042342757 /nfs/dbraw/zinc/34/27/57/1042342757.db2.gz HVBCTKUPFALNAP-UHFFFAOYSA-N -1 1 343.370 4.155 20 0 EIADMM CC(C)(C)c1ccc(S(=O)(=O)[N-]c2ccc(F)cc2F)s1 ZINC000439044681 1042475089 /nfs/dbraw/zinc/47/50/89/1042475089.db2.gz QIFUGSGHFUYAIL-UHFFFAOYSA-N -1 1 331.409 4.125 20 0 EIADMM CCCCC[C@@H]1CCCN1C(=O)c1ccc(Br)c([O-])c1 ZINC000491823458 1042501918 /nfs/dbraw/zinc/50/19/18/1042501918.db2.gz BGVFCKBFEZWEDW-CYBMUJFWSA-N -1 1 340.261 4.340 20 0 EIADMM C[C@H](CNC(=O)c1ccc([O-])cc1F)c1ccc(C(F)(F)F)cc1 ZINC000189917078 1042815127 /nfs/dbraw/zinc/81/51/27/1042815127.db2.gz PYSIITGBWKRNBX-SNVBAGLBSA-N -1 1 341.304 4.084 20 0 EIADMM CCN(Cc1ccc(OC)cc1)C(=O)c1cc2ccccc2cc1[O-] ZINC000220099991 1043290543 /nfs/dbraw/zinc/29/05/43/1043290543.db2.gz WIHGDMDHTYWDSX-UHFFFAOYSA-N -1 1 335.403 4.216 20 0 EIADMM C[C@H](C(=O)N=c1cc(-c2cccs2)[n-][nH]1)c1ccc(Cl)s1 ZINC000428028276 1043302259 /nfs/dbraw/zinc/30/22/59/1043302259.db2.gz ROYBMICDZBTYHM-QMMMGPOBSA-N -1 1 337.857 4.017 20 0 EIADMM O=S(=O)(/C=C\c1ccc(Cl)cc1)[N-]c1cc(Cl)ccc1O ZINC000728149911 1043377180 /nfs/dbraw/zinc/37/71/80/1043377180.db2.gz VCQXMKHAGLJJFR-FPLPWBNLSA-N -1 1 344.219 4.112 20 0 EIADMM Cc1cccc(F)c1[N-]S(=O)(=O)c1cc(Cl)sc1Cl ZINC000494345953 1043423617 /nfs/dbraw/zinc/42/36/17/1043423617.db2.gz GCZZLABMDMOUTJ-UHFFFAOYSA-N -1 1 340.228 4.303 20 0 EIADMM [O-]c1cccnc1-c1nc(-c2ccc(Cl)cc2C(F)(F)F)no1 ZINC001212480850 1043437888 /nfs/dbraw/zinc/43/78/88/1043437888.db2.gz MIAWQILRXZZXSS-UHFFFAOYSA-N -1 1 341.676 4.176 20 0 EIADMM Fc1cccc(F)c1-c1ccc(C[N-]c2nnc(C(F)F)o2)o1 ZINC000189290398 1043529738 /nfs/dbraw/zinc/52/97/38/1043529738.db2.gz CQNHDADCMBCIDG-UHFFFAOYSA-N -1 1 327.237 4.158 20 0 EIADMM FC(F)c1nnc([N-]Cc2ccc(-c3nc4ccccc4s3)o2)o1 ZINC000189299636 1043533907 /nfs/dbraw/zinc/53/39/07/1043533907.db2.gz FMLBWIPAQCEDPW-UHFFFAOYSA-N -1 1 348.334 4.489 20 0 EIADMM CC(C)c1ocnc1C(=O)[N-]c1nc(-c2cccc(Cl)c2)ns1 ZINC000731982715 1043859431 /nfs/dbraw/zinc/85/94/31/1043859431.db2.gz CELPBQRALWACMA-UHFFFAOYSA-N -1 1 348.815 4.222 20 0 EIADMM COc1cc(C(=O)N2CCC[C@H]2c2ccsc2)cc(Cl)c1[O-] ZINC000442865607 1043868182 /nfs/dbraw/zinc/86/81/82/1043868182.db2.gz IMRWBDBEJVESIH-ZDUSSCGKSA-N -1 1 337.828 4.093 20 0 EIADMM O=C(Nc1cnc(-c2ccccc2)nc1)Nc1ccc([O-])c(Cl)c1 ZINC000192204695 1043892917 /nfs/dbraw/zinc/89/29/17/1043892917.db2.gz NWPFUWLLKKGRJE-UHFFFAOYSA-N -1 1 340.770 4.147 20 0 EIADMM CCCOc1ccc(C(=O)Nc2ccc([O-])c(Cl)c2)cc1OCC ZINC000732309817 1043894634 /nfs/dbraw/zinc/89/46/34/1043894634.db2.gz YPULAUDMRAODHK-UHFFFAOYSA-N -1 1 349.814 4.485 20 0 EIADMM COc1cc(C(=O)N[C@@H]2CC(C)(C)c3ccccc32)cc(Cl)c1[O-] ZINC000443057892 1043994803 /nfs/dbraw/zinc/99/48/03/1043994803.db2.gz LJZXYDAZUWKFLR-OAHLLOKOSA-N -1 1 345.826 4.207 20 0 EIADMM COc1cc(-c2nc(-c3ccccc3Cl)no2)cc(Cl)c1[O-] ZINC000443098185 1044029106 /nfs/dbraw/zinc/02/91/06/1044029106.db2.gz ZEXISCXOKUOCJO-UHFFFAOYSA-N -1 1 337.162 4.425 20 0 EIADMM CCOc1cc(-c2nc(-c3ccncc3CC)no2)cc(Cl)c1[O-] ZINC000443198969 1044086838 /nfs/dbraw/zinc/08/68/38/1044086838.db2.gz QERASDWHXSBPMF-UHFFFAOYSA-N -1 1 345.786 4.119 20 0 EIADMM COc1cc(-c2nc(Cc3cccc(C)c3)no2)cc(Cl)c1[O-] ZINC000443204383 1044094948 /nfs/dbraw/zinc/09/49/48/1044094948.db2.gz OOQIAIPZVZFKMC-UHFFFAOYSA-N -1 1 330.771 4.003 20 0 EIADMM COc1cc(C(=O)N(C)C2CCC(C)(C)CC2)cc(Cl)c1[O-] ZINC000443291457 1044161638 /nfs/dbraw/zinc/16/16/38/1044161638.db2.gz FTHQXVQGKWWHIM-UHFFFAOYSA-N -1 1 325.836 4.095 20 0 EIADMM COc1ccc(S(=O)(=O)[N-]c2cccc3ccsc32)c(C)c1 ZINC000443464396 1044347697 /nfs/dbraw/zinc/34/76/97/1044347697.db2.gz FKTVSYCMSHHENS-UHFFFAOYSA-N -1 1 333.434 4.019 20 0 EIADMM COC(=O)c1c[n-]c(SC[C@@H](C)c2ccc(C(F)(F)F)cc2)n1 ZINC000443467894 1044356558 /nfs/dbraw/zinc/35/65/58/1044356558.db2.gz NMWWGFNMPCQNTN-SECBINFHSA-N -1 1 344.358 4.111 20 0 EIADMM O=C(c1cc(Cl)ccc1[O-])N1CC[C@@H](C(F)(F)F)C2(CCC2)C1 ZINC000282652009 1044368798 /nfs/dbraw/zinc/36/87/98/1044368798.db2.gz CJDPFQIEMWKACQ-CYBMUJFWSA-N -1 1 347.764 4.240 20 0 EIADMM Cc1nc(-c2ccc(N[C@@H]3CC[C@@H](C)[C@@H](C)C3)nc2)[n-]c(=O)c1C ZINC000543450979 1044621822 /nfs/dbraw/zinc/62/18/22/1044621822.db2.gz AFTFCSDRKVUQSQ-BFQNTYOBSA-N -1 1 326.444 4.098 20 0 EIADMM CCCN(C(=O)c1ncc(C)cc1[O-])[C@@H](C)c1cc2ccccc2o1 ZINC000495138523 1044712159 /nfs/dbraw/zinc/71/21/59/1044712159.db2.gz NWXGFKGYTMTDML-AWEZNQCLSA-N -1 1 338.407 4.455 20 0 EIADMM COc1ccc2nc(-c3cccc(-c4cscn4)c3)[n-]c(=O)c2c1 ZINC000481546702 1044715989 /nfs/dbraw/zinc/71/59/89/1044715989.db2.gz MBPLDTQPPDXDES-UHFFFAOYSA-N -1 1 335.388 4.135 20 0 EIADMM [O-]c1ccc(-c2nc(-c3ccc(Br)cc3)no2)c(F)c1 ZINC000230226114 1044809463 /nfs/dbraw/zinc/80/94/63/1044809463.db2.gz UATUWINBIYMKLV-UHFFFAOYSA-N -1 1 335.132 4.011 20 0 EIADMM Cc1c(C(=O)Nc2cc([O-])c(F)cc2F)cccc1-c1ccccn1 ZINC001141833967 1044853584 /nfs/dbraw/zinc/85/35/84/1044853584.db2.gz QHIDZUNBPPYKAZ-UHFFFAOYSA-N -1 1 340.329 4.293 20 0 EIADMM COc1ccc(C(=O)N2CCCc3cc(C(C)C)ccc32)c([O-])c1 ZINC000915165944 1045147766 /nfs/dbraw/zinc/14/77/66/1045147766.db2.gz RAJZKMJWRUOSAV-UHFFFAOYSA-N -1 1 325.408 4.117 20 0 EIADMM CC(=O)Nc1ccc([O-])c(-c2nc(C3CCCCCCC3)no2)c1 ZINC000762358886 1045200703 /nfs/dbraw/zinc/20/07/03/1045200703.db2.gz TXKGBQHAGSOTDH-UHFFFAOYSA-N -1 1 329.400 4.229 20 0 EIADMM CC(C)COc1ccc(CC(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000533540260 1045557245 /nfs/dbraw/zinc/55/72/45/1045557245.db2.gz WVEFNHSJBGFHGC-UHFFFAOYSA-N -1 1 333.815 4.262 20 0 EIADMM CC(C)(C)OC(=O)Nc1ccc(NC(=O)c2ccc([O-])c(F)c2)cc1 ZINC000767959784 1045691975 /nfs/dbraw/zinc/69/19/75/1045691975.db2.gz VWXRCNFXKANKEB-UHFFFAOYSA-N -1 1 346.358 4.131 20 0 EIADMM C[C@@]1(c2noc(-c3cc(Oc4ccccc4)ccc3[O-])n2)CCCO1 ZINC000763314475 1045822115 /nfs/dbraw/zinc/82/21/15/1045822115.db2.gz BZEIAPXLBYIUIB-IBGZPJMESA-N -1 1 338.363 4.260 20 0 EIADMM Cc1ccc(F)cc1-c1nnc([N-]C(=O)c2ncoc2C(C)C)s1 ZINC000791878650 1045838718 /nfs/dbraw/zinc/83/87/18/1045838718.db2.gz UDBCBCRWFRRMSU-UHFFFAOYSA-N -1 1 346.387 4.016 20 0 EIADMM C[C@@H]([N-]C(=O)C(F)(F)c1cccc(Cl)c1)c1ccc(Cl)cn1 ZINC000792450078 1045897607 /nfs/dbraw/zinc/89/76/07/1045897607.db2.gz MDRLHUPRQHTSCH-SECBINFHSA-N -1 1 345.176 4.358 20 0 EIADMM C[C@@H]1CCCCCN1C(=O)c1ccc(NC(=O)OC(C)(C)C)cc1[O-] ZINC000769858086 1046083371 /nfs/dbraw/zinc/08/33/71/1046083371.db2.gz FPAYXENNLPKNJX-CYBMUJFWSA-N -1 1 348.443 4.144 20 0 EIADMM O=C(c1ncc2ccccc2c1[O-])N1CCC[C@@H]1CCc1ccccc1 ZINC001626113109 1046123547 /nfs/dbraw/zinc/12/35/47/1046123547.db2.gz IRZDFIFRPHVYTA-GOSISDBHSA-N -1 1 346.430 4.178 20 0 EIADMM CCCN(CC(=O)[O-])Cc1ccc(-c2cccc(C(F)(F)F)c2)o1 ZINC000263382010 1046279758 /nfs/dbraw/zinc/27/97/58/1046279758.db2.gz BVTLHWMVCFHTRC-UHFFFAOYSA-N -1 1 341.329 4.262 20 0 EIADMM CC(C)(C)C[C@@H]([N-]C(=O)C(F)(F)Cc1ccccc1)C(F)(F)F ZINC000793779071 1046338180 /nfs/dbraw/zinc/33/81/80/1046338180.db2.gz FOGPKYPYXGXJNX-GFCCVEGCSA-N -1 1 337.332 4.348 20 0 EIADMM Cc1oc(-c2cccs2)nc1-c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000771222698 1046355028 /nfs/dbraw/zinc/35/50/28/1046355028.db2.gz HQWUHEXPJSOBSR-UHFFFAOYSA-N -1 1 343.339 4.273 20 0 EIADMM O=S(=O)([N-]c1ccc(-c2ccc[nH]2)cc1)c1ccc(Cl)cc1 ZINC000537157959 1046992988 /nfs/dbraw/zinc/99/29/88/1046992988.db2.gz GFQVCXQVTKHELH-UHFFFAOYSA-N -1 1 332.812 4.136 20 0 EIADMM O=C(Nc1cc(Cl)cc(Cl)c1[O-])c1c(O)cccc1Cl ZINC000760428303 1047369227 /nfs/dbraw/zinc/36/92/27/1047369227.db2.gz ZYILZJUIHHQHQD-UHFFFAOYSA-N -1 1 332.570 4.310 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1csc(Br)c1 ZINC000129598561 1047444109 /nfs/dbraw/zinc/44/41/09/1047444109.db2.gz CUFMSAHNJVFZES-UHFFFAOYSA-N -1 1 332.606 4.122 20 0 EIADMM CC(C)c1cccc(S(=O)(=O)[N-]c2ccc3ncsc3c2)c1 ZINC000460425709 1047782148 /nfs/dbraw/zinc/78/21/48/1047782148.db2.gz LZIITWYZXFLARH-UHFFFAOYSA-N -1 1 332.450 4.221 20 0 EIADMM O=C(N[C@@H]1CCO[C@@H](c2ccccc2)C1)c1ccc2ccccc2c1[O-] ZINC000131128729 1047831920 /nfs/dbraw/zinc/83/19/20/1047831920.db2.gz ZGBWTABOEKCARG-YLJYHZDGSA-N -1 1 347.414 4.196 20 0 EIADMM CCCN(C(=O)c1ccc([O-])c(F)c1)[C@H]1C[C@@H](OCC)C12CCCC2 ZINC001136843891 1047847274 /nfs/dbraw/zinc/84/72/74/1047847274.db2.gz CXLVNGSMMWCBAP-ZWKOTPCHSA-N -1 1 349.446 4.121 20 0 EIADMM Cc1ccc(-c2nc(C(=O)[N-]c3c(F)cc(F)cc3F)cs2)o1 ZINC000072506490 1047926292 /nfs/dbraw/zinc/92/62/92/1047926292.db2.gz GRIADZJGHVKDNF-UHFFFAOYSA-N -1 1 338.310 4.381 20 0 EIADMM COc1ccc2ccc(C(=O)Nc3ccc([O-])c(Cl)c3)cc2c1 ZINC000814311516 1047954076 /nfs/dbraw/zinc/95/40/76/1047954076.db2.gz FBPNMTGESZESOZ-UHFFFAOYSA-N -1 1 327.767 4.460 20 0 EIADMM Cc1ccc([C@H]2CCC[C@H]2N(C)C(=O)c2ccc(F)c([O-])c2)cc1 ZINC001136989529 1048035209 /nfs/dbraw/zinc/03/52/09/1048035209.db2.gz JKDDAAFEMRIPOG-SJLPKXTDSA-N -1 1 327.399 4.248 20 0 EIADMM Cc1nc(C(C)C)[n-]c(=O)c1C(=O)N[C@@H](C1CCC1)C1CCCCC1 ZINC000844054144 1048183354 /nfs/dbraw/zinc/18/33/54/1048183354.db2.gz YAQBPOPZEDAGMS-QGZVFWFLSA-N -1 1 345.487 4.093 20 0 EIADMM Cc1c[nH]c(-c2ccc(NC(=O)c3ccc4ccccc4c3[O-])cc2)n1 ZINC001143948593 1048306176 /nfs/dbraw/zinc/30/61/76/1048306176.db2.gz ADUBWBAVCQTHDE-UHFFFAOYSA-N -1 1 343.386 4.496 20 0 EIADMM [O-]c1cccc(CNc2ccc(OC[C@H]3CCCO3)cc2)c1Cl ZINC000815127227 1048341697 /nfs/dbraw/zinc/34/16/97/1048341697.db2.gz ZLRSSNFPRAMURF-MRXNPFEDSA-N -1 1 333.815 4.216 20 0 EIADMM Cc1nc(-c2ccc([N-]S(=O)(=O)c3cccc(C)c3)cc2)oc1C ZINC000919958679 1048344410 /nfs/dbraw/zinc/34/44/10/1048344410.db2.gz XROQRWIRAHBDHO-UHFFFAOYSA-N -1 1 342.420 4.068 20 0 EIADMM CCCc1ccc(S(=O)(=O)[N-]c2ccc(-c3ncco3)cc2)cc1 ZINC000499290965 1048578179 /nfs/dbraw/zinc/57/81/79/1048578179.db2.gz LJHGGBQTXWWWMX-UHFFFAOYSA-N -1 1 342.420 4.095 20 0 EIADMM O=C(c1c([O-])cccc1Cl)N1CCC(Cc2cccc(F)c2)CC1 ZINC000920453604 1048676973 /nfs/dbraw/zinc/67/69/73/1048676973.db2.gz LNBDWTMFQAQWBM-UHFFFAOYSA-N -1 1 347.817 4.280 20 0 EIADMM [O-]c1cc(F)c(CN2CCn3cccc3[C@@H]2c2ccccc2)c(F)c1 ZINC001144541121 1048720042 /nfs/dbraw/zinc/72/00/42/1048720042.db2.gz BFDNRSTYPCBSPR-FQEVSTJZSA-N -1 1 340.373 4.077 20 0 EIADMM [O-]c1cc(F)c(CN2CCc3c(cccc3C(F)(F)F)C2)c(F)c1 ZINC001144558702 1048728526 /nfs/dbraw/zinc/72/85/26/1048728526.db2.gz AOWJZCRUJVLZOL-UHFFFAOYSA-N -1 1 343.295 4.248 20 0 EIADMM COc1cccc([C@@H]2CCCCN2Cc2cc(F)c([O-])cc2F)c1 ZINC001144667608 1048786825 /nfs/dbraw/zinc/78/68/25/1048786825.db2.gz WRVVESPPOWQDJN-SFHVURJKSA-N -1 1 333.378 4.406 20 0 EIADMM CC[C@H](C)N(Cc1ccccc1)C(=O)c1ncc2ccccc2c1[O-] ZINC001144752155 1048843880 /nfs/dbraw/zinc/84/38/80/1048843880.db2.gz GFCAJMFKKJZBFH-HNNXBMFYSA-N -1 1 334.419 4.381 20 0 EIADMM CCOc1cc(C(=O)N[C@H]2CCC[C@H](C(C)C)C2)cc(Cl)c1[O-] ZINC001144746161 1048844591 /nfs/dbraw/zinc/84/45/91/1048844591.db2.gz VCOOHACVLJZGBW-JSGCOSHPSA-N -1 1 339.863 4.389 20 0 EIADMM COCCc1cccc(OC(=O)c2cc3cc(Cl)sc3[n-]2)c1 ZINC000810755223 1048860040 /nfs/dbraw/zinc/86/00/40/1048860040.db2.gz ROPYFSOBAKWRMU-UHFFFAOYSA-N -1 1 335.812 4.291 20 0 EIADMM O=C(NCCOc1ccc(Cl)cc1)c1cc2ccccc2cc1[O-] ZINC001135772506 1048883726 /nfs/dbraw/zinc/88/37/26/1048883726.db2.gz AUZNHMGZWJDWDI-UHFFFAOYSA-N -1 1 341.794 4.008 20 0 EIADMM C[C@@H](Oc1ccccc1NC(=O)c1ccc([O-])cn1)c1ccccc1 ZINC001146852647 1049065114 /nfs/dbraw/zinc/06/51/14/1049065114.db2.gz ATOFZUMHZNZKDD-CQSZACIVSA-N -1 1 334.375 4.180 20 0 EIADMM CSc1c(F)cccc1[N-]C(=O)c1cc(-c2cccc(O)c2)on1 ZINC001147040192 1049080278 /nfs/dbraw/zinc/08/02/78/1049080278.db2.gz UIMWLDNLVHCYHF-UHFFFAOYSA-N -1 1 344.367 4.161 20 0 EIADMM O=S(=O)([N-]c1ccccc1C(F)F)c1cccc2c1CCCC2 ZINC000818054306 1049093304 /nfs/dbraw/zinc/09/33/04/1049093304.db2.gz OFXBGHQJGLKODA-UHFFFAOYSA-N -1 1 337.391 4.304 20 0 EIADMM CC(C)c1ccc(CN(C)C(=O)c2ncc3ccccc3c2[O-])cc1 ZINC001136152030 1049186330 /nfs/dbraw/zinc/18/63/30/1049186330.db2.gz BHMWRBOTIJRCRW-UHFFFAOYSA-N -1 1 334.419 4.336 20 0 EIADMM Cc1ccc([C@@H]2[C@H](C)CCCN2C(=O)c2ccc(F)c([O-])c2)cc1 ZINC001147795742 1049218774 /nfs/dbraw/zinc/21/87/74/1049218774.db2.gz IAOFYKYZBQNIHZ-KUHUBIRLSA-N -1 1 327.399 4.453 20 0 EIADMM COc1c(C)cc(Cl)cc1NC(=O)c1cc(SC)ccc1[O-] ZINC001147937264 1049236650 /nfs/dbraw/zinc/23/66/50/1049236650.db2.gz PAZGZONPHHEBJO-UHFFFAOYSA-N -1 1 337.828 4.337 20 0 EIADMM O=C(Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)c1sccc1C(F)F ZINC001136190505 1049267264 /nfs/dbraw/zinc/26/72/64/1049267264.db2.gz HGSLLIUTBPUASF-UHFFFAOYSA-N -1 1 335.335 4.034 20 0 EIADMM O=C(Nc1cc(Cl)c([O-])c2ccccc12)c1c[nH]c2ncccc12 ZINC001148252553 1049288286 /nfs/dbraw/zinc/28/82/86/1049288286.db2.gz LMYXIAGDPQKPBI-UHFFFAOYSA-N -1 1 337.766 4.327 20 0 EIADMM O=C(c1c([O-])cnc2c(F)cccc21)N1CCCC[C@@H]1CC1CCC1 ZINC001148513466 1049324345 /nfs/dbraw/zinc/32/43/45/1049324345.db2.gz VVCFGXIWXYBSFZ-CQSZACIVSA-N -1 1 342.414 4.264 20 0 EIADMM O=C(c1cc(Cl)ccc1[O-])N1CCCCC[C@H]1c1ccncc1 ZINC001136232780 1049341497 /nfs/dbraw/zinc/34/14/97/1049341497.db2.gz VIBDQAVILIKHOI-INIZCTEOSA-N -1 1 330.815 4.198 20 0 EIADMM Cc1c(F)c(F)cc(C(=O)Nc2cccc(C(F)(F)F)c2[O-])c1F ZINC001148729596 1049363516 /nfs/dbraw/zinc/36/35/16/1049363516.db2.gz ADVCXDKTFWWXSF-UHFFFAOYSA-N -1 1 349.230 4.389 20 0 EIADMM O=C(Nc1cccc(C(F)(F)F)c1[O-])c1ccccc1OC(F)F ZINC001148707453 1049366674 /nfs/dbraw/zinc/36/66/74/1049366674.db2.gz WAVDPEQWVBGQJC-UHFFFAOYSA-N -1 1 347.239 4.265 20 0 EIADMM CC1(C)CN(C(=O)c2cccc(-c3ccccc3)c2[O-])CC(C)(C)O1 ZINC001148866929 1049391537 /nfs/dbraw/zinc/39/15/37/1049391537.db2.gz SGFTUQLWCGUXAF-UHFFFAOYSA-N -1 1 339.435 4.089 20 0 EIADMM O=C(NC1CC2(C1)CC(F)(F)C2)c1cccc(-c2ccccc2)c1[O-] ZINC001148873028 1049394121 /nfs/dbraw/zinc/39/41/21/1049394121.db2.gz QSVYOXQYKLMMOI-UHFFFAOYSA-N -1 1 343.373 4.367 20 0 EIADMM Cc1ccccc1-c1cc(NC(=O)c2ccc(C(C)C)cc2[O-])n(C)n1 ZINC001148997866 1049406200 /nfs/dbraw/zinc/40/62/00/1049406200.db2.gz SROCWEFOVFSOPZ-UHFFFAOYSA-N -1 1 349.434 4.477 20 0 EIADMM CC(C)CN(Cc1ccccc1)C(=O)Cc1ccc([O-])c(Cl)c1 ZINC001136449349 1049635886 /nfs/dbraw/zinc/63/58/86/1049635886.db2.gz FFZYNRNEGXKRKK-UHFFFAOYSA-N -1 1 331.843 4.273 20 0 EIADMM COC(=O)Cc1ccc(Nc2cc(Cl)c([O-])cc2Cl)cc1 ZINC001212620140 1049664796 /nfs/dbraw/zinc/66/47/96/1049664796.db2.gz HQNNIFMFHGRUFJ-UHFFFAOYSA-N -1 1 326.179 4.158 20 0 EIADMM CCSc1cccc(F)c1[N-]C(=O)c1cnc(Cl)c(F)c1 ZINC000813306150 1049748127 /nfs/dbraw/zinc/74/81/27/1049748127.db2.gz VOZLTPYGQZOSSR-UHFFFAOYSA-N -1 1 328.771 4.378 20 0 EIADMM CCSc1cccc(F)c1[N-]C(=O)c1ccc(OC)c(Cl)n1 ZINC000813305932 1049748576 /nfs/dbraw/zinc/74/85/76/1049748576.db2.gz PSUUFNQVJSEYBI-UHFFFAOYSA-N -1 1 340.807 4.247 20 0 EIADMM [O-]c1c(Cl)c(Cl)ccc1Nc1cnn(CC(F)(F)F)c1 ZINC001248669280 1049751078 /nfs/dbraw/zinc/75/10/78/1049751078.db2.gz NOLUBHCLLQHGKN-UHFFFAOYSA-N -1 1 326.105 4.201 20 0 EIADMM C[C@H](C1CC1)N(C(=O)Cc1ccc([O-])c(Cl)c1)c1ccccc1 ZINC001171588871 1049751796 /nfs/dbraw/zinc/75/17/96/1049751796.db2.gz IEPIMEDSNROMQN-CYBMUJFWSA-N -1 1 329.827 4.420 20 0 EIADMM C[C@H](Oc1cccc(C(C)(C)C)c1)C(=O)Nc1cccc(F)c1[O-] ZINC001171632732 1049763993 /nfs/dbraw/zinc/76/39/93/1049763993.db2.gz MPBQAGQSPYTSBG-LBPRGKRZSA-N -1 1 331.387 4.235 20 0 EIADMM Cc1cc(Oc2ccccc2)ccc1NC(=O)C(=O)c1ccc([O-])cc1 ZINC001136633027 1049801447 /nfs/dbraw/zinc/80/14/47/1049801447.db2.gz XMJYNCXGCXDBDI-UHFFFAOYSA-N -1 1 347.370 4.314 20 0 EIADMM O=C(Nc1ccc(Oc2ccc(F)cc2)cn1)c1ccc(F)c([O-])c1 ZINC001136678736 1049823915 /nfs/dbraw/zinc/82/39/15/1049823915.db2.gz IJXLDHDNCWEHMG-UHFFFAOYSA-N -1 1 342.301 4.110 20 0 EIADMM O=C(Cc1ccc([O-])c(Cl)c1)N[C@H](c1ccc(F)cc1)C1CCC1 ZINC001136690689 1049831417 /nfs/dbraw/zinc/83/14/17/1049831417.db2.gz RJXUUKSDGJXCNR-IBGZPJMESA-N -1 1 347.817 4.385 20 0 EIADMM CC(C)n1c(=S)[n-]nc1C1CCN(C(=O)C=C2CCCCC2)CC1 ZINC000068435806 1049846388 /nfs/dbraw/zinc/84/63/88/1049846388.db2.gz JNWIBLUZTHLQOB-UHFFFAOYSA-N -1 1 348.516 4.118 20 0 EIADMM CCCCC[C@H](CC)C(=O)N[N-]C(=O)c1c(Cl)cccc1Cl ZINC000180309973 1049876702 /nfs/dbraw/zinc/87/67/02/1049876702.db2.gz AKDSQAJXDYROCC-NSHDSACASA-N -1 1 345.270 4.361 20 0 EIADMM C[C@H](NC(=O)Cc1ccc([O-])c(Cl)c1)c1nc2ccccc2s1 ZINC001136817889 1049898196 /nfs/dbraw/zinc/89/81/96/1049898196.db2.gz DVRKOXZQEUOZBR-JTQLQIEISA-N -1 1 346.839 4.075 20 0 EIADMM COc1cc(C(=O)Nc2nc(C(C)C)c(C)s2)cc(Cl)c1[O-] ZINC000617245065 1049968521 /nfs/dbraw/zinc/96/85/21/1049968521.db2.gz WSVPLXJLQUSAKY-UHFFFAOYSA-N -1 1 340.832 4.195 20 0 EIADMM Cc1c([N-]S(=O)(=O)c2ccc3ccccc3c2)cccc1N(C)C ZINC000181158556 1050022956 /nfs/dbraw/zinc/02/29/56/1050022956.db2.gz SMFROAHDNUXSJV-UHFFFAOYSA-N -1 1 340.448 4.015 20 0 EIADMM CCOc1cc(C(=O)Nc2cc(C)c(C)cc2OC)cc(Cl)c1[O-] ZINC000617549664 1050049461 /nfs/dbraw/zinc/04/94/61/1050049461.db2.gz RTRIPMADPXQWKA-UHFFFAOYSA-N -1 1 349.814 4.322 20 0 EIADMM CCOc1cc(C(=O)N2C[C@H](C)[C@H]3CCCC[C@H]32)cc(Cl)c1[O-] ZINC000248390807 1050053178 /nfs/dbraw/zinc/05/31/78/1050053178.db2.gz CJHFJYMHGNULKA-NJZAAPMLSA-N -1 1 337.847 4.095 20 0 EIADMM Cc1ccc2ccccc2c1[N-]S(=O)(=O)c1cccc(F)c1C ZINC001185790758 1050155308 /nfs/dbraw/zinc/15/53/08/1050155308.db2.gz LUXULDSPFWJWFM-UHFFFAOYSA-N -1 1 329.396 4.397 20 0 EIADMM Cc1cc([N-]S(=O)(=O)c2cccc(F)c2C)c(C)cc1Cl ZINC001185824897 1050173106 /nfs/dbraw/zinc/17/31/06/1050173106.db2.gz XXHXLHHLXUUQEH-UHFFFAOYSA-N -1 1 327.808 4.205 20 0 EIADMM CCOc1cc(C(=O)N2CC[C@H]2c2ccc(F)cc2)cc(Cl)c1[O-] ZINC000618050850 1050202066 /nfs/dbraw/zinc/20/20/66/1050202066.db2.gz FPOWTLCWJAYUAP-HNNXBMFYSA-N -1 1 349.789 4.171 20 0 EIADMM COc1ncc(Br)cc1Nc1c(F)ccc([O-])c1Cl ZINC001250228635 1050234059 /nfs/dbraw/zinc/23/40/59/1050234059.db2.gz HXXHBPQGAGFPNJ-UHFFFAOYSA-N -1 1 347.571 4.094 20 0 EIADMM Cc1cc(Br)nc(Nc2c(F)ccc([O-])c2Cl)c1 ZINC001250228633 1050241221 /nfs/dbraw/zinc/24/12/21/1050241221.db2.gz HUFYTEWEVXZQAI-UHFFFAOYSA-N -1 1 331.572 4.394 20 0 EIADMM O=C(Nc1cccc2c(Br)c[nH]c21)c1ccc([O-])cc1F ZINC001186337603 1050302308 /nfs/dbraw/zinc/30/23/08/1050302308.db2.gz NIGTVMRJYNEQEC-UHFFFAOYSA-N -1 1 349.159 4.027 20 0 EIADMM CSc1ccc(/C=C\C(=O)Nc2ccc([O-])c(Cl)c2)s1 ZINC001151582299 1050412486 /nfs/dbraw/zinc/41/24/86/1050412486.db2.gz FIOYXOUFYBVEPN-UTCJRWHESA-N -1 1 325.842 4.481 20 0 EIADMM [O-]c1cnccc1-c1nc(-c2ccc(-c3ccc(F)cc3)cc2)no1 ZINC001212722619 1050416130 /nfs/dbraw/zinc/41/61/30/1050416130.db2.gz QVWHSTGDXLZEKT-UHFFFAOYSA-N -1 1 333.322 4.310 20 0 EIADMM [O-]c1cnccc1-c1nc(-c2cccc(Oc3ccccc3)c2)no1 ZINC001212721305 1050430235 /nfs/dbraw/zinc/43/02/35/1050430235.db2.gz JNSFNUNCOLUSQZ-UHFFFAOYSA-N -1 1 331.331 4.297 20 0 EIADMM Cc1cc(C(=O)N(C)C)ccc1Nc1cc(Cl)c([O-])cc1Cl ZINC001212731716 1050469147 /nfs/dbraw/zinc/46/91/47/1050469147.db2.gz YYUKFQMAGJJISZ-UHFFFAOYSA-N -1 1 339.222 4.453 20 0 EIADMM O=C(Nc1cccc(C(F)(F)F)c1[O-])[C@@H]1CCC(=O)c2ccccc21 ZINC001178928332 1050581787 /nfs/dbraw/zinc/58/17/87/1050581787.db2.gz CQBUEYPUYNTIMT-GFCCVEGCSA-N -1 1 349.308 4.110 20 0 EIADMM Cc1ccc(Br)c(CNCc2cccc([O-])c2Cl)c1 ZINC001178966838 1050598612 /nfs/dbraw/zinc/59/86/12/1050598612.db2.gz QDONYGJGLFBOHK-UHFFFAOYSA-N -1 1 340.648 4.406 20 0 EIADMM COc1cc(OC)c(Nc2cc(Cl)cc(Cl)c2[O-])c(OC)c1 ZINC001173910350 1050622762 /nfs/dbraw/zinc/62/27/62/1050622762.db2.gz QNYYWKJLMWNKLU-UHFFFAOYSA-N -1 1 344.194 4.468 20 0 EIADMM COc1ccc(Cl)cc1NC(=O)Nc1cccc([O-])c1Cl ZINC001187928332 1050652110 /nfs/dbraw/zinc/65/21/10/1050652110.db2.gz IOJLXTXUXDIXAW-UHFFFAOYSA-N -1 1 327.167 4.352 20 0 EIADMM CCCc1cc(=O)[n-]c(SCC(=O)c2cc3cc(C)ccc3o2)n1 ZINC001188163196 1050712274 /nfs/dbraw/zinc/71/22/74/1050712274.db2.gz PKQALFATXYRESO-UHFFFAOYSA-N -1 1 342.420 4.164 20 0 EIADMM O=C(Nc1cc(F)c([O-])cc1Cl)c1ccccc1OC(F)(F)F ZINC001179660038 1050740703 /nfs/dbraw/zinc/74/07/03/1050740703.db2.gz KJMJLSGGZMBEOP-UHFFFAOYSA-N -1 1 349.667 4.336 20 0 EIADMM CN(C)C(=O)c1cccc(Nc2ccc(Cl)c(Cl)c2[O-])c1 ZINC001174088052 1050763375 /nfs/dbraw/zinc/76/33/75/1050763375.db2.gz MOKDJMNLEAAOEN-UHFFFAOYSA-N -1 1 325.195 4.144 20 0 EIADMM CC(C)(C)NC(=O)c1ccc(Nc2cc([O-])c(Cl)cc2F)cc1 ZINC001174127220 1050769962 /nfs/dbraw/zinc/76/99/62/1050769962.db2.gz ZNYOOEODNVVIET-UHFFFAOYSA-N -1 1 336.794 4.457 20 0 EIADMM O=C(Nc1ccccc1-c1cnco1)c1ccc([O-])c(C(F)(F)F)c1 ZINC001188587959 1050811131 /nfs/dbraw/zinc/81/11/31/1050811131.db2.gz YVMKXWVQTBKLQS-UHFFFAOYSA-N -1 1 348.280 4.318 20 0 EIADMM O=C(NC1CCCC1)c1cccc(Nc2cc([O-])c(F)c(F)c2)c1 ZINC001174198341 1050834975 /nfs/dbraw/zinc/83/49/75/1050834975.db2.gz FLXKBCGSACDBBE-UHFFFAOYSA-N -1 1 332.350 4.086 20 0 EIADMM Cn1nc(C(F)(F)F)cc1Nc1cc(Cl)cc(Cl)c1[O-] ZINC001174325191 1050890614 /nfs/dbraw/zinc/89/06/14/1050890614.db2.gz CWXZMOWOULPPGF-UHFFFAOYSA-N -1 1 326.105 4.195 20 0 EIADMM CC(C)(C)[C@@H]1CCC[C@@H]([N-]S(=O)(=O)c2ccc(C(F)F)o2)CC1 ZINC001189288992 1050947436 /nfs/dbraw/zinc/94/74/36/1050947436.db2.gz LETGUWCEEJPVRO-VXGBXAGGSA-N -1 1 349.443 4.491 20 0 EIADMM CC(C)CCn1cc(Nc2ccc(F)c(Br)c2[O-])cn1 ZINC001174418105 1050952519 /nfs/dbraw/zinc/95/25/19/1050952519.db2.gz LXNFWFBWJDPAGJ-UHFFFAOYSA-N -1 1 342.212 4.280 20 0 EIADMM C=Cc1ccccc1[N-]S(=O)(=O)c1ccc(F)c2ccccc21 ZINC001189389891 1050977592 /nfs/dbraw/zinc/97/75/92/1050977592.db2.gz ZFWXKYDVXOYSOO-UHFFFAOYSA-N -1 1 327.380 4.423 20 0 EIADMM CCC1(CC)CCC([N-]S(=O)(=O)c2ccc(F)c(F)c2F)CC1 ZINC001189864218 1051072238 /nfs/dbraw/zinc/07/22/38/1051072238.db2.gz WXGHIGKTQATHCV-UHFFFAOYSA-N -1 1 349.418 4.131 20 0 EIADMM O=C(Nc1ccc(F)cc1[O-])NC1c2ccccc2-c2ccccc21 ZINC001190038787 1051105313 /nfs/dbraw/zinc/10/53/13/1051105313.db2.gz SIJNTDRGPGRCRG-UHFFFAOYSA-N -1 1 334.350 4.423 20 0 EIADMM CCC(C)(C)c1ccc(S(=O)(=O)[N-]c2ccccc2[C@H](C)O)cc1 ZINC001190448554 1051190032 /nfs/dbraw/zinc/19/00/32/1051190032.db2.gz VHKXMFFVVWDWIE-AWEZNQCLSA-N -1 1 347.480 4.228 20 0 EIADMM Cc1nc2ccc([N-]S(=O)(=O)c3ccc(C4CC4)cc3)cc2s1 ZINC001190497213 1051209646 /nfs/dbraw/zinc/20/96/46/1051209646.db2.gz GLIPXAZRNFGLRZ-UHFFFAOYSA-N -1 1 344.461 4.283 20 0 EIADMM Cc1ccc([C@H](NCc2ccc([O-])c(F)c2F)c2ccccn2)cc1 ZINC001181410650 1051215476 /nfs/dbraw/zinc/21/54/76/1051215476.db2.gz OALCSUVOYUFADF-FQEVSTJZSA-N -1 1 340.373 4.253 20 0 EIADMM COc1cc(C(=O)N(CC2CC2)C2CCCCC2)cc(Cl)c1[O-] ZINC000153745937 1051222397 /nfs/dbraw/zinc/22/23/97/1051222397.db2.gz VMQJERWFRUZHKL-UHFFFAOYSA-N -1 1 337.847 4.239 20 0 EIADMM [O-]c1c(Br)c(F)ccc1Nc1cc(F)c(F)c(F)c1 ZINC001174961327 1051276261 /nfs/dbraw/zinc/27/62/61/1051276261.db2.gz STFXQVLSRHZMJV-UHFFFAOYSA-N -1 1 336.082 4.455 20 0 EIADMM [O-]c1cc(F)c(Nc2cc(Br)cnc2F)cc1Cl ZINC001250020459 1051296111 /nfs/dbraw/zinc/29/61/11/1051296111.db2.gz LIDKFSSHPXLTLE-UHFFFAOYSA-N -1 1 335.535 4.225 20 0 EIADMM CCOC(=O)c1sc([N-]c2c(F)ccc(F)c2F)nc1C1CC1 ZINC001175029154 1051322898 /nfs/dbraw/zinc/32/28/98/1051322898.db2.gz UBBIUWFLJIWBIK-UHFFFAOYSA-N -1 1 342.342 4.358 20 0 EIADMM [O-]c1c(Br)ccc(Cl)c1Nc1cc(CO)ccc1F ZINC001175132328 1051398853 /nfs/dbraw/zinc/39/88/53/1051398853.db2.gz NMMFBEVENGZTIU-UHFFFAOYSA-N -1 1 346.583 4.183 20 0 EIADMM CCCCc1ccc(S(=O)(=O)[N-]c2ccnc(Cl)c2C)cc1 ZINC001191233477 1051407623 /nfs/dbraw/zinc/40/76/23/1051407623.db2.gz NCIQUUWEKNKFQZ-UHFFFAOYSA-N -1 1 338.860 4.187 20 0 EIADMM O=S(=O)([N-][C@@H]1CCC[C@H](F)C1)c1sc2ccccc2c1Cl ZINC001191755003 1051538581 /nfs/dbraw/zinc/53/85/81/1051538581.db2.gz CIISKPJAUGGMMD-VHSXEESVSA-N -1 1 347.864 4.114 20 0 EIADMM O=C(Cc1c[nH]c2ccc(Cl)cc12)Nc1ccc([O-])c(Cl)c1 ZINC000156759504 1051561316 /nfs/dbraw/zinc/56/13/16/1051561316.db2.gz TWNDZQROKNEUCD-UHFFFAOYSA-N -1 1 335.190 4.362 20 0 EIADMM Cc1cccc(S(=O)(=O)[N-]c2cccc(Cl)c2Cl)c1F ZINC000313223352 1051610559 /nfs/dbraw/zinc/61/05/59/1051610559.db2.gz SIHLDGGSZAGHSV-UHFFFAOYSA-N -1 1 334.199 4.242 20 0 EIADMM [O-]c1c(Cl)cc(Br)cc1Nc1cccc(CO)c1 ZINC001175516662 1051643813 /nfs/dbraw/zinc/64/38/13/1051643813.db2.gz VMSCAPAJAYGUQM-UHFFFAOYSA-N -1 1 328.593 4.044 20 0 EIADMM Cc1ccc2n[nH]cc2c1Nc1ccc(F)c(Br)c1[O-] ZINC001175527468 1051652404 /nfs/dbraw/zinc/65/24/04/1051652404.db2.gz OZGIXZZIGJOGSS-UHFFFAOYSA-N -1 1 336.164 4.222 20 0 EIADMM CCCCOc1ccc(C(=O)Nc2nc(C(C)C)cs2)c([O-])c1 ZINC001182688675 1051674144 /nfs/dbraw/zinc/67/41/44/1051674144.db2.gz NRSLQNYZASWDRV-UHFFFAOYSA-N -1 1 334.441 4.403 20 0 EIADMM O=C(Nc1ccc(OC(F)F)c(Cl)c1)Nc1ccc(F)cc1[O-] ZINC001192314759 1051688700 /nfs/dbraw/zinc/68/87/00/1051688700.db2.gz MYHWCMJEFHRAIH-UHFFFAOYSA-N -1 1 346.692 4.430 20 0 EIADMM CSc1ncc(Nc2cc(Br)cc(Cl)c2[O-])cn1 ZINC001175651247 1051693639 /nfs/dbraw/zinc/69/36/39/1051693639.db2.gz MERFQDREAVBNFV-UHFFFAOYSA-N -1 1 346.637 4.064 20 0 EIADMM CCc1cc([N-]S(=O)(=O)c2cnc(Cl)cc2C)c(C)cc1C ZINC001192368159 1051707037 /nfs/dbraw/zinc/70/70/37/1051707037.db2.gz LMRDPDMJOAOYAY-UHFFFAOYSA-N -1 1 338.860 4.023 20 0 EIADMM Cc1cc(Cl)cc(Cl)c1CNC(=O)c1c(F)ccc([O-])c1F ZINC001192553174 1051755701 /nfs/dbraw/zinc/75/57/01/1051755701.db2.gz WSRLBHXPEHDKAS-UHFFFAOYSA-N -1 1 346.160 4.216 20 0 EIADMM COc1cc2ccc(NCc3ccc([O-])c(F)c3F)cc2cc1OC ZINC001182979186 1051763567 /nfs/dbraw/zinc/76/35/67/1051763567.db2.gz SXOOATDOPMEWLY-UHFFFAOYSA-N -1 1 345.345 4.453 20 0 EIADMM COCCOc1ccc(Nc2cc(Cl)c([O-])cc2Cl)cc1 ZINC001175788363 1051786559 /nfs/dbraw/zinc/78/65/59/1051786559.db2.gz VFVQCLNFQJZCPE-UHFFFAOYSA-N -1 1 328.195 4.468 20 0 EIADMM O=C(Nc1cccc2c(Cl)ccnc12)c1cc([O-])cc(F)c1F ZINC001192671142 1051788344 /nfs/dbraw/zinc/78/83/44/1051788344.db2.gz UGLKUQZWNAWIGK-UHFFFAOYSA-N -1 1 334.709 4.124 20 0 EIADMM CC(C)Cc1ccc([C@@H](C)NC(=O)c2cc([O-])cc(F)c2F)cc1 ZINC001192684632 1051793258 /nfs/dbraw/zinc/79/32/58/1051793258.db2.gz RPBPKPAFFMVZRB-GFCCVEGCSA-N -1 1 333.378 4.360 20 0 EIADMM C[C@H](Cc1ccccc1)n1cccc1C(=O)Nc1c([O-])cccc1F ZINC000773524951 1051796797 /nfs/dbraw/zinc/79/67/97/1051796797.db2.gz WZXOYYGKIYBMMG-CQSZACIVSA-N -1 1 338.382 4.389 20 0 EIADMM Nc1ccc(-c2ccc(NC(=O)c3cc([O-])cc(F)c3F)cc2)cc1 ZINC001192665780 1051797866 /nfs/dbraw/zinc/79/78/66/1051797866.db2.gz WCUYVAIZFRJJHL-UHFFFAOYSA-N -1 1 340.329 4.172 20 0 EIADMM O=c1[nH]c2ccc(NCc3cccc([O-])c3Cl)cc2n1C1CC1 ZINC001183483207 1051849819 /nfs/dbraw/zinc/84/98/19/1051849819.db2.gz RQVPWIBHLZXXDW-UHFFFAOYSA-N -1 1 329.787 4.048 20 0 EIADMM [O-]c1cc(F)c(Nc2cccc3c2cnn3[C@@H]2CCCCO2)cc1F ZINC001176324902 1051991506 /nfs/dbraw/zinc/99/15/06/1051991506.db2.gz YEHBJNMALLLDQL-SFHVURJKSA-N -1 1 345.349 4.463 20 0 EIADMM CC(=O)c1ccc(NC(=O)c2ccc([O-])cc2C(F)(F)F)c(F)c1 ZINC001193748120 1051992229 /nfs/dbraw/zinc/99/22/29/1051992229.db2.gz PUZZLDSYFAXGMG-UHFFFAOYSA-N -1 1 341.260 4.005 20 0 EIADMM CC(=O)c1ccc([N-]S(=O)(=O)c2ccc(C)c3ccccc32)cc1 ZINC001193824163 1052004152 /nfs/dbraw/zinc/00/41/52/1052004152.db2.gz CSZFMJQDHFPVDY-UHFFFAOYSA-N -1 1 339.416 4.152 20 0 EIADMM Cc1ccc(-c2ccc([N-]S(=O)(=O)c3ccccc3N)cc2)cc1 ZINC001193928592 1052021999 /nfs/dbraw/zinc/02/19/99/1052021999.db2.gz GZNSYOBJLIDABM-UHFFFAOYSA-N -1 1 338.432 4.045 20 0 EIADMM [O-]c1ccc(-c2nc(-c3ccc(Cl)cc3C(F)(F)F)no2)nn1 ZINC001205299178 1052028911 /nfs/dbraw/zinc/02/89/11/1052028911.db2.gz NGASDHLJIACGIZ-UHFFFAOYSA-N -1 1 342.664 4.132 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2cccc(Cl)c2)cc1-c1ncco1 ZINC000164713109 1052037275 /nfs/dbraw/zinc/03/72/75/1052037275.db2.gz ZZLQBLJMWSBLCC-UHFFFAOYSA-N -1 1 348.811 4.104 20 0 EIADMM O=c1nc(Cl)cc(Oc2ccc(Cl)cc2Br)[n-]1 ZINC001184515943 1052037430 /nfs/dbraw/zinc/03/74/30/1052037430.db2.gz HUXBXYSMRQLZNH-UHFFFAOYSA-N -1 1 335.972 4.044 20 0 EIADMM COc1cccc([N-]S(=O)(=O)c2ccc(-c3cccs3)cc2)c1 ZINC001194131246 1052078255 /nfs/dbraw/zinc/07/82/55/1052078255.db2.gz QBXGZEWIQPBXSQ-UHFFFAOYSA-N -1 1 345.445 4.225 20 0 EIADMM O=S(=O)([N-]c1ccc(F)cc1)c1ccc2c(Cl)cccc2c1 ZINC001194215985 1052108459 /nfs/dbraw/zinc/10/84/59/1052108459.db2.gz PKRVPVYUNQOXEU-UHFFFAOYSA-N -1 1 335.787 4.433 20 0 EIADMM CCCCCCc1ccc([N-]S(=O)(=O)c2cccc(N)c2)cc1 ZINC001176525255 1052109937 /nfs/dbraw/zinc/10/99/37/1052109937.db2.gz FZRCSDDYKMDVMY-UHFFFAOYSA-N -1 1 332.469 4.192 20 0 EIADMM [O-]c1c(Br)c(F)ccc1Nc1cc(O)cc(Cl)c1 ZINC001176625702 1052144818 /nfs/dbraw/zinc/14/48/18/1052144818.db2.gz HLLWTDZXXIFMDW-UHFFFAOYSA-N -1 1 332.556 4.396 20 0 EIADMM COc1ccc(Br)c(Nc2c(F)cc(F)c([O-])c2F)c1 ZINC001176669004 1052156989 /nfs/dbraw/zinc/15/69/89/1052156989.db2.gz BKDAHVDWMZZDER-UHFFFAOYSA-N -1 1 348.118 4.324 20 0 EIADMM Cc1ccc(Br)c(Nc2c(F)cc(F)c([O-])c2F)n1 ZINC001176663855 1052157789 /nfs/dbraw/zinc/15/77/89/1052157789.db2.gz MMVOSHIAUOWIER-UHFFFAOYSA-N -1 1 333.107 4.019 20 0 EIADMM Cc1cc(N)c(Nc2c(F)cc(F)c([O-])c2F)cc1Br ZINC001176671796 1052159299 /nfs/dbraw/zinc/15/92/99/1052159299.db2.gz PJJSYOCLAZCBTH-UHFFFAOYSA-N -1 1 347.134 4.206 20 0 EIADMM COc1ccc(OC(=O)Nc2cc(Cl)c(Cl)cc2[O-])cc1 ZINC001194534730 1052165467 /nfs/dbraw/zinc/16/54/67/1052165467.db2.gz IACHEGWBBZLJQA-UHFFFAOYSA-N -1 1 328.151 4.319 20 0 EIADMM Cc1cnc(Br)c(Nc2c(F)cc(F)c([O-])c2F)c1 ZINC001176663043 1052172966 /nfs/dbraw/zinc/17/29/66/1052172966.db2.gz AKAWDVHIRXRGFX-UHFFFAOYSA-N -1 1 333.107 4.019 20 0 EIADMM O=C(Nc1c(F)cc([O-])cc1F)Oc1ccc(Br)cc1 ZINC001194599282 1052174939 /nfs/dbraw/zinc/17/49/39/1052174939.db2.gz BNZHFGOLJMHACS-UHFFFAOYSA-N -1 1 344.111 4.044 20 0 EIADMM Nc1cccc(S(=O)(=O)[N-]c2ccc(C3CCCCC3)cc2)c1 ZINC001176730416 1052175448 /nfs/dbraw/zinc/17/54/48/1052175448.db2.gz GXSXXVVUDJCHMP-UHFFFAOYSA-N -1 1 330.453 4.117 20 0 EIADMM COc1cccc2c([N-]S(=O)(=O)c3c(C)cccc3C)cccc12 ZINC001194641898 1052183541 /nfs/dbraw/zinc/18/35/41/1052183541.db2.gz BVTYVNVNFRXYRM-UHFFFAOYSA-N -1 1 341.432 4.266 20 0 EIADMM O=C(Nc1ccccc1N1CCCCCC1)c1cc(F)ccc1[O-] ZINC000622292700 1052186870 /nfs/dbraw/zinc/18/68/70/1052186870.db2.gz HFRLJZBNMNSYGG-UHFFFAOYSA-N -1 1 328.387 4.164 20 0 EIADMM CC(C)c1ccc(C(=O)[C@@H](C)OC(=O)c2ccc([O-])cc2F)cc1 ZINC000773586729 1052192368 /nfs/dbraw/zinc/19/23/68/1052192368.db2.gz WMZYNNNXIIXJFE-GFCCVEGCSA-N -1 1 330.355 4.083 20 0 EIADMM O=C(NCc1ccc([O-])c(Cl)c1)c1occc1-c1ccccc1 ZINC001176988274 1052213372 /nfs/dbraw/zinc/21/33/72/1052213372.db2.gz JREQFBOWWAIFLI-UHFFFAOYSA-N -1 1 327.767 4.236 20 0 EIADMM C[C@@H](CCc1ccc(F)cc1)C(=O)NCc1ccc([O-])c(Cl)c1 ZINC001176993625 1052213706 /nfs/dbraw/zinc/21/37/06/1052213706.db2.gz HASPQWQSKJEGLS-LBPRGKRZSA-N -1 1 335.806 4.070 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2cccc(-c3cnco3)c2)ccc1Cl ZINC001185524139 1052256436 /nfs/dbraw/zinc/25/64/36/1052256436.db2.gz BMOHGWMTBLJGJR-UHFFFAOYSA-N -1 1 348.811 4.104 20 0 EIADMM Cn1nc(C2CCCC2)cc1NC(=O)c1cc2ccccc2cc1[O-] ZINC000622500286 1052295210 /nfs/dbraw/zinc/29/52/10/1052295210.db2.gz QBEBFWFLXFMOQJ-UHFFFAOYSA-N -1 1 335.407 4.189 20 0 EIADMM CC(C)C1(C)CCN(C(=O)c2ccc(C(F)(F)F)cc2[O-])CC1 ZINC000622525092 1052315852 /nfs/dbraw/zinc/31/58/52/1052315852.db2.gz RPSRADJDNNGVNC-UHFFFAOYSA-N -1 1 329.362 4.309 20 0 EIADMM Cc1c(=O)[n-]c(SCc2ccc(Cl)nc2)nc1-c1ccccc1 ZINC000185055581 1052387124 /nfs/dbraw/zinc/38/71/24/1052387124.db2.gz SZYZBNKYZLGIOW-UHFFFAOYSA-N -1 1 343.839 4.086 20 0 EIADMM COc1ccc2c(c1)C[C@@H](C(C)C)CN2C(=O)c1cc(F)ccc1[O-] ZINC000622728735 1052397861 /nfs/dbraw/zinc/39/78/61/1052397861.db2.gz JNJZISZGQMMFQS-CQSZACIVSA-N -1 1 343.398 4.015 20 0 EIADMM Cc1noc(-c2ccccc2)c1[N-]C(=O)c1sc(Cl)nc1C ZINC000185114376 1052441187 /nfs/dbraw/zinc/44/11/87/1052441187.db2.gz FNCMSBTYSJDUPI-UHFFFAOYSA-N -1 1 333.800 4.321 20 0 EIADMM CCOc1cc(C(=O)Nc2cnc3ccccc3c2)cc(Cl)c1[O-] ZINC000192646951 1052630738 /nfs/dbraw/zinc/63/07/38/1052630738.db2.gz AKEKNBHUWAQLKH-UHFFFAOYSA-N -1 1 342.782 4.245 20 0 EIADMM COc1cc([N-]S(=O)(=O)c2cccc(C(C)C)c2)ccc1Cl ZINC001195155937 1053305994 /nfs/dbraw/zinc/30/59/94/1053305994.db2.gz BWKFKWONWYBTKF-UHFFFAOYSA-N -1 1 339.844 4.273 20 0 EIADMM CC(C)c1cccc(S(=O)(=O)[N-]c2ccc3sncc3c2)c1 ZINC001195156451 1053310544 /nfs/dbraw/zinc/31/05/44/1053310544.db2.gz MWRQVOSFOALANC-UHFFFAOYSA-N -1 1 332.450 4.221 20 0 EIADMM CC(C)c1cccc(S(=O)(=O)[N-]c2ccc(C(=O)C3CC3)cc2)c1 ZINC001195169620 1053314073 /nfs/dbraw/zinc/31/40/73/1053314073.db2.gz RVNAZAQJVVAXII-UHFFFAOYSA-N -1 1 343.448 4.204 20 0 EIADMM O=C(Nc1ccc([O-])c(F)c1F)Oc1ccccc1C(F)(F)F ZINC001195197218 1053326956 /nfs/dbraw/zinc/32/69/56/1053326956.db2.gz SPDVYLACAWEIKJ-UHFFFAOYSA-N -1 1 333.212 4.300 20 0 EIADMM CCOC(=O)NC(=S)[N-]c1c(C)cccc1Oc1ccccc1 ZINC001195483644 1053419708 /nfs/dbraw/zinc/41/97/08/1053419708.db2.gz YITUIEBUCIYIIE-UHFFFAOYSA-N -1 1 330.409 4.230 20 0 EIADMM [O-]c1cnc(Cl)cc1NC(=S)Nc1ccc(C(F)(F)F)cc1 ZINC001196161670 1053602712 /nfs/dbraw/zinc/60/27/12/1053602712.db2.gz MFLZVFJYLPSMEK-UHFFFAOYSA-N -1 1 347.749 4.268 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2cc(C)c(Cl)cc2F)c(F)c1 ZINC001196382125 1053653020 /nfs/dbraw/zinc/65/30/20/1053653020.db2.gz BSRIZQIDEYIMBF-UHFFFAOYSA-N -1 1 331.771 4.036 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1ccn(-c2ccccc2Cl)n1 ZINC000111667631 1053719045 /nfs/dbraw/zinc/71/90/45/1053719045.db2.gz ITHRHZPHFHYOEO-UHFFFAOYSA-N -1 1 348.189 4.137 20 0 EIADMM CCOc1ccc(N(C)C(=O)c2ccc(C(F)(F)F)cc2[O-])cc1 ZINC000776707642 1053753566 /nfs/dbraw/zinc/75/35/66/1053753566.db2.gz SWTDFGPHRSXHOK-UHFFFAOYSA-N -1 1 339.313 4.086 20 0 EIADMM [O-]c1cccc(NC(=S)NCc2ccccc2Cl)c1Cl ZINC001196829438 1053773314 /nfs/dbraw/zinc/77/33/14/1053773314.db2.gz ZUICKTGPFGHHTE-UHFFFAOYSA-N -1 1 327.236 4.186 20 0 EIADMM O=C(Nc1cc(F)c([O-])cc1Cl)[C@@H]1CC[C@@H](C(F)(F)F)C1 ZINC000885678840 1053810412 /nfs/dbraw/zinc/81/04/12/1053810412.db2.gz WRMLKJWERCPTEQ-RNFRBKRXSA-N -1 1 325.689 4.102 20 0 EIADMM CCCCc1oc2ccccc2c1C=CC(=O)Nc1c(C)[n-][nH]c1=O ZINC000854634977 1053832914 /nfs/dbraw/zinc/83/29/14/1053832914.db2.gz KTTMTCBNRODVHZ-KHPPLWFESA-N -1 1 339.395 4.164 20 0 EIADMM CC(C)c1cccc(F)c1[N-]S(=O)(=O)Cc1c(F)cccc1F ZINC001197607035 1053956818 /nfs/dbraw/zinc/95/68/18/1053956818.db2.gz DZLLZUINKMTJQB-UHFFFAOYSA-N -1 1 343.370 4.169 20 0 EIADMM O=C(Nc1ccc2nc(C(F)F)[nH]c2c1)c1cccc(Cl)c1[O-] ZINC000775798610 1054029161 /nfs/dbraw/zinc/02/91/61/1054029161.db2.gz GCSOVQLSHMHMAI-UHFFFAOYSA-N -1 1 337.713 4.112 20 0 EIADMM [O-]c1cc(NC(=S)Nc2cccc(C(F)(F)F)c2)c(F)cc1F ZINC001198060011 1054054828 /nfs/dbraw/zinc/05/48/28/1054054828.db2.gz SNEXGLQRJACJII-UHFFFAOYSA-N -1 1 348.296 4.498 20 0 EIADMM CCCc1ccccc1[N-]S(=O)(=O)c1ccc(OC)c(Cl)c1 ZINC000032595498 1054108426 /nfs/dbraw/zinc/10/84/26/1054108426.db2.gz GLNYWYRKMXDPSL-UHFFFAOYSA-N -1 1 339.844 4.102 20 0 EIADMM CC(C)C(=O)c1ccc([C@@H](C)C(=O)[N-]OCCCC(F)(F)F)cc1 ZINC000871216297 1054170206 /nfs/dbraw/zinc/17/02/06/1054170206.db2.gz VMQJJDFAOLNSIY-GFCCVEGCSA-N -1 1 345.361 4.019 20 0 EIADMM CCC(F)(F)c1ccccc1NCc1nc(C(F)(F)F)cc(=O)[n-]1 ZINC000871861865 1054310642 /nfs/dbraw/zinc/31/06/42/1054310642.db2.gz PEECWCCZORPGLW-UHFFFAOYSA-N -1 1 347.287 4.315 20 0 EIADMM CCCCCC(=O)Nc1cccc([N-]S(=O)(=O)c2ccccc2)c1 ZINC000046611889 1054389377 /nfs/dbraw/zinc/38/93/77/1054389377.db2.gz LPFJMDAGVZCHCV-UHFFFAOYSA-N -1 1 346.452 4.006 20 0 EIADMM C[C@H]1CN(CCOc2ccc(C(=O)[O-])cc2Cl)Cc2ccccc21 ZINC000872166805 1054420182 /nfs/dbraw/zinc/42/01/82/1054420182.db2.gz RZWHKCLGFBKRJT-ZDUSSCGKSA-N -1 1 345.826 4.036 20 0 EIADMM O=c1nc(N2CCCC[C@@H]2CCCc2ccccc2)cc(Cl)[n-]1 ZINC000858455012 1054492501 /nfs/dbraw/zinc/49/25/01/1054492501.db2.gz IMVGQTMKFKFIPH-OAHLLOKOSA-N -1 1 331.847 4.217 20 0 EIADMM CSCCCCCCC(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC000858448175 1054493306 /nfs/dbraw/zinc/49/33/06/1054493306.db2.gz WYWIQVXZWDJNTA-UHFFFAOYSA-N -1 1 333.457 4.034 20 0 EIADMM Cc1c(Cl)cccc1S(=O)(=O)[N-]c1cccc(-c2cnco2)c1 ZINC000057119338 1054502359 /nfs/dbraw/zinc/50/23/59/1054502359.db2.gz UVQSOPGWYYTRDD-UHFFFAOYSA-N -1 1 348.811 4.104 20 0 EIADMM O=c1nc(CN(Cc2ccoc2)C2CCCCC2)[n-]c2ccsc21 ZINC000266014921 1054552373 /nfs/dbraw/zinc/55/23/73/1054552373.db2.gz UCQWQDMUSQQNIW-UHFFFAOYSA-N -1 1 343.452 4.325 20 0 EIADMM CSc1ccc(NC(=S)Nc2ccc([O-])c(F)c2F)cc1 ZINC001201183741 1054705433 /nfs/dbraw/zinc/70/54/33/1054705433.db2.gz WAERFGLPMKMZIM-UHFFFAOYSA-N -1 1 326.393 4.201 20 0 EIADMM Cc1onc(OC(F)F)c1[N-]C(=O)c1ccc(-c2ccccc2)o1 ZINC001127991599 1054825985 /nfs/dbraw/zinc/82/59/85/1054825985.db2.gz FIGSMJIQPOPDBX-UHFFFAOYSA-N -1 1 334.278 4.097 20 0 EIADMM Cc1ccc(C(C)C)c(OCC(=O)Nc2ccc([O-])c(Cl)c2)c1 ZINC000109014432 1054870687 /nfs/dbraw/zinc/87/06/87/1054870687.db2.gz UGPGKDPLUBZISX-UHFFFAOYSA-N -1 1 333.815 4.495 20 0 EIADMM Cc1c(C)c(C)c(S(=O)(=O)[N-]c2cnccc2C2CC2)c(C)c1C ZINC001201792741 1054907121 /nfs/dbraw/zinc/90/71/21/1054907121.db2.gz QFEVFJZFTCAAPL-UHFFFAOYSA-N -1 1 344.480 4.302 20 0 EIADMM COc1ccccc1NC(=O)Nc1cc(Cl)c(Cl)cc1[O-] ZINC001202127654 1055043407 /nfs/dbraw/zinc/04/34/07/1055043407.db2.gz ZDIFFJZVSGIMRD-UHFFFAOYSA-N -1 1 327.167 4.352 20 0 EIADMM O=C(Nc1cc(Cl)c([O-])c2ccccc12)C1SCCCS1 ZINC000862295735 1055048670 /nfs/dbraw/zinc/04/86/70/1055048670.db2.gz SMHABXMWJDXVII-UHFFFAOYSA-N -1 1 339.869 4.334 20 0 EIADMM O=C(Nc1cc(F)c(F)cc1[O-])Nc1ccccc1C(F)(F)F ZINC001202164043 1055063696 /nfs/dbraw/zinc/06/36/96/1055063696.db2.gz DRWMANWXVNIXED-UHFFFAOYSA-N -1 1 332.228 4.333 20 0 EIADMM O=C(Nc1cccc(C(F)(F)F)c1)Nc1cc(F)c([O-])cc1F ZINC001202297836 1055129558 /nfs/dbraw/zinc/12/95/58/1055129558.db2.gz ZJHNHGVQPKDGLL-UHFFFAOYSA-N -1 1 332.228 4.333 20 0 EIADMM C[C@H](NC(=O)Nc1cccc([O-])c1Br)c1ccccc1 ZINC001202507910 1055134055 /nfs/dbraw/zinc/13/40/55/1055134055.db2.gz ICGZOHBWMWBLQI-JTQLQIEISA-N -1 1 335.201 4.037 20 0 EIADMM Cc1cccc([C@@H]2CCCN2Cc2nnc(-c3ccccc3O)o2)c1 ZINC000877986552 1055169241 /nfs/dbraw/zinc/16/92/41/1055169241.db2.gz QCVQFNRUDPJKMY-KRWDZBQOSA-N -1 1 335.407 4.088 20 0 EIADMM O=C([N-]c1nnc(C(F)F)s1)c1sccc1SC(F)F ZINC000107130338 1055211058 /nfs/dbraw/zinc/21/10/58/1055211058.db2.gz BHQPAPSTHGIKTD-UHFFFAOYSA-N -1 1 343.352 4.104 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1cc(-c2ccccc2Cl)[nH]n1 ZINC000542816831 1056096512 /nfs/dbraw/zinc/09/65/12/1056096512.db2.gz JGPLICAETQUIDO-UHFFFAOYSA-N -1 1 348.189 4.341 20 0 EIADMM CC(C)c1ccc([C@@H](C)CC(=O)Nc2n[n-]c(C(F)(F)F)n2)cc1 ZINC000303752491 1056275139 /nfs/dbraw/zinc/27/51/39/1056275139.db2.gz MDEJSFCBXWQXLH-JTQLQIEISA-N -1 1 340.349 4.079 20 0 EIADMM Cc1ccc(-c2nc(CC(=O)Nc3ccc([O-])c(Cl)c3)cs2)o1 ZINC000111668381 1056812594 /nfs/dbraw/zinc/81/25/94/1056812594.db2.gz ZRQGUIKZWSURDH-UHFFFAOYSA-N -1 1 348.811 4.252 20 0 EIADMM Cc1cccc(NC2CCN(C(=O)c3c([O-])cccc3Cl)CC2)c1 ZINC000741298479 1058186296 /nfs/dbraw/zinc/18/62/96/1058186296.db2.gz DQILJFQCNJMRTL-UHFFFAOYSA-N -1 1 344.842 4.071 20 0 EIADMM CCC(CC)(CNc1ccc(-c2nc(C)c(C)c(=O)[n-]2)cn1)SC ZINC000742426012 1058618333 /nfs/dbraw/zinc/61/83/33/1058618333.db2.gz UJIKOCYWALHIEF-UHFFFAOYSA-N -1 1 346.500 4.195 20 0 EIADMM CCCCC[C@@H](C)CC(=O)N1CCC(C(=O)c2ccc([O-])cc2)CC1 ZINC000743295861 1058916081 /nfs/dbraw/zinc/91/60/81/1058916081.db2.gz RZTPCNGZJMNJJJ-MRXNPFEDSA-N -1 1 345.483 4.420 20 0 EIADMM O=C(NCc1ccc(-c2cccnc2)cc1)c1c([O-])cccc1Cl ZINC000743809977 1059127714 /nfs/dbraw/zinc/12/77/14/1059127714.db2.gz QZEWSSNWWRYNGN-UHFFFAOYSA-N -1 1 338.794 4.038 20 0 EIADMM CC(=O)c1ccc([O-])c(CCOC(=O)C=Cc2ccccc2Cl)c1 ZINC000744488678 1059553422 /nfs/dbraw/zinc/55/34/22/1059553422.db2.gz BSXKPOMCDTVLPH-VQHVLOKHSA-N -1 1 344.794 4.047 20 0 EIADMM CC(=O)c1ccc([O-])c(CCOC(=O)C[C@H](C)c2ccccc2F)c1 ZINC000744930360 1059667855 /nfs/dbraw/zinc/66/78/55/1059667855.db2.gz GHQFBQXMRRPZPD-ZDUSSCGKSA-N -1 1 344.382 4.013 20 0 EIADMM CC(=O)c1ccc([O-])c(CCOC(=O)[C@H](C)c2cccc(Cl)c2)c1 ZINC000745301582 1059807219 /nfs/dbraw/zinc/80/72/19/1059807219.db2.gz FVXSUPNVSQKDBS-GFCCVEGCSA-N -1 1 346.810 4.138 20 0 EIADMM O=C(OCc1csc(C2CCCC2)n1)c1c([O-])cc(F)cc1F ZINC000749278399 1060163898 /nfs/dbraw/zinc/16/38/98/1060163898.db2.gz KAOZHDOELOWNAD-UHFFFAOYSA-N -1 1 339.363 4.142 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)Nc1cc(C(F)(F)F)ccn1 ZINC000192426961 1060209121 /nfs/dbraw/zinc/20/91/21/1060209121.db2.gz CBJRYOKGAHZESD-UHFFFAOYSA-N -1 1 331.681 4.103 20 0 EIADMM COc1ccc2cc(NC(=O)c3c(F)ccc([O-])c3F)ccc2c1 ZINC000804307747 1060644457 /nfs/dbraw/zinc/64/44/57/1060644457.db2.gz JDVFFAVGYQZBFA-UHFFFAOYSA-N -1 1 329.302 4.085 20 0 EIADMM O=S(=O)([N-]c1cc(F)ccc1F)c1cc(Cl)sc1Cl ZINC000020627219 212157371 /nfs/dbraw/zinc/15/73/71/212157371.db2.gz DGELSTQKUSFFGN-UHFFFAOYSA-N -1 1 344.191 4.134 20 0 EIADMM CCOc1cc(C(=O)N(C)[C@H](C)c2ccccc2)cc(Cl)c1[O-] ZINC000178124383 1032529697 /nfs/dbraw/zinc/52/96/97/1032529697.db2.gz JJCPDDUZSAPVNB-GFCCVEGCSA-N -1 1 333.815 4.278 20 0 EIADMM COc1cc(C)c(S(=O)(=O)[N-]c2cscc2C)cc1C(C)C ZINC000432778935 1032788798 /nfs/dbraw/zinc/78/87/98/1032788798.db2.gz GAVBRTGRGBBVGE-UHFFFAOYSA-N -1 1 339.482 4.298 20 0 EIADMM COc1ccc(-c2ccccc2)cc1CNCc1cccc(C(=O)[O-])c1 ZINC000683176856 1019116230 /nfs/dbraw/zinc/11/62/30/1019116230.db2.gz UQKBYCCECZEDIS-UHFFFAOYSA-N -1 1 347.414 4.350 20 0 EIADMM O=C([N-]c1ccccc1SCC(F)(F)F)c1ncc(F)cc1F ZINC000683188999 1019205084 /nfs/dbraw/zinc/20/50/84/1019205084.db2.gz FWKHFPRTPXIARC-UHFFFAOYSA-N -1 1 348.296 4.267 20 0 EIADMM CCc1ccc(S(=O)(=O)[N-]c2ccc(-c3coc(C)n3)cc2)cc1 ZINC000029433420 1019216705 /nfs/dbraw/zinc/21/67/05/1019216705.db2.gz ZKSIHYMFMMQVCS-UHFFFAOYSA-N -1 1 342.420 4.013 20 0 EIADMM O=C(c1ccc([O-])c(F)c1)N1C[C@H](c2ccccc2)c2ccccc21 ZINC000683516950 1020856032 /nfs/dbraw/zinc/85/60/32/1020856032.db2.gz LKZJIESJDGPINW-QGZVFWFLSA-N -1 1 333.362 4.324 20 0 EIADMM COc1ccc(S(=O)(=O)[N-]c2cc(C)ccc2C)c2ccccc12 ZINC000035685651 1021035012 /nfs/dbraw/zinc/03/50/12/1021035012.db2.gz GJJWHJCLDWSLMS-UHFFFAOYSA-N -1 1 341.432 4.266 20 0 EIADMM CCC(C)(C)c1ccc(S(=O)(=O)[N-]c2ccccc2COC)cc1 ZINC000467071184 1021094893 /nfs/dbraw/zinc/09/48/93/1021094893.db2.gz HWWCQKJTESIDSO-UHFFFAOYSA-N -1 1 347.480 4.321 20 0 EIADMM CC(C)c1nnc([N-]C(=O)c2cc(-c3ccccc3Cl)on2)s1 ZINC000047443523 1021784725 /nfs/dbraw/zinc/78/47/25/1021784725.db2.gz UFRSIGQUFJWJKX-UHFFFAOYSA-N -1 1 348.815 4.222 20 0 EIADMM O=C(CCn1ccc2cc(Cl)ccc21)Nc1c([O-])cccc1F ZINC000089493376 1021848103 /nfs/dbraw/zinc/84/81/03/1021848103.db2.gz VWYLUEMKTYQVOS-UHFFFAOYSA-N -1 1 332.762 4.168 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N(CC1CCC1)CC(F)(F)F ZINC000175945614 1022518942 /nfs/dbraw/zinc/51/89/42/1022518942.db2.gz QLURSJROTWVUIR-UHFFFAOYSA-N -1 1 337.341 4.350 20 0 EIADMM O=C(Nc1cccc(C2SCCS2)c1)c1ccc([O-])cc1F ZINC000181062562 1022587252 /nfs/dbraw/zinc/58/72/52/1022587252.db2.gz HPWLPTXQNRASPC-UHFFFAOYSA-N -1 1 335.425 4.262 20 0 EIADMM CCOc1cc(C(=O)Nc2cccc([C@H](C)OC)c2)cc(Cl)c1[O-] ZINC000186771602 1022743934 /nfs/dbraw/zinc/74/39/34/1022743934.db2.gz HDSWXHKGXFUHJF-NSHDSACASA-N -1 1 349.814 4.404 20 0 EIADMM CCOc1cc(C(=O)Nc2ccc(OC)cc2C)cc(Cl)c1[O-] ZINC000186771914 1022744142 /nfs/dbraw/zinc/74/41/42/1022744142.db2.gz IHYYOXNELVVTAJ-UHFFFAOYSA-N -1 1 335.787 4.014 20 0 EIADMM O=C(Nc1cc(Cl)c([O-])c2ccccc12)c1ccnc2ccncc21 ZINC001167444704 1022817552 /nfs/dbraw/zinc/81/75/52/1022817552.db2.gz MBBBYWWKIUWZFP-UHFFFAOYSA-N -1 1 349.777 4.394 20 0 EIADMM O=C([O-])c1ccccc1C1CCN(Cc2cc(F)ccc2F)CC1 ZINC000363885477 1022892199 /nfs/dbraw/zinc/89/21/99/1022892199.db2.gz HRIIVZDXVLZQBH-UHFFFAOYSA-N -1 1 331.362 4.043 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc(-c3nccs3)cc2)c(C)c1 ZINC000096695247 1022898609 /nfs/dbraw/zinc/89/86/09/1022898609.db2.gz XHFBHGZQXAMZGR-UHFFFAOYSA-N -1 1 344.461 4.228 20 0 EIADMM CCCOc1ccc(-c2nc(=O)c3sc(C)cc3[n-]2)cc1OC ZINC000656491511 1023046572 /nfs/dbraw/zinc/04/65/72/1023046572.db2.gz MUPFHLXJNOKQMT-UHFFFAOYSA-N -1 1 330.409 4.170 20 0 EIADMM Cc1cc(C(=O)N2CCCC2)ccc1NCc1cccc([O-])c1Cl ZINC000414460625 1023108251 /nfs/dbraw/zinc/10/82/51/1023108251.db2.gz JZTPCYPQAYRQRI-UHFFFAOYSA-N -1 1 344.842 4.202 20 0 EIADMM O=c1cc(C(F)F)nc(SCc2cccc(Br)c2)[n-]1 ZINC000581398557 1023110651 /nfs/dbraw/zinc/11/06/51/1023110651.db2.gz VCHZHCKTPILUOT-UHFFFAOYSA-N -1 1 347.184 4.175 20 0 EIADMM CCOc1cc(C(=O)N2CC(C3CCCCC3)C2)cc(Cl)c1[O-] ZINC000584674718 1023166768 /nfs/dbraw/zinc/16/67/68/1023166768.db2.gz LXUDSLUPENDUTG-UHFFFAOYSA-N -1 1 337.847 4.097 20 0 EIADMM O=c1cc(C(F)F)nc(SCc2cc(-c3cccs3)on2)[n-]1 ZINC000584688846 1023189131 /nfs/dbraw/zinc/18/91/31/1023189131.db2.gz LXICIDOSNPUAIH-UHFFFAOYSA-N -1 1 341.364 4.129 20 0 EIADMM O=C(Nc1cc(Cl)ccc1[O-])c1ccc2c(c1)CCCCC2=O ZINC000584690129 1023191511 /nfs/dbraw/zinc/19/15/11/1023191511.db2.gz VXLRKXMVSXWESL-UHFFFAOYSA-N -1 1 329.783 4.207 20 0 EIADMM O=C(Nc1ccc(OC(F)F)c(Cl)c1)c1ccc([O-])cc1F ZINC000181081844 1023236640 /nfs/dbraw/zinc/23/66/40/1023236640.db2.gz FHHPHKGWWJMMLL-UHFFFAOYSA-N -1 1 331.677 4.038 20 0 EIADMM COc1cc(F)c(C(=O)[N-]c2c(F)cc(Cl)cc2F)c(F)c1 ZINC001266748021 1023297207 /nfs/dbraw/zinc/29/72/07/1023297207.db2.gz STVOKVZWRLLKLM-UHFFFAOYSA-N -1 1 333.668 4.157 20 0 EIADMM CC(=O)Nc1ccc(NC(=O)c2ccc3ccccc3c2[O-])cc1C ZINC000892745331 1023362272 /nfs/dbraw/zinc/36/22/72/1023362272.db2.gz NOTWNIALHQUJOM-UHFFFAOYSA-N -1 1 334.375 4.065 20 0 EIADMM CSc1ccc(Cl)cc1Nc1nc[n-]c(=O)c1Br ZINC001215913925 1023398577 /nfs/dbraw/zinc/39/85/77/1023398577.db2.gz VISVOWIUDASXRJ-UHFFFAOYSA-N -1 1 346.637 4.064 20 0 EIADMM CC(C)c1ccc([C@@H](CC(=O)[O-])NCc2ccc(F)cc2F)cc1 ZINC000584875383 1023411248 /nfs/dbraw/zinc/41/12/48/1023411248.db2.gz CRWHRFVVCJKXJN-GOSISDBHSA-N -1 1 333.378 4.394 20 0 EIADMM C[C@H](Oc1cc(Cl)cc(Cl)c1)C(=O)Nc1c([O-])cccc1F ZINC000605439946 1023411473 /nfs/dbraw/zinc/41/14/73/1023411473.db2.gz YTLGMNBTUGKZMT-QMMMGPOBSA-N -1 1 344.169 4.244 20 0 EIADMM CCc1ccc(-c2ccc(CN[C@@H](CC3CCC3)C(=O)[O-])o2)cc1 ZINC000417711431 1023413553 /nfs/dbraw/zinc/41/35/53/1023413553.db2.gz VOGQSEFOGQVWJJ-SFHVURJKSA-N -1 1 327.424 4.242 20 0 EIADMM O=C(Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)c1cccc(Cl)c1Cl ZINC000613665719 1023477944 /nfs/dbraw/zinc/47/79/44/1023477944.db2.gz VZVWBERUONQHJG-UHFFFAOYSA-N -1 1 348.189 4.341 20 0 EIADMM CC(C)(C)[C@H]1CCN(C(=O)c2c([O-])cnc3ccc(Cl)cc32)C1 ZINC000549224624 1023491520 /nfs/dbraw/zinc/49/15/20/1023491520.db2.gz YWMORAOSMMNNPO-NSHDSACASA-N -1 1 332.831 4.102 20 0 EIADMM CCn1c2ccc(C(=O)[O-])cc2nc1CN1CCCC(CC)(CC)C1 ZINC000656762317 1023503346 /nfs/dbraw/zinc/50/33/46/1023503346.db2.gz CJZDTNJJRWIERR-UHFFFAOYSA-N -1 1 343.471 4.157 20 0 EIADMM O=C([O-])c1ccc(-c2nc(CN3CCC[C@H](CCF)C3)cs2)cc1 ZINC000656763115 1023504220 /nfs/dbraw/zinc/50/42/20/1023504220.db2.gz LEXSGCGYFHMDNP-CYBMUJFWSA-N -1 1 348.443 4.080 20 0 EIADMM CC[C@@H](C)Oc1ccc([N-]S(=O)(=O)c2cc(F)ccc2C)cc1 ZINC000511688465 1023831136 /nfs/dbraw/zinc/83/11/36/1023831136.db2.gz RQHNGAVKCVJFFD-CYBMUJFWSA-N -1 1 337.416 4.112 20 0 EIADMM CC[C@@H](C)Oc1cccc([N-]S(=O)(=O)c2ccc3c(c2)CCC3)c1 ZINC000511722725 1023838611 /nfs/dbraw/zinc/83/86/11/1023838611.db2.gz NFOQMZVQRRJOKP-CQSZACIVSA-N -1 1 345.464 4.153 20 0 EIADMM Cc1c(Cl)cccc1-c1noc(-c2cnc(C(F)(F)F)[n-]2)n1 ZINC001213590086 1024328736 /nfs/dbraw/zinc/32/87/36/1024328736.db2.gz XXDBXXPQRLDHKL-UHFFFAOYSA-N -1 1 328.681 4.107 20 0 EIADMM Cc1c(Cl)cccc1-c1noc(-c2c[n-]c(C(F)(F)F)n2)n1 ZINC001213590086 1024328749 /nfs/dbraw/zinc/32/87/49/1024328749.db2.gz XXDBXXPQRLDHKL-UHFFFAOYSA-N -1 1 328.681 4.107 20 0 EIADMM CSc1cccc([N-]S(=O)(=O)c2ccc(Cl)cc2C)c1 ZINC000048652511 1024670950 /nfs/dbraw/zinc/67/09/50/1024670950.db2.gz VAXXSZPHWAVGIY-UHFFFAOYSA-N -1 1 327.858 4.171 20 0 EIADMM O=S(=O)([N-]c1cc(Cl)ccc1F)c1cccc(Cl)c1F ZINC000048653652 1024676104 /nfs/dbraw/zinc/67/61/04/1024676104.db2.gz QCBJCCLKXWYXOF-UHFFFAOYSA-N -1 1 338.162 4.072 20 0 EIADMM Cc1ccccc1Nc1nc(CN2CCCC[C@H]2CC(=O)[O-])cs1 ZINC000652463548 1024842239 /nfs/dbraw/zinc/84/22/39/1024842239.db2.gz KHGKSXHQGRLUAV-HNNXBMFYSA-N -1 1 345.468 4.024 20 0 EIADMM CCn1c2ccc(C(=O)[O-])cc2nc1CN1CCC(C(C)(C)C)CC1 ZINC000582008519 1024850033 /nfs/dbraw/zinc/85/00/33/1024850033.db2.gz PYMSGUHFRIJKDG-UHFFFAOYSA-N -1 1 343.471 4.013 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1C[C@@H]2CCC(=O)c3cccc1c32 ZINC000184391853 1024851343 /nfs/dbraw/zinc/85/13/43/1024851343.db2.gz SSPIHGJPPSOJND-AWEZNQCLSA-N -1 1 343.382 4.266 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2cccc(OC3CCCC3)c2)cc1 ZINC000028259926 1024935739 /nfs/dbraw/zinc/93/57/39/1024935739.db2.gz DYQIMBGCKBJQGT-UHFFFAOYSA-N -1 1 331.437 4.117 20 0 EIADMM O=C([O-])C[C@@H](NCc1ccc(CSC(F)F)o1)c1ccsc1 ZINC000277020672 1024998948 /nfs/dbraw/zinc/99/89/48/1024998948.db2.gz OGLHFPWKSPBBCE-GFCCVEGCSA-N -1 1 347.408 4.103 20 0 EIADMM O=C(C[C@@H]1CCCc2ccccc21)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC000342062664 1025082879 /nfs/dbraw/zinc/08/28/79/1025082879.db2.gz MSAYWTNRCCKNFF-INIZCTEOSA-N -1 1 347.418 4.231 20 0 EIADMM CC[C@@H](C)c1ccc(S(=O)(=O)[N-]c2ccc3oc(C)nc3c2)cc1 ZINC000008110063 1025208999 /nfs/dbraw/zinc/20/89/99/1025208999.db2.gz GNWFXAWTUJVCTH-GFCCVEGCSA-N -1 1 344.436 4.451 20 0 EIADMM CCc1nc(SCc2csc(-c3ccco3)n2)[n-]c(=O)c1C ZINC000519183319 1025578365 /nfs/dbraw/zinc/57/83/65/1025578365.db2.gz OSFPPEROWQPFOU-UHFFFAOYSA-N -1 1 333.438 4.062 20 0 EIADMM Cc1ccccc1-c1cccc(CNCc2ccc(C(=O)[O-])c(C)n2)c1 ZINC000426634869 1025823998 /nfs/dbraw/zinc/82/39/98/1025823998.db2.gz QUPFJUFIOWGTBS-UHFFFAOYSA-N -1 1 346.430 4.353 20 0 EIADMM C[C@@H](CC1CCCCC1)C(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC000512106354 1026020805 /nfs/dbraw/zinc/02/08/05/1026020805.db2.gz RKSHOZOKBFXDPI-ZDUSSCGKSA-N -1 1 327.428 4.327 20 0 EIADMM CC[C@@H](C)[C@@H](NCc1ccc(-c2nc3ccccc3s2)o1)C(=O)[O-] ZINC000277441495 1026031516 /nfs/dbraw/zinc/03/15/16/1026031516.db2.gz UORKWULMHGJGCN-BDJLRTHQSA-N -1 1 344.436 4.145 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc(-c3cnco3)cc2)cc1Cl ZINC000119785689 1026104459 /nfs/dbraw/zinc/10/44/59/1026104459.db2.gz VJYIDMPLEDMDBE-UHFFFAOYSA-N -1 1 348.811 4.104 20 0 EIADMM CC(C)CN(C(=O)c1ccc([O-])cn1)[C@H](C)c1ccccc1Cl ZINC001143435476 1026113678 /nfs/dbraw/zinc/11/36/78/1026113678.db2.gz RJRCDJQEEKOLRK-CYBMUJFWSA-N -1 1 332.831 4.300 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1cnn(-c2cccc(Cl)c2)c1 ZINC000111666045 1026314371 /nfs/dbraw/zinc/31/43/71/1026314371.db2.gz VSNWTQVNRKJEKE-UHFFFAOYSA-N -1 1 348.189 4.137 20 0 EIADMM CCCN(Cc1ccccc1)c1ccc(-c2nc(C)c(C)c(=O)[n-]2)cn1 ZINC000663728029 1026329462 /nfs/dbraw/zinc/32/94/62/1026329462.db2.gz IBLRJQHRXMAMJP-UHFFFAOYSA-N -1 1 348.450 4.278 20 0 EIADMM COc1ccc(Cl)c(NC(=O)c2ccc3ccccc3c2[O-])c1 ZINC000321323463 1026371014 /nfs/dbraw/zinc/37/10/14/1026371014.db2.gz OJZMITWJLCEUAG-UHFFFAOYSA-N -1 1 327.767 4.460 20 0 EIADMM COc1cc(C(=O)N(C)C2CCC(C(C)C)CC2)cc(Cl)c1[O-] ZINC000432539485 1026459631 /nfs/dbraw/zinc/45/96/31/1026459631.db2.gz CAFWEGAIZZPRBG-UHFFFAOYSA-N -1 1 339.863 4.341 20 0 EIADMM O=C([O-])C[C@H](NCc1c(Cl)oc2ccccc21)c1ccsc1 ZINC000426695958 1026482487 /nfs/dbraw/zinc/48/24/87/1026482487.db2.gz PQQJDQMSZKRENV-ZDUSSCGKSA-N -1 1 335.812 4.453 20 0 EIADMM O=C([O-])Cc1ccccc1CNCc1ccc(-c2ccccc2F)o1 ZINC000426691852 1026492368 /nfs/dbraw/zinc/49/23/68/1026492368.db2.gz LZSYYFBYQVPOKY-UHFFFAOYSA-N -1 1 339.366 4.003 20 0 EIADMM Cc1ccc([C@@H](CC(=O)[O-])NCc2cccc(OC3CCCC3)c2)o1 ZINC000426766192 1026532856 /nfs/dbraw/zinc/53/28/56/1026532856.db2.gz XSHCLHGSSJSXEM-GOSISDBHSA-N -1 1 343.423 4.215 20 0 EIADMM O=C([O-])[C@@H](NCc1cc(F)cc(Cl)c1)c1ccc(Cl)c(F)c1 ZINC000426752889 1026538156 /nfs/dbraw/zinc/53/81/56/1026538156.db2.gz FWMCRLWYGROPML-AWEZNQCLSA-N -1 1 346.160 4.187 20 0 EIADMM Cc1ccoc1CN[C@H](CC(=O)[O-])c1cc(Cl)cc(Cl)c1 ZINC000426758998 1026543024 /nfs/dbraw/zinc/54/30/24/1026543024.db2.gz VDHOVXJZQYDSPF-CYBMUJFWSA-N -1 1 328.195 4.200 20 0 EIADMM O=C([O-])[C@@H](NCc1ccc(-c2cccc(F)c2)s1)c1ccccc1 ZINC000426772697 1026550620 /nfs/dbraw/zinc/55/06/20/1026550620.db2.gz LDJFAFKIOKUSHL-SFHVURJKSA-N -1 1 341.407 4.470 20 0 EIADMM Cn1ccc(C(=O)Nc2ccc([O-])c(Cl)c2)c1-c1ccccc1 ZINC001137674094 1026619512 /nfs/dbraw/zinc/61/95/12/1026619512.db2.gz FFWKUTCXOREOBG-UHFFFAOYSA-N -1 1 326.783 4.303 20 0 EIADMM O=C([N-]c1c(F)cc(Cl)cc1F)c1csc(C(F)(F)F)n1 ZINC000351746396 1026619753 /nfs/dbraw/zinc/61/97/53/1026619753.db2.gz RCOXLBQYDOENBK-UHFFFAOYSA-N -1 1 342.676 4.346 20 0 EIADMM CSc1ccccc1NC(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684871268 1026635457 /nfs/dbraw/zinc/63/54/57/1026635457.db2.gz ZTIAFMHHGYCWNA-UHFFFAOYSA-N -1 1 327.327 4.385 20 0 EIADMM C[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684875495 1026650330 /nfs/dbraw/zinc/65/03/30/1026650330.db2.gz GXYDVGDLIBWEFD-SUNKGSAMSA-N -1 1 327.346 4.204 20 0 EIADMM CCCc1cnc(NC(=O)c2ccc(C(F)(F)F)c([O-])c2)s1 ZINC000684877387 1026655251 /nfs/dbraw/zinc/65/52/51/1026655251.db2.gz OFVKKATYCJISLO-UHFFFAOYSA-N -1 1 330.331 4.072 20 0 EIADMM CC(C)n1ncc2cc(NC(=O)Nc3ccc([O-])c(Cl)c3)cnc21 ZINC000582461879 1026670539 /nfs/dbraw/zinc/67/05/39/1026670539.db2.gz GPBTWUOFWXKVSY-UHFFFAOYSA-N -1 1 345.790 4.015 20 0 EIADMM COC(=O)c1c[n-]c(S[C@H](C)c2cc(Cl)ccc2Cl)n1 ZINC000432657046 1026679346 /nfs/dbraw/zinc/67/93/46/1026679346.db2.gz JLXUDLGSYNFKJT-SSDOTTSWSA-N -1 1 331.224 4.356 20 0 EIADMM Cc1nc2ccc(S(=O)(=O)[N-]c3ccc(C)cc3C)cc2s1 ZINC000427116559 1026727150 /nfs/dbraw/zinc/72/71/50/1026727150.db2.gz YPBRRBCAALQKLR-UHFFFAOYSA-N -1 1 332.450 4.022 20 0 EIADMM CCSc1cccc(-c2nc3cc(OC)c(OC)cc3c(=O)[n-]2)c1 ZINC000427455766 1026858672 /nfs/dbraw/zinc/85/86/72/1026858672.db2.gz DNXMTJOJSXEOTJ-UHFFFAOYSA-N -1 1 342.420 4.132 20 0 EIADMM COc1ccccc1[C@H]1CCN(C(=O)c2ccc3ccccc3c2[O-])C1 ZINC000152932824 1026905124 /nfs/dbraw/zinc/90/51/24/1026905124.db2.gz GAXDUFKUKMVIKD-INIZCTEOSA-N -1 1 347.414 4.184 20 0 EIADMM Cc1cnc(C(=O)N(C)[C@@H](C)c2ccc(Cl)cc2Cl)c([O-])c1 ZINC000460293963 1027036411 /nfs/dbraw/zinc/03/64/11/1027036411.db2.gz QVQDJCOMNYMRJR-JTQLQIEISA-N -1 1 339.222 4.236 20 0 EIADMM Cc1ccc(-c2cc(C(=O)Nc3ccc([O-])c(Cl)c3)on2)cc1 ZINC000440945859 1027131260 /nfs/dbraw/zinc/13/12/60/1027131260.db2.gz RTTHYNFRAGLQRP-UHFFFAOYSA-N -1 1 328.755 4.261 20 0 EIADMM Cc1ccc(Cl)c(O[C@@H](C)C(=O)Nc2ccc([O-])c(Cl)c2)c1 ZINC000440948644 1027153974 /nfs/dbraw/zinc/15/39/74/1027153974.db2.gz MSIXCYPPFASBCT-JTQLQIEISA-N -1 1 340.206 4.413 20 0 EIADMM Oc1cccc(C[NH2+]C[C@@H](OC2CCCC2)C(F)(F)F)c1Cl ZINC000657587618 1027214298 /nfs/dbraw/zinc/21/42/98/1027214298.db2.gz FTGULEZIYIUKMK-CYBMUJFWSA-N -1 1 337.769 4.025 20 0 EIADMM O=C([N-]c1ccccc1SCC(F)(F)F)c1cc(C2CC2)no1 ZINC000685036212 1027458011 /nfs/dbraw/zinc/45/80/11/1027458011.db2.gz LBBRSBGUBQLTLV-UHFFFAOYSA-N -1 1 342.342 4.459 20 0 EIADMM COc1c(C)ccc([N-]S(=O)(=O)c2ccc(C)c(Cl)c2)c1C ZINC000614787014 1027670241 /nfs/dbraw/zinc/67/02/41/1027670241.db2.gz MRBPLOXAKMZGIY-UHFFFAOYSA-N -1 1 339.844 4.075 20 0 EIADMM Cc1cc(Cl)ccc1NC(=O)c1cc(Br)ccc1[O-] ZINC000039302620 1027778950 /nfs/dbraw/zinc/77/89/50/1027778950.db2.gz ZYMJQJYBEAGNCX-UHFFFAOYSA-N -1 1 340.604 4.369 20 0 EIADMM Cc1ccccc1S(=O)(=O)[N-]c1ccc(OC(F)F)c(Cl)c1 ZINC000039973880 1027808609 /nfs/dbraw/zinc/80/86/09/1027808609.db2.gz JQMPIDXMBBNCQA-UHFFFAOYSA-N -1 1 347.770 4.051 20 0 EIADMM Cc1cnc(C(=O)N2CCCC[C@@H]2c2cccc(Cl)c2)c([O-])c1 ZINC000444665923 1027948213 /nfs/dbraw/zinc/94/82/13/1027948213.db2.gz REPYDGNHEZWTID-OAHLLOKOSA-N -1 1 330.815 4.116 20 0 EIADMM Cc1coc(-c2cc([N-]S(=O)(=O)c3ccccc3C)ccc2C)n1 ZINC000150798562 1028144173 /nfs/dbraw/zinc/14/41/73/1028144173.db2.gz SMEMVXBBTHSJBH-UHFFFAOYSA-N -1 1 342.420 4.068 20 0 EIADMM O=C1[N-]C(=O)C(=Cc2ccc(-c3ccc(C(F)(F)F)cc3)o2)S1 ZINC000201372510 1028236732 /nfs/dbraw/zinc/23/67/32/1028236732.db2.gz NWIUWQVHBBEHSD-GHXNOFRVSA-N -1 1 339.294 4.289 20 0 EIADMM COc1cc(C(=O)N2CCC[C@H]2c2ccccc2)cc(Cl)c1[O-] ZINC000343134523 1028339018 /nfs/dbraw/zinc/33/90/18/1028339018.db2.gz MUZVZZSFMXTBQH-HNNXBMFYSA-N -1 1 331.799 4.032 20 0 EIADMM CCOc1cc(-c2noc(-c3ccc(Cl)o3)n2)cc(Cl)c1[O-] ZINC000445399612 1028511928 /nfs/dbraw/zinc/51/19/28/1028511928.db2.gz DBEPXYOSVAZPPF-UHFFFAOYSA-N -1 1 341.150 4.408 20 0 EIADMM CCOc1cc(-c2noc(-c3ccc(C)cc3O)n2)cc(Cl)c1[O-] ZINC000445422652 1028521796 /nfs/dbraw/zinc/52/17/96/1028521796.db2.gz PHAIUFBEGCYFKY-UHFFFAOYSA-N -1 1 346.770 4.175 20 0 EIADMM CCCCO[C@@H](C)c1nc(-c2cc(Cl)c([O-])c(OCC)c2)no1 ZINC000445427588 1028523360 /nfs/dbraw/zinc/52/33/60/1028523360.db2.gz PPYFEZGOPROCLO-JTQLQIEISA-N -1 1 340.807 4.372 20 0 EIADMM [O-]c1ccc(-c2noc(-c3ccc4ncsc4c3)n2)c(Cl)c1 ZINC000445448331 1028537746 /nfs/dbraw/zinc/53/77/46/1028537746.db2.gz RSIWLTAQGDFVSG-UHFFFAOYSA-N -1 1 329.768 4.372 20 0 EIADMM [O-]c1ccc(-c2noc(CCCOc3ccccc3)n2)c(Cl)c1 ZINC000445447987 1028538283 /nfs/dbraw/zinc/53/82/83/1028538283.db2.gz JTJSKVKTEPKWKN-UHFFFAOYSA-N -1 1 330.771 4.107 20 0 EIADMM [O-]c1ccc(-c2noc(Cc3cc(F)c(F)cc3F)n2)c(Cl)c1 ZINC000445450246 1028546246 /nfs/dbraw/zinc/54/62/46/1028546246.db2.gz XIDXFQFWCBDYNV-UHFFFAOYSA-N -1 1 340.688 4.104 20 0 EIADMM Cc1cccc2c(Cc3nc(-c4ccc([O-])cc4Cl)no3)c[nH]c21 ZINC000445445695 1028574251 /nfs/dbraw/zinc/57/42/51/1028574251.db2.gz JZAYRPYNLLHXRT-UHFFFAOYSA-N -1 1 339.782 4.476 20 0 EIADMM [O-]c1ccc(-c2noc(C[C@H]3CCOc4ccccc43)n2)c(Cl)c1 ZINC000445454461 1028606817 /nfs/dbraw/zinc/60/68/17/1028606817.db2.gz ZYUIMKNURDEPOL-LLVKDONJSA-N -1 1 342.782 4.204 20 0 EIADMM Cc1nc(-c2ccccc2)oc1-c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445477127 1028623435 /nfs/dbraw/zinc/62/34/35/1028623435.db2.gz BDAHVDOGQZGUGY-UHFFFAOYSA-N -1 1 337.310 4.212 20 0 EIADMM [O-]c1ccc(-c2noc(-c3csc(Br)c3)n2)cc1F ZINC000445482169 1028634239 /nfs/dbraw/zinc/63/42/39/1028634239.db2.gz RJEZRPKPIUBAEX-UHFFFAOYSA-N -1 1 341.161 4.072 20 0 EIADMM CC(C)CCc1ccc([N-]S(=O)(=O)c2ccc3c(c2)COC3)cc1 ZINC000524103657 1028654869 /nfs/dbraw/zinc/65/48/69/1028654869.db2.gz RHHFJTCUDBHHPG-UHFFFAOYSA-N -1 1 345.464 4.106 20 0 EIADMM O=C(c1cc(Cl)ccc1[O-])N1CCC(c2ccccc2F)CC1 ZINC000524246739 1028828072 /nfs/dbraw/zinc/82/80/72/1028828072.db2.gz BAOPBFLLSRSLFJ-UHFFFAOYSA-N -1 1 333.790 4.205 20 0 EIADMM Cc1ccccc1S(=O)(=O)[N-]c1ccc2oc(C(C)(C)C)nc2c1 ZINC000524292161 1028845576 /nfs/dbraw/zinc/84/55/76/1028845576.db2.gz SHSSHNPZPDXKKS-UHFFFAOYSA-N -1 1 344.436 4.235 20 0 EIADMM CCOc1cc(C(=O)N2CCC[C@](C)(CC)C2)cc(Cl)c1[O-] ZINC000358105070 1029200072 /nfs/dbraw/zinc/20/00/72/1029200072.db2.gz GKFYDKYAYFNQOD-KRWDZBQOSA-N -1 1 325.836 4.097 20 0 EIADMM CSc1cc(O)ccc1[N-]C(=O)c1cc(-c2cccc(F)c2)no1 ZINC000583848010 1029269966 /nfs/dbraw/zinc/26/99/66/1029269966.db2.gz HBUUTSNJPYQOCP-UHFFFAOYSA-N -1 1 344.367 4.161 20 0 EIADMM CCSc1cccc([N-]S(=O)(=O)c2cc(F)c(F)c(F)c2)c1 ZINC000525009522 1029383064 /nfs/dbraw/zinc/38/30/64/1029383064.db2.gz FTCVBZHCXNAXLO-UHFFFAOYSA-N -1 1 347.383 4.017 20 0 EIADMM Cc1ccc(Cl)c([N-]S(=O)(=O)c2cccc(F)c2F)c1C ZINC000446945429 1029648723 /nfs/dbraw/zinc/64/87/23/1029648723.db2.gz FVOUEYSZNWKEBC-UHFFFAOYSA-N -1 1 331.771 4.036 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2c(C)c(C)ccc2Cl)sc1C ZINC000446963974 1029653218 /nfs/dbraw/zinc/65/32/18/1029653218.db2.gz ACKABALDXQRCIE-UHFFFAOYSA-N -1 1 329.874 4.436 20 0 EIADMM Cc1nc(-c2ccc(NC[C@@H]3CCC[C@@H](C)C3)nc2)[n-]c(=O)c1C ZINC000301348391 1029713843 /nfs/dbraw/zinc/71/38/43/1029713843.db2.gz HXWIFTSQVPCEFA-IUODEOHRSA-N -1 1 326.444 4.099 20 0 EIADMM Cc1ccc([C@@H](C)N(C)c2ccc(-c3nc(C)c(C)c(=O)[n-]3)cn2)cc1 ZINC000301525077 1029749528 /nfs/dbraw/zinc/74/95/28/1029749528.db2.gz MXDWQBXDJNKGBN-MRXNPFEDSA-N -1 1 348.450 4.367 20 0 EIADMM Cc1nc(-c2ccc(N[C@@H]3CCCCC3(C)C)nc2)[n-]c(=O)c1C ZINC000301621318 1029774744 /nfs/dbraw/zinc/77/47/44/1029774744.db2.gz NCLMMCYEPVJNRO-OAHLLOKOSA-N -1 1 326.444 4.242 20 0 EIADMM COc1cc(C)cc([N-]S(=O)(=O)c2cccc(C(C)C)c2)c1C ZINC000447274547 1029938148 /nfs/dbraw/zinc/93/81/48/1029938148.db2.gz MKAFNLIBBHTWDS-UHFFFAOYSA-N -1 1 333.453 4.236 20 0 EIADMM Cc1nc(C(C)(C)C)[n-]c(=O)c1C(=O)N(C)C[C@@H](C)C1CCCCC1 ZINC000530040754 1030078577 /nfs/dbraw/zinc/07/85/77/1030078577.db2.gz VOBKUBZSLWLAEV-CYBMUJFWSA-N -1 1 347.503 4.077 20 0 EIADMM O=S(=O)([N-]c1ccc2cc[nH]c2c1)c1cc(Cl)cc(Cl)c1 ZINC000144766291 1030079765 /nfs/dbraw/zinc/07/97/65/1030079765.db2.gz YQUMQCNAFDOGIJ-UHFFFAOYSA-N -1 1 341.219 4.276 20 0 EIADMM C[C@H]1CC(C(=O)[O-])C[C@H](C)N1Cc1csc(C2CCCCC2)n1 ZINC000530176321 1030195834 /nfs/dbraw/zinc/19/58/34/1030195834.db2.gz SKXIWJOCXWSMKN-STQMWFEESA-N -1 1 336.501 4.264 20 0 EIADMM CC(F)(F)c1ccccc1[N-]S(=O)(=O)c1ccc(C2CC2)cc1 ZINC000451081180 1030229310 /nfs/dbraw/zinc/22/93/10/1030229310.db2.gz DMCCZCLKGCPSFK-UHFFFAOYSA-N -1 1 337.391 4.477 20 0 EIADMM COc1cc(C(=O)N2CC[C@H](C)[C@@H]3CCCC[C@H]32)cc(Cl)c1[O-] ZINC000526949750 1030341717 /nfs/dbraw/zinc/34/17/17/1030341717.db2.gz KVWHIHJUBHCEFC-CORIIIEPSA-N -1 1 337.847 4.095 20 0 EIADMM CCOc1ccc(N(CC)C(=O)c2cc(SC)ccc2[O-])cc1 ZINC000666203843 1030530051 /nfs/dbraw/zinc/53/00/51/1030530051.db2.gz PEBASKCBQFWHMG-UHFFFAOYSA-N -1 1 331.437 4.180 20 0 EIADMM C[C@@H]1CC[C@H](C(=O)[O-])CN1Cc1ccc(Cl)c(C(F)(F)F)c1 ZINC000263311175 1030823134 /nfs/dbraw/zinc/82/31/34/1030823134.db2.gz HZMWCCTYOGJBKV-KOLCDFICSA-N -1 1 335.753 4.044 20 0 EIADMM C[C@@H]1CC[C@H](C(=O)[O-])CN1Cc1cc(C(F)(F)F)ccc1Cl ZINC000263396038 1030848270 /nfs/dbraw/zinc/84/82/70/1030848270.db2.gz ZKHQTHXMYNJPRU-ZJUUUORDSA-N -1 1 335.753 4.044 20 0 EIADMM O=S(=O)([N-]c1ccc2c(c1)N=NC2)c1ccc(C(F)(F)F)cc1 ZINC000039942410 1031108257 /nfs/dbraw/zinc/10/82/57/1031108257.db2.gz GHWNOYHVHCCGPT-UHFFFAOYSA-N -1 1 341.314 4.104 20 0 EIADMM CC1(C)C[C@@H](C(=O)Nc2ccc([O-])c(Cl)c2)c2ccccc2O1 ZINC000413661046 1031384787 /nfs/dbraw/zinc/38/47/87/1031384787.db2.gz XFRKIFFEOSLINM-CYBMUJFWSA-N -1 1 331.799 4.329 20 0 EIADMM CC[C@H](NC(=O)c1c[nH]c2ccccc2c1=O)c1cccc(Cl)c1 ZINC000053799211 1032039660 /nfs/dbraw/zinc/03/96/60/1032039660.db2.gz IBJCIEIABVOOFK-INIZCTEOSA-N -1 1 340.810 4.063 20 0 EIADMM CCCN(CCC)C(=O)c1ccc(Nc2ccnc(Cl)c2[O-])cc1 ZINC001211765457 1033857952 /nfs/dbraw/zinc/85/79/52/1033857952.db2.gz WSHMTPVPKGYWPY-UHFFFAOYSA-N -1 1 347.846 4.446 20 0 EIADMM CCCOc1cccc(F)c1Nc1cc2ccc([O-])cc2oc1=O ZINC001211786283 1033910416 /nfs/dbraw/zinc/91/04/16/1033910416.db2.gz YQEUTVYREDQXGW-UHFFFAOYSA-N -1 1 329.327 4.170 20 0 EIADMM CCOCc1ccccc1CNC(=O)c1cc2ccccc2cc1[O-] ZINC000030179548 1034686645 /nfs/dbraw/zinc/68/66/45/1034686645.db2.gz OZTCGWCCUBWOKZ-UHFFFAOYSA-N -1 1 335.403 4.012 20 0 EIADMM CCC(=O)c1cccc([N-]S(=O)(=O)c2cccc3ccccc32)c1 ZINC000433599964 1034837343 /nfs/dbraw/zinc/83/73/43/1034837343.db2.gz OPYCWRLUTXMLPL-UHFFFAOYSA-N -1 1 339.416 4.233 20 0 EIADMM [O-]c1ccc(F)cc1-c1nc(-c2ccsc2C(F)(F)F)no1 ZINC000904922601 1035662096 /nfs/dbraw/zinc/66/20/96/1035662096.db2.gz HTWHIGZXQDXFFL-UHFFFAOYSA-N -1 1 330.262 4.329 20 0 EIADMM [O-]c1ccc(F)cc1-c1nc(-c2ccc(C(F)(F)F)s2)no1 ZINC000904972988 1035690586 /nfs/dbraw/zinc/69/05/86/1035690586.db2.gz PJCDNKIUKCKKIR-UHFFFAOYSA-N -1 1 330.262 4.329 20 0 EIADMM Cc1cc(C)c([N-]S(=O)(=O)c2c(C)c(C)cc(C)c2C)c(C)n1 ZINC000414460425 1035720253 /nfs/dbraw/zinc/72/02/53/1035720253.db2.gz QLCGZEIJLODJRZ-UHFFFAOYSA-N -1 1 332.469 4.041 20 0 EIADMM CCn1ncc2ccc(NC(=O)c3cc4ccccc4cc3[O-])cc21 ZINC000195743347 1035884879 /nfs/dbraw/zinc/88/48/79/1035884879.db2.gz IWIXBCYQXSZLOD-UHFFFAOYSA-N -1 1 331.375 4.167 20 0 EIADMM COc1cc(C(=O)N[C@@H](c2ccc(C)cc2)C2CC2)cc(Cl)c1[O-] ZINC000571113331 1035944771 /nfs/dbraw/zinc/94/47/71/1035944771.db2.gz GKMRZFPFRUAIEU-KRWDZBQOSA-N -1 1 345.826 4.244 20 0 EIADMM CO[C@@H](C)c1cccc([N-]S(=O)(=O)c2ccc3c(c2)CCCC3)c1 ZINC000588833511 1036544244 /nfs/dbraw/zinc/54/42/44/1036544244.db2.gz NTMDZYNIZNCHPY-AWEZNQCLSA-N -1 1 345.464 4.074 20 0 EIADMM CO[C@H](C)c1cccc([N-]S(=O)(=O)c2ccc(C(C)(C)C)cc2)c1 ZINC000588833826 1036545782 /nfs/dbraw/zinc/54/57/82/1036545782.db2.gz SHFOBTWEWKQYCT-CQSZACIVSA-N -1 1 347.480 4.492 20 0 EIADMM COc1cccc(S(=O)(=O)[N-]c2ccccc2CCC(C)C)c1 ZINC000589434669 1036798726 /nfs/dbraw/zinc/79/87/26/1036798726.db2.gz LJYDYMTZCCWAAJ-UHFFFAOYSA-N -1 1 333.453 4.085 20 0 EIADMM CCCCCCN(C)CC(=O)Nc1ccc2sc(C(=O)[O-])cc2c1 ZINC000909120275 1037059910 /nfs/dbraw/zinc/05/99/10/1037059910.db2.gz XWKXMJORXJSMSC-UHFFFAOYSA-N -1 1 348.468 4.050 20 0 EIADMM COc1ccc(C2(C(=O)Nc3cc([O-])c(F)cc3F)CCCC2)cc1 ZINC000909979191 1037219096 /nfs/dbraw/zinc/21/90/96/1037219096.db2.gz OGNYCMRBEOTTKE-UHFFFAOYSA-N -1 1 347.361 4.130 20 0 EIADMM Cc1nc(-c2ccc(N[C@@H]3Cc4ccccc4[C@@H]3C)nc2)[n-]c(=O)c1C ZINC000664292497 1037396659 /nfs/dbraw/zinc/39/66/59/1037396659.db2.gz DOQTUUWAAQGVJK-SCLBCKFNSA-N -1 1 346.434 4.001 20 0 EIADMM Cc1cnc([C@H](C)Sc2nc(-c3ccccc3)c(C)c(=O)[n-]2)cn1 ZINC000488271716 1037469145 /nfs/dbraw/zinc/46/91/45/1037469145.db2.gz ZPYQRDBFZOZDGW-ZDUSSCGKSA-N -1 1 338.436 4.109 20 0 EIADMM O=C(Nc1c([O-])cccc1F)c1cccc(OCc2cccs2)c1 ZINC000605435989 1037787132 /nfs/dbraw/zinc/78/71/32/1037787132.db2.gz JOPRTQSRVSWJBT-UHFFFAOYSA-N -1 1 343.379 4.424 20 0 EIADMM Cc1ccc(C)c(OCCCCC(=O)Nc2c([O-])cccc2F)c1 ZINC000605436684 1037787665 /nfs/dbraw/zinc/78/76/65/1037787665.db2.gz LUENIHUSEVZOBV-UHFFFAOYSA-N -1 1 331.387 4.336 20 0 EIADMM O=C(CCc1ccc(OC(F)(F)F)cc1)Nc1c([O-])cccc1F ZINC000605439611 1037788381 /nfs/dbraw/zinc/78/83/81/1037788381.db2.gz IZUHMMALGWAURH-UHFFFAOYSA-N -1 1 343.276 4.001 20 0 EIADMM CC(C)Oc1cccc(CSc2nc(C(F)(F)F)cc(=O)[n-]2)c1 ZINC000605447822 1037793053 /nfs/dbraw/zinc/79/30/53/1037793053.db2.gz OZZXMJXLWFBOQG-UHFFFAOYSA-N -1 1 344.358 4.281 20 0 EIADMM CCc1cccc(CC)c1S(=O)(=O)[N-]c1ccc2nc(C)oc2c1 ZINC000605495438 1037823167 /nfs/dbraw/zinc/82/31/67/1037823167.db2.gz CCBKUIGPRGPOKM-UHFFFAOYSA-N -1 1 344.436 4.062 20 0 EIADMM CCCC[C@@H](CC)CCCN(C)C(=O)c1cnc(C2CC2)[n-]c1=O ZINC000912764839 1038275656 /nfs/dbraw/zinc/27/56/56/1038275656.db2.gz MKRBEHLSDYEQQS-CQSZACIVSA-N -1 1 333.476 4.128 20 0 EIADMM CSc1cccc([N-]S(=O)(=O)c2cc(Cl)ccc2C)c1 ZINC000031665519 1038347797 /nfs/dbraw/zinc/34/77/97/1038347797.db2.gz IRZGJNRUEWKUHY-UHFFFAOYSA-N -1 1 327.858 4.171 20 0 EIADMM COc1c(C)cc(S(=O)(=O)[N-]c2ccccc2C(F)F)cc1C ZINC000424061425 1038484495 /nfs/dbraw/zinc/48/44/95/1038484495.db2.gz FLSYEGBIJAEDGJ-UHFFFAOYSA-N -1 1 341.379 4.050 20 0 EIADMM O=C(Nc1c([O-])cccc1F)c1cc(-c2ccc(Cl)cc2)on1 ZINC000608366414 1038804497 /nfs/dbraw/zinc/80/44/97/1038804497.db2.gz UTIKJHPRJXFRBU-UHFFFAOYSA-N -1 1 332.718 4.092 20 0 EIADMM CCc1ccc(-c2ccc(CN3CCC[C@H](C)[C@H]3C(=O)[O-])o2)cc1 ZINC000424424460 1038845080 /nfs/dbraw/zinc/84/50/80/1038845080.db2.gz WSLQPEGQGYYONA-LIRRHRJNSA-N -1 1 327.424 4.194 20 0 EIADMM C[C@@H]1CCCN(Cc2cc(C(F)(F)F)ccc2Cl)[C@@H]1C(=O)[O-] ZINC000424417519 1038851388 /nfs/dbraw/zinc/85/13/88/1038851388.db2.gz MCDGVBAKKHBFKI-RNCFNFMXSA-N -1 1 335.753 4.044 20 0 EIADMM CC(C)n1ncc2cc(S(=O)(=O)[N-]c3cccc(Cl)c3)ccc21 ZINC000476500851 1038869943 /nfs/dbraw/zinc/86/99/43/1038869943.db2.gz RNZZRBHXODWWMJ-UHFFFAOYSA-N -1 1 349.843 4.071 20 0 EIADMM Cc1cccc(S(=O)(=O)[N-]c2ccc(OC(C)C)c(Cl)c2)c1 ZINC000505045194 1038897158 /nfs/dbraw/zinc/89/71/58/1038897158.db2.gz UYLFXAMJBAXDEC-UHFFFAOYSA-N -1 1 339.844 4.236 20 0 EIADMM CC(=O)Nc1ccc([O-])c(C(=O)Nc2ccccc2CCC(C)C)c1 ZINC000534360928 1039361560 /nfs/dbraw/zinc/36/15/60/1039361560.db2.gz SBBDCYZECJCBLY-UHFFFAOYSA-N -1 1 340.423 4.192 20 0 EIADMM COc1cc(C(=O)N2CC3(CCC3)[C@H]2c2ccco2)cc(Cl)c1[O-] ZINC000456582197 1039479522 /nfs/dbraw/zinc/47/95/22/1039479522.db2.gz ZEFXYUDJTLXRPH-MRXNPFEDSA-N -1 1 347.798 4.015 20 0 EIADMM Cc1ccccc1C1(C(=O)Nc2ccc([O-])c(F)c2F)CCCC1 ZINC000456774632 1039588784 /nfs/dbraw/zinc/58/87/84/1039588784.db2.gz CMDYBJCOFRHQMM-UHFFFAOYSA-N -1 1 331.362 4.429 20 0 EIADMM CC(C)(C)O[C@H](C(=O)Nc1ccc([O-])c(F)c1F)c1ccccc1 ZINC000456779322 1039601708 /nfs/dbraw/zinc/60/17/08/1039601708.db2.gz HTUUZPGPNOHKDS-INIZCTEOSA-N -1 1 335.350 4.165 20 0 EIADMM O=C(Nc1ccc([O-])c(F)c1F)C1(c2cccc(F)c2)CCCC1 ZINC000456792276 1039610770 /nfs/dbraw/zinc/61/07/70/1039610770.db2.gz IMWUSBJQTCTDCX-UHFFFAOYSA-N -1 1 335.325 4.260 20 0 EIADMM C[C@@H]1C[C@@H]1c1ccc([C@@H]2C[C@H]2C(=O)Nc2ccc([O-])c(F)c2F)o1 ZINC000456793725 1039610875 /nfs/dbraw/zinc/61/08/75/1039610875.db2.gz OGOHNSVZJATQBM-LMLFDSFASA-N -1 1 333.334 4.129 20 0 EIADMM COc1ccc(CCCCC(=O)Nc2ccc([O-])c(F)c2F)cc1 ZINC000456792183 1039612405 /nfs/dbraw/zinc/61/24/05/1039612405.db2.gz HBCFYSHMZXZERK-UHFFFAOYSA-N -1 1 335.350 4.031 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1C[C@H]2CCCN2c2ccccc21 ZINC000537642492 1039722934 /nfs/dbraw/zinc/72/29/34/1039722934.db2.gz CQHZYCGLDPWKNF-QGZVFWFLSA-N -1 1 344.414 4.175 20 0 EIADMM CCOc1ccc(F)c([N-]C(=O)c2cc(-c3ccccc3)on2)c1F ZINC000534768730 1039770363 /nfs/dbraw/zinc/77/03/63/1039770363.db2.gz CEVRXQWFOBUUKS-UHFFFAOYSA-N -1 1 344.317 4.271 20 0 EIADMM COc1cc(C(=O)Nc2ccc(Cl)cc2C)cc(Cl)c1[O-] ZINC000476625916 1039808769 /nfs/dbraw/zinc/80/87/69/1039808769.db2.gz LLQXHCNLULLNRG-UHFFFAOYSA-N -1 1 326.179 4.268 20 0 EIADMM O=C(Nc1ccc(Cl)cc1[O-])C(F)(F)c1c(F)cccc1F ZINC000757908321 1039828097 /nfs/dbraw/zinc/82/80/97/1039828097.db2.gz MQRPHRWXLAGEDY-UHFFFAOYSA-N -1 1 333.668 4.054 20 0 EIADMM O=C(N[C@H](c1ccccc1)C1CC1)c1ccc(Br)c([O-])c1 ZINC000481832276 1039852980 /nfs/dbraw/zinc/85/29/80/1039852980.db2.gz STUPLZABFVKIHX-MRXNPFEDSA-N -1 1 346.224 4.036 20 0 EIADMM CCc1cccc(S(=O)(=O)[N-]c2nc(C)c(Cl)cc2Cl)c1 ZINC000481962864 1039927560 /nfs/dbraw/zinc/92/75/60/1039927560.db2.gz QZCKWIURHDBGHT-UHFFFAOYSA-N -1 1 345.251 4.060 20 0 EIADMM CCC[C@@]1(C)CCCN(Cc2coc(-c3ccc(C(=O)[O-])cc3)n2)C1 ZINC000514945854 1040369603 /nfs/dbraw/zinc/36/96/03/1040369603.db2.gz YHLXTSFEEBVAST-FQEVSTJZSA-N -1 1 342.439 4.442 20 0 EIADMM Cc1cc(Br)c([O-])c(NC(=O)[C@H](C)c2ccsc2)c1 ZINC000482643222 1040404585 /nfs/dbraw/zinc/40/45/85/1040404585.db2.gz VCLKGCBDZOLMEF-SECBINFHSA-N -1 1 340.242 4.267 20 0 EIADMM Cc1cc(Cl)ccc1[N-]S(=O)(=O)c1ccc2ncsc2c1 ZINC000479524569 1040422777 /nfs/dbraw/zinc/42/27/77/1040422777.db2.gz HXRWKYDCIRJQAD-UHFFFAOYSA-N -1 1 338.841 4.059 20 0 EIADMM CCOc1cc(C(=O)N2c3ccccc3C[C@H]2C)cc(Cl)c1[O-] ZINC000192795812 1040733495 /nfs/dbraw/zinc/73/34/95/1040733495.db2.gz VNYGHBDFLYBSSX-LLVKDONJSA-N -1 1 331.799 4.036 20 0 EIADMM [O-]c1ccc(-c2noc(C3(c4cccc(Cl)c4)CC3)n2)c(F)c1 ZINC000445457486 1040818019 /nfs/dbraw/zinc/81/80/19/1040818019.db2.gz SRYVXFOONBSRMY-UHFFFAOYSA-N -1 1 330.746 4.315 20 0 EIADMM O=C(Nc1ccc(-c2nncs2)cc1)c1ccc2ccccc2c1[O-] ZINC000539924574 1040906764 /nfs/dbraw/zinc/90/67/64/1040906764.db2.gz HSAHVQUWIMDUSP-UHFFFAOYSA-N -1 1 347.399 4.316 20 0 EIADMM CC(F)(F)c1cccc([N-]S(=O)(=O)c2ccc(Cl)cc2)c1 ZINC000436162587 1040913898 /nfs/dbraw/zinc/91/38/98/1040913898.db2.gz SLSUFMJBFZZUHY-UHFFFAOYSA-N -1 1 331.771 4.253 20 0 EIADMM Cc1cc2cc[nH]c2cc1[N-]S(=O)(=O)c1ccc2c(c1)CCCC2 ZINC000436176679 1040943691 /nfs/dbraw/zinc/94/36/91/1040943691.db2.gz IUJZDBPKKMXVQA-UHFFFAOYSA-N -1 1 340.448 4.156 20 0 EIADMM CCc1cc(=O)[n-]c(SCc2ccc(OC(C)C)c(Cl)c2)n1 ZINC000436212858 1040984951 /nfs/dbraw/zinc/98/49/51/1040984951.db2.gz WSTCCVLMNZIEFG-UHFFFAOYSA-N -1 1 338.860 4.478 20 0 EIADMM O=c1cc(C2CC2)nc(SCc2cc(-c3ccccc3)no2)[n-]1 ZINC000436240359 1040987006 /nfs/dbraw/zinc/98/70/06/1040987006.db2.gz JQDJTLLTJLMLMQ-UHFFFAOYSA-N -1 1 325.393 4.007 20 0 EIADMM CCOCc1cccc([N-]S(=O)(=O)c2ccccc2C(C)(C)C)c1 ZINC000460836256 1040997411 /nfs/dbraw/zinc/99/74/11/1040997411.db2.gz ASQJBFUOUZNHHA-UHFFFAOYSA-N -1 1 347.480 4.321 20 0 EIADMM O=S(=O)([N-]c1ccc(-c2ccc[nH]2)cc1)c1cccc2ncccc21 ZINC000484200355 1041168624 /nfs/dbraw/zinc/16/86/24/1041168624.db2.gz JVINTKDPDNCPGA-UHFFFAOYSA-N -1 1 349.415 4.031 20 0 EIADMM CCC[C@H](C)C[C@H](NCc1ccc(-c2ccc(F)cc2)o1)C(=O)[O-] ZINC000904002850 1041249572 /nfs/dbraw/zinc/24/95/72/1041249572.db2.gz FTHLBEWLNBALKR-GUYCJALGSA-N -1 1 333.403 4.455 20 0 EIADMM Cc1cccc(S(=O)(=O)[N-]c2cc(Cl)ccc2F)c1Cl ZINC000538298701 1041251252 /nfs/dbraw/zinc/25/12/52/1041251252.db2.gz ASPQUXMFYMOJPW-UHFFFAOYSA-N -1 1 334.199 4.242 20 0 EIADMM CCCc1cc(=O)[n-]c(SCc2ncc(-c3ccc(C)cc3)o2)n1 ZINC000463035884 1041257128 /nfs/dbraw/zinc/25/71/28/1041257128.db2.gz QDBOXRDLSWHGRW-UHFFFAOYSA-N -1 1 341.436 4.390 20 0 EIADMM CSCc1cccc([N-]S(=O)(=O)c2cccc(SC)c2)c1 ZINC000554617749 1041282876 /nfs/dbraw/zinc/28/28/76/1041282876.db2.gz ALTIKVYUDMEJPB-UHFFFAOYSA-N -1 1 339.507 4.072 20 0 EIADMM O=C(Nc1c(F)cccc1Oc1ccccc1)c1ccc(O)cc1[O-] ZINC000436486201 1041286355 /nfs/dbraw/zinc/28/63/55/1041286355.db2.gz INDASUOXIQFCTD-UHFFFAOYSA-N -1 1 339.322 4.282 20 0 EIADMM COc1cccc2c1[C@@H](c1nc(-c3ccc([O-])cc3Cl)no1)CC2 ZINC000436522898 1041306314 /nfs/dbraw/zinc/30/63/14/1041306314.db2.gz YCQXNDYDGHPFRP-ZDUSSCGKSA-N -1 1 342.782 4.182 20 0 EIADMM COc1cc(-c2nc(-c3ccc(F)cc3F)no2)cc(Cl)c1[O-] ZINC000436534095 1041316829 /nfs/dbraw/zinc/31/68/29/1041316829.db2.gz JMQCDPUVQIVBRE-UHFFFAOYSA-N -1 1 338.697 4.049 20 0 EIADMM [O-]c1cccc(CNc2ccnn2Cc2ccccc2F)c1Cl ZINC000436518518 1041323642 /nfs/dbraw/zinc/32/36/42/1041323642.db2.gz ZAXGWNFWQDNFAA-UHFFFAOYSA-N -1 1 331.778 4.042 20 0 EIADMM CCCC[C@@H]1CCC[C@@H]1NC(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC000436552236 1041329206 /nfs/dbraw/zinc/32/92/06/1041329206.db2.gz BLYLGJLCNVFVFH-RISCZKNCSA-N -1 1 325.836 4.143 20 0 EIADMM CC[C@@H](C)[C@H](C)N(C(=O)c1cc(Cl)c([O-])c(OC)c1)C1CC1 ZINC000436538549 1041330268 /nfs/dbraw/zinc/33/02/68/1041330268.db2.gz WDQAGCLGTJMULP-MNOVXSKESA-N -1 1 325.836 4.093 20 0 EIADMM O=C(Nc1cccc(-c2cc[nH]n2)c1)c1cc2ccccc2cc1[O-] ZINC000436539432 1041332872 /nfs/dbraw/zinc/33/28/72/1041332872.db2.gz YGVDOQIACYWKNB-UHFFFAOYSA-N -1 1 329.359 4.188 20 0 EIADMM COc1ccc([C@H]2CCN(C(=O)c3cc4ccccc4cc3[O-])C2)cc1 ZINC000436543111 1041338157 /nfs/dbraw/zinc/33/81/57/1041338157.db2.gz JXSJAKCYECYDJC-SFHVURJKSA-N -1 1 347.414 4.184 20 0 EIADMM CCC(=O)c1cccc([N-]S(=O)(=O)c2ccc(C(F)F)cc2)c1 ZINC000554686969 1041338490 /nfs/dbraw/zinc/33/84/90/1041338490.db2.gz HXIKFAITCMTTLV-UHFFFAOYSA-N -1 1 339.363 4.018 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1CC[C@@H](c2cccc(F)c2)C1 ZINC000436568519 1041345736 /nfs/dbraw/zinc/34/57/36/1041345736.db2.gz UEXFIPMBESXQON-QGZVFWFLSA-N -1 1 335.378 4.314 20 0 EIADMM CC(=O)Nc1ccc(C)cc1NC(=O)c1ccc(C(C)C)cc1[O-] ZINC000436568579 1041346152 /nfs/dbraw/zinc/34/61/52/1041346152.db2.gz URZFFWPZLNBYTA-UHFFFAOYSA-N -1 1 326.396 4.035 20 0 EIADMM CC[C@@H]1CCCC[C@@H]1c1noc(-c2cc(NC(C)=O)ccc2[O-])n1 ZINC000436596172 1041354294 /nfs/dbraw/zinc/35/42/94/1041354294.db2.gz PJBRUDKWKSUTTO-OCCSQVGLSA-N -1 1 329.400 4.084 20 0 EIADMM C[C@H]1CN(C)c2ccccc2N(C(=O)c2ccc3ccccc3c2[O-])C1 ZINC000436597299 1041355110 /nfs/dbraw/zinc/35/51/10/1041355110.db2.gz URXWFOKLRQUPFR-HNNXBMFYSA-N -1 1 346.430 4.278 20 0 EIADMM COc1ccc(C(=O)N(CC(C)C)c2ccc(Cl)cc2)c([O-])c1 ZINC000436583176 1041360455 /nfs/dbraw/zinc/36/04/55/1041360455.db2.gz JTWYCIXPBALCGI-UHFFFAOYSA-N -1 1 333.815 4.357 20 0 EIADMM CC(C)Oc1cccc(CN(C)C(=O)c2cc(Cl)ccc2[O-])c1 ZINC000436609371 1041370687 /nfs/dbraw/zinc/37/06/87/1041370687.db2.gz KYJIQESNQHUIFM-UHFFFAOYSA-N -1 1 333.815 4.105 20 0 EIADMM Cc1ccc(C)n1C1CCN(C(=O)c2ccc3ccccc3c2[O-])CC1 ZINC000436628507 1041379205 /nfs/dbraw/zinc/37/92/05/1041379205.db2.gz ZJKZSAHJZUZQFN-UHFFFAOYSA-N -1 1 348.446 4.441 20 0 EIADMM CCCCc1nc2ccc(NC(=O)c3cc(F)c([O-])c(F)c3)cc2[nH]1 ZINC000436638675 1041388130 /nfs/dbraw/zinc/38/81/30/1041388130.db2.gz JVPZMYQDDUQPCS-UHFFFAOYSA-N -1 1 345.349 4.142 20 0 EIADMM Cc1ccc(-c2nc(CSc3nc(C)c(C)c(=O)[n-]3)cs2)o1 ZINC000538517274 1041402493 /nfs/dbraw/zinc/40/24/93/1041402493.db2.gz RCBJGLZSQFXJIY-UHFFFAOYSA-N -1 1 333.438 4.116 20 0 EIADMM COc1ccc(C[C@@H](C)CN(C)C(=O)c2ccc(Cl)cc2[O-])cc1 ZINC000436664708 1041406767 /nfs/dbraw/zinc/40/67/67/1041406767.db2.gz MGLMTFDWRFLTMT-CYBMUJFWSA-N -1 1 347.842 4.005 20 0 EIADMM CN(C(=O)C(=O)c1ccc([O-])cc1)c1ccc(Oc2ccccc2)cc1 ZINC000436689392 1041423146 /nfs/dbraw/zinc/42/31/46/1041423146.db2.gz QYNPRFMCBQOXKA-UHFFFAOYSA-N -1 1 347.370 4.030 20 0 EIADMM CN(C)c1cccc([C@H]2CCCN2C(=O)c2ccc(Cl)cc2[O-])c1 ZINC000436717952 1041441198 /nfs/dbraw/zinc/44/11/98/1041441198.db2.gz JCXRILFDBHCROH-QGZVFWFLSA-N -1 1 344.842 4.089 20 0 EIADMM C[C@H]1CN(C(=O)c2ccc(Cl)cc2[O-])CC[C@@H]1c1ccccc1 ZINC000436718719 1041441259 /nfs/dbraw/zinc/44/12/59/1041441259.db2.gz LIDKMNXSXKEZCR-BBRMVZONSA-N -1 1 329.827 4.311 20 0 EIADMM O=C(c1ccc(C(F)(F)F)cc1[O-])N1Cc2cccc(Cl)c2C1 ZINC000436743480 1041450154 /nfs/dbraw/zinc/45/01/54/1041450154.db2.gz HHOOAQHLQZKBRB-UHFFFAOYSA-N -1 1 341.716 4.220 20 0 EIADMM CCc1cc(=O)[n-]c(S[C@@H](c2ccccc2)c2ccc(F)cc2)n1 ZINC000195058144 1041453314 /nfs/dbraw/zinc/45/33/14/1041453314.db2.gz IVLICIHWWHHKHZ-SFHVURJKSA-N -1 1 340.423 4.353 20 0 EIADMM CN(Cc1c(Cl)cccc1Cl)C(=O)c1cc(F)ccc1[O-] ZINC000436760001 1041457760 /nfs/dbraw/zinc/45/77/60/1041457760.db2.gz KAXULXYWOSELPG-UHFFFAOYSA-N -1 1 328.170 4.110 20 0 EIADMM O=C(c1ccc(C(F)(F)F)cc1[O-])N1CCC[C@@H]1Cc1ccccc1 ZINC000436763914 1041459811 /nfs/dbraw/zinc/45/98/11/1041459811.db2.gz NGWPPSXCUZLWLL-OAHLLOKOSA-N -1 1 349.352 4.258 20 0 EIADMM CN(Cc1cccc(Cl)c1Cl)C(=O)c1cc(F)ccc1[O-] ZINC000436749564 1041461451 /nfs/dbraw/zinc/46/14/51/1041461451.db2.gz ZDJKMCNTBUYHJX-UHFFFAOYSA-N -1 1 328.170 4.110 20 0 EIADMM O=C(c1ccc(C(F)(F)F)cc1[O-])N1CCC[C@@H]1c1cccs1 ZINC000436763757 1041461837 /nfs/dbraw/zinc/46/18/37/1041461837.db2.gz HQSIIWUUCSMTDB-GFCCVEGCSA-N -1 1 341.354 4.450 20 0 EIADMM CCN(CCc1cccs1)C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436750816 1041463286 /nfs/dbraw/zinc/46/32/86/1041463286.db2.gz HIYBVYFIPVVMBT-UHFFFAOYSA-N -1 1 343.370 4.177 20 0 EIADMM C[C@H]1[C@H](c2ccccc2)CCN1C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436751755 1041463434 /nfs/dbraw/zinc/46/34/34/1041463434.db2.gz NQYLHULBDOOYOP-SWLSCSKDSA-N -1 1 349.352 4.429 20 0 EIADMM C[C@@H]1C[C@@H](c2ccccc2)CCN1C(=O)c1ccc(Cl)cc1[O-] ZINC000436751214 1041463703 /nfs/dbraw/zinc/46/37/03/1041463703.db2.gz QRRRBBGRVQTYDD-HIFRSBDPSA-N -1 1 329.827 4.454 20 0 EIADMM O=C(Nc1cc(Cl)ccc1OCC(F)(F)F)c1ccccc1[O-] ZINC000436756357 1041466959 /nfs/dbraw/zinc/46/69/59/1041466959.db2.gz CLVARXFFBDWDST-UHFFFAOYSA-N -1 1 345.704 4.239 20 0 EIADMM CC[C@@]1(C(=O)[O-])CCCN(Cc2cc(Cl)cc(Cl)c2OC)C1 ZINC000904399867 1041467774 /nfs/dbraw/zinc/46/77/74/1041467774.db2.gz BMKYRSGMPGKBLM-MRXNPFEDSA-N -1 1 346.254 4.079 20 0 EIADMM O=C(Nc1cccc(-c2ncco2)c1)c1ccc(C(F)(F)F)cc1[O-] ZINC000436777476 1041471700 /nfs/dbraw/zinc/47/17/00/1041471700.db2.gz NSGVCNCHZGEERK-UHFFFAOYSA-N -1 1 348.280 4.318 20 0 EIADMM O=C(Nc1cc(F)cc(F)c1F)c1ccc(C(F)(F)F)cc1[O-] ZINC000436838514 1041507611 /nfs/dbraw/zinc/50/76/11/1041507611.db2.gz RHLMZNNHJXWNOB-UHFFFAOYSA-N -1 1 335.203 4.081 20 0 EIADMM O=C(c1ccc([O-])cc1F)N1CCC[C@@H]1Cc1ccccc1Cl ZINC000436870111 1041527989 /nfs/dbraw/zinc/52/79/89/1041527989.db2.gz ONOIKKGPHQNIBG-CYBMUJFWSA-N -1 1 333.790 4.032 20 0 EIADMM COc1cccc(C2(c3nc(-c4ccc([O-])cc4Cl)no3)CC2)c1 ZINC000436874292 1041531035 /nfs/dbraw/zinc/53/10/35/1041531035.db2.gz SIQJMOJXSACQFY-UHFFFAOYSA-N -1 1 342.782 4.184 20 0 EIADMM CCc1c(-c2nc(-c3ccc([O-])c(F)c3)no2)cnn1CCC(C)C ZINC000436874833 1041533029 /nfs/dbraw/zinc/53/30/29/1041533029.db2.gz RYFFEAMEVFWQJJ-UHFFFAOYSA-N -1 1 344.390 4.053 20 0 EIADMM COC(C)(C)c1noc(-c2cc(Oc3ccccc3)ccc2[O-])n1 ZINC000436893420 1041534889 /nfs/dbraw/zinc/53/48/89/1041534889.db2.gz ARXDVRBUGMXBOG-UHFFFAOYSA-N -1 1 326.352 4.116 20 0 EIADMM O=C(NCc1ccc(Oc2ccccc2)cc1)c1ccc([O-])cc1F ZINC000436881268 1041537979 /nfs/dbraw/zinc/53/79/79/1041537979.db2.gz RSAOHOXIWFOMSR-UHFFFAOYSA-N -1 1 337.350 4.254 20 0 EIADMM O=C(NCc1ccc(-c2ccncc2)cc1)c1cc(Cl)ccc1[O-] ZINC000436888748 1041543775 /nfs/dbraw/zinc/54/37/75/1041543775.db2.gz ONXSYIQLWSGZNG-UHFFFAOYSA-N -1 1 338.794 4.038 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N1CCC[C@@H]1/C=C/c1ccccc1 ZINC000436902160 1041554589 /nfs/dbraw/zinc/55/45/89/1041554589.db2.gz OTVWXSZRLZVTIZ-XAVKZTDYSA-N -1 1 327.811 4.364 20 0 EIADMM COc1ccc(C(=O)Nc2ccc(CNc3ccccc3)cc2)c([O-])c1 ZINC000436937972 1041567600 /nfs/dbraw/zinc/56/76/00/1041567600.db2.gz RQUFYNYWMMXZPH-UHFFFAOYSA-N -1 1 348.402 4.265 20 0 EIADMM CN(Cc1ccc(F)c(Cl)c1)C(=O)c1cc(Cl)ccc1[O-] ZINC000436948210 1041570419 /nfs/dbraw/zinc/57/04/19/1041570419.db2.gz JGJKCPOBOLHIGU-UHFFFAOYSA-N -1 1 328.170 4.110 20 0 EIADMM O=C(c1ccc([O-])cc1F)N1CC=C(c2cccc3ccccc32)C1 ZINC000436955347 1041574310 /nfs/dbraw/zinc/57/43/10/1041574310.db2.gz DWQBJYBZIOHBOR-UHFFFAOYSA-N -1 1 333.362 4.224 20 0 EIADMM [O-]c1ccc(-c2noc(Cc3cccc(Cl)c3F)n2)c(Cl)c1 ZINC000436956902 1041574558 /nfs/dbraw/zinc/57/45/58/1041574558.db2.gz QCCASSWQYHMBMO-UHFFFAOYSA-N -1 1 339.153 4.479 20 0 EIADMM CCC[C@H]1CCCCN1C(=O)c1cc(Cl)c([O-])c(OCC)c1 ZINC000436972704 1041577693 /nfs/dbraw/zinc/57/76/93/1041577693.db2.gz USPKLGIKNVHTIS-ZDUSSCGKSA-N -1 1 325.836 4.239 20 0 EIADMM O=C(c1cc(F)ccc1[O-])N1CCC(c2ccc(Cl)cc2)CC1 ZINC000436988397 1041582266 /nfs/dbraw/zinc/58/22/66/1041582266.db2.gz OXWSIOQPLUWCJW-UHFFFAOYSA-N -1 1 333.790 4.205 20 0 EIADMM COc1cccc2c1CCCN2C(=O)c1ccc2ccccc2c1[O-] ZINC000436992860 1041583443 /nfs/dbraw/zinc/58/34/43/1041583443.db2.gz XCOWTRVUTPGKSO-UHFFFAOYSA-N -1 1 333.387 4.147 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1cc(-c2cccc(F)c2)no1 ZINC000540960167 1041753052 /nfs/dbraw/zinc/75/30/52/1041753052.db2.gz GYFXQKCXPBEOKH-UHFFFAOYSA-N -1 1 332.718 4.092 20 0 EIADMM CSc1ccc(S(=O)(=O)[N-]c2cccc(F)c2C)cc1Cl ZINC000463797398 1041755514 /nfs/dbraw/zinc/75/55/14/1041755514.db2.gz PORILSJPIUFNCL-UHFFFAOYSA-N -1 1 345.848 4.310 20 0 EIADMM Cc1ccc(F)cc1S(=O)(=O)[N-]c1ccc(C(=O)C(C)(C)C)cc1 ZINC000425942624 1042021449 /nfs/dbraw/zinc/02/14/49/1042021449.db2.gz NOWBSJXGZPVKEN-UHFFFAOYSA-N -1 1 349.427 4.164 20 0 EIADMM CCc1cc(C(=O)Nc2c([O-])cccc2F)c2c(n1)onc2C(C)C ZINC000669908797 1042052208 /nfs/dbraw/zinc/05/22/08/1042052208.db2.gz LARBJZCZZBWJQL-UHFFFAOYSA-N -1 1 343.358 4.006 20 0 EIADMM O=C(C[C@@H]1CC[C@H]2C[C@H]21)Nc1c([O-])cc(Br)cc1Cl ZINC000517744062 1042164905 /nfs/dbraw/zinc/16/49/05/1042164905.db2.gz KDKRHBAZIMRGQA-OYNCUSHFSA-N -1 1 344.636 4.183 20 0 EIADMM Cc1ccccc1S(=O)(=O)[N-]c1ccc(C(F)(F)F)c(C)c1 ZINC000438777084 1042345309 /nfs/dbraw/zinc/34/53/09/1042345309.db2.gz UXNBAKACSYCFPD-UHFFFAOYSA-N -1 1 329.343 4.123 20 0 EIADMM Cc1c(F)cccc1S(=O)(=O)[N-]c1ccc(OC2CCCC2)cc1 ZINC000438803998 1042351192 /nfs/dbraw/zinc/35/11/92/1042351192.db2.gz HSRIJINCFWKTME-UHFFFAOYSA-N -1 1 349.427 4.256 20 0 EIADMM O=S(=O)([N-]c1ccccc1-c1cn[nH]c1)c1ccc2ccccc2c1 ZINC000438814145 1042353733 /nfs/dbraw/zinc/35/37/33/1042353733.db2.gz VQJPICWQRONKLB-UHFFFAOYSA-N -1 1 349.415 4.031 20 0 EIADMM C[C@@H](C(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)c1cccc(Cl)c1 ZINC000439065014 1042489449 /nfs/dbraw/zinc/48/94/49/1042489449.db2.gz AJRLHRXPKOTOOB-LLVKDONJSA-N -1 1 341.798 4.178 20 0 EIADMM C[C@H](CC(=O)Nc1ccc([O-])c(Cl)c1)C(=O)c1cccc(F)c1 ZINC000174416400 1042684790 /nfs/dbraw/zinc/68/47/90/1042684790.db2.gz VPCWLZGHVMPOHD-SNVBAGLBSA-N -1 1 335.762 4.032 20 0 EIADMM CSc1ccc([O-])c(-c2nc(Cc3csc(C(C)C)n3)no2)c1 ZINC000664772071 1042799436 /nfs/dbraw/zinc/79/94/36/1042799436.db2.gz KIPDWTULIHJDBJ-UHFFFAOYSA-N -1 1 347.465 4.335 20 0 EIADMM COc1cc(C(=O)N2CC[C@H](C(C)(C)C)C[C@@H]2C)cc(Cl)c1[O-] ZINC000493179466 1042837552 /nfs/dbraw/zinc/83/75/52/1042837552.db2.gz HQFKTWKADIEOHH-AAEUAGOBSA-N -1 1 339.863 4.341 20 0 EIADMM O=C([O-])c1cccc(CNCc2ccccc2OCc2ccccc2)c1 ZINC000311798429 1042866081 /nfs/dbraw/zinc/86/60/81/1042866081.db2.gz NCESFWGMXXRWMF-UHFFFAOYSA-N -1 1 347.414 4.254 20 0 EIADMM CC(C)c1cccc(S(=O)(=O)[N-]c2ccccc2-c2cn[nH]c2)c1 ZINC000542468368 1042922450 /nfs/dbraw/zinc/92/24/50/1042922450.db2.gz RVZMSYABMZFGPY-UHFFFAOYSA-N -1 1 341.436 4.001 20 0 EIADMM Cc1cscc1C(=O)Nc1cc(C)cc(Br)c1[O-] ZINC000182931378 1043035079 /nfs/dbraw/zinc/03/50/79/1043035079.db2.gz MPYBEOTZTNNAQF-UHFFFAOYSA-N -1 1 326.215 4.085 20 0 EIADMM Cc1ccc(C(=O)Nc2cc(C)cc(Br)c2[O-])s1 ZINC000182933297 1043035721 /nfs/dbraw/zinc/03/57/21/1043035721.db2.gz KFZRKOMCOBNFSZ-UHFFFAOYSA-N -1 1 326.215 4.085 20 0 EIADMM [O-]c1ccc(-c2noc([C@@H]3CC[C@H](Cc4ccccc4)O3)n2)cc1F ZINC000866976292 1043048902 /nfs/dbraw/zinc/04/89/02/1043048902.db2.gz RILQUSPOPGVATF-PBHICJAKSA-N -1 1 340.354 4.044 20 0 EIADMM CCS(=O)(=O)[N-]c1cc(-c2ccccc2C(F)F)ccc1OC ZINC000665189644 1043066754 /nfs/dbraw/zinc/06/67/54/1043066754.db2.gz PAYZEEFHCUEFOM-UHFFFAOYSA-N -1 1 341.379 4.061 20 0 EIADMM COc1cc(Nc2cc(F)c([O-])c(Cl)c2)c(C(C)=O)cc1OC ZINC001214486514 1043092150 /nfs/dbraw/zinc/09/21/50/1043092150.db2.gz LCFWVXXGOAYORC-UHFFFAOYSA-N -1 1 339.750 4.148 20 0 EIADMM O=C(Nc1ccccc1OC(F)F)c1cc2ccccc2cc1[O-] ZINC000218314340 1043116114 /nfs/dbraw/zinc/11/61/14/1043116114.db2.gz OJXBSHAYNAIDRO-UHFFFAOYSA-N -1 1 329.302 4.399 20 0 EIADMM CSc1ccc(S(=O)(=O)[N-]c2c(C)cccc2SC)cc1 ZINC000185337239 1043174494 /nfs/dbraw/zinc/17/44/94/1043174494.db2.gz QVBIRLRBJKNIJW-UHFFFAOYSA-N -1 1 339.507 4.240 20 0 EIADMM Cc1cccc(-c2cnc(NC(=O)c3ccc([O-])c(F)c3)s2)c1 ZINC000672512347 1043261144 /nfs/dbraw/zinc/26/11/44/1043261144.db2.gz VIELHVOWPOODRD-UHFFFAOYSA-N -1 1 328.368 4.216 20 0 EIADMM CO[C@H](C)c1cccc([N-]S(=O)(=O)c2ccc3ccccc3c2)c1 ZINC000171013713 1043390346 /nfs/dbraw/zinc/39/03/46/1043390346.db2.gz QIZCBHZHCRECNQ-CQSZACIVSA-N -1 1 341.432 4.348 20 0 EIADMM COc1ccc(-c2ccc(-c3noc(-c4ncccc4[O-])n3)cc2)cc1 ZINC001212480824 1043437587 /nfs/dbraw/zinc/43/75/87/1043437587.db2.gz KUPSECNWDKUDFX-UHFFFAOYSA-N -1 1 345.358 4.180 20 0 EIADMM Cc1ccc(C(=O)COC(=O)c2ccc(Cl)c(Cl)c2[O-])s1 ZINC000730359733 1043502704 /nfs/dbraw/zinc/50/27/04/1043502704.db2.gz NFKRXIMOUVXCKB-UHFFFAOYSA-N -1 1 345.203 4.109 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)Nc1ccccc1Br ZINC000190905771 1043747623 /nfs/dbraw/zinc/74/76/23/1043747623.db2.gz UZWGHQDJNAQOND-UHFFFAOYSA-N -1 1 341.592 4.452 20 0 EIADMM O=C(NCC1(Sc2ccccc2)CC1)c1c([O-])cccc1Cl ZINC000731836799 1043836333 /nfs/dbraw/zinc/83/63/33/1043836333.db2.gz FPZVHKSESXKZOX-UHFFFAOYSA-N -1 1 333.840 4.100 20 0 EIADMM COc1cc(C(=O)N2CCC[C@@H](C(C)(C)C)CC2)cc(Cl)c1[O-] ZINC000442964609 1043928281 /nfs/dbraw/zinc/92/82/81/1043928281.db2.gz KTTUVVCZXMDPBJ-CYBMUJFWSA-N -1 1 339.863 4.343 20 0 EIADMM CC(C)C(=O)c1ccc([C@H](C)C(=O)Nc2c([O-])cccc2F)cc1 ZINC000670083926 1043961028 /nfs/dbraw/zinc/96/10/28/1043961028.db2.gz JXHJDDWBSVTPOT-LBPRGKRZSA-N -1 1 329.371 4.112 20 0 EIADMM CCCCC[C@@H]1CCCN1C(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC000443043024 1043980130 /nfs/dbraw/zinc/98/01/30/1043980130.db2.gz DITSXMQLUWYVDS-CYBMUJFWSA-N -1 1 325.836 4.239 20 0 EIADMM O=C(Nc1ccc(SC(F)(F)F)cc1)c1cc(F)ccc1[O-] ZINC001625934191 1044009618 /nfs/dbraw/zinc/00/96/18/1044009618.db2.gz JFOTXSKQRZQJIJ-UHFFFAOYSA-N -1 1 331.290 4.396 20 0 EIADMM COc1cc(C(=O)N(C)c2ccc(F)c(Cl)c2)cc(Cl)c1[O-] ZINC000443107246 1044020560 /nfs/dbraw/zinc/02/05/60/1044020560.db2.gz GJBSCFGRTFNRHF-UHFFFAOYSA-N -1 1 344.169 4.123 20 0 EIADMM CCOc1cc(C(=O)N[C@@H]2CCC[C@H](C)CC2)cc(Cl)c1[O-] ZINC000443385438 1044249742 /nfs/dbraw/zinc/24/97/42/1044249742.db2.gz PGUYFIOTQONGPH-WCQYABFASA-N -1 1 325.836 4.143 20 0 EIADMM COc1ccc(C(=O)Nc2ccc(F)cc2[O-])cc1OC1CCCC1 ZINC000543312343 1044327317 /nfs/dbraw/zinc/32/73/17/1044327317.db2.gz BDULWUAQPRHICM-UHFFFAOYSA-N -1 1 345.370 4.114 20 0 EIADMM O=C([O-])CCC1CCN(Cc2ccc(OC(F)F)c(Cl)c2)CC1 ZINC000665342647 1044388749 /nfs/dbraw/zinc/38/87/49/1044388749.db2.gz IZYBTAYLALDGSX-UHFFFAOYSA-N -1 1 347.789 4.018 20 0 EIADMM Cc1nc(-c2ccc(N[C@@H]3CC[C@@H](C)[C@H](C)C3)nc2)[n-]c(=O)c1C ZINC000543450983 1044621273 /nfs/dbraw/zinc/62/12/73/1044621273.db2.gz AFTFCSDRKVUQSQ-XHBSWPGZSA-N -1 1 326.444 4.098 20 0 EIADMM O=C([N-]c1nc(C2CC2)no1)c1ccc(-c2ccccc2Cl)o1 ZINC000734879877 1044714092 /nfs/dbraw/zinc/71/40/92/1044714092.db2.gz AWVGQVOJZKMATQ-UHFFFAOYSA-N -1 1 329.743 4.113 20 0 EIADMM CSCc1ccc([N-]S(=O)(=O)c2cccc(SC)c2)cc1 ZINC000509076375 1045073282 /nfs/dbraw/zinc/07/32/82/1045073282.db2.gz VWZGPPSKLWCNQM-UHFFFAOYSA-N -1 1 339.507 4.072 20 0 EIADMM C[C@@H](c1noc(-c2ccc(NC(=O)OC(C)(C)C)cc2[O-])n1)C1CC1 ZINC000495438085 1045116704 /nfs/dbraw/zinc/11/67/04/1045116704.db2.gz LBXHYIGZGZHENY-SNVBAGLBSA-N -1 1 345.399 4.303 20 0 EIADMM CSc1cccc(S(=O)(=O)[N-]c2ccc(Cl)cc2C)c1 ZINC000509103350 1045132835 /nfs/dbraw/zinc/13/28/35/1045132835.db2.gz OJOWSNALLYBQPI-UHFFFAOYSA-N -1 1 327.858 4.171 20 0 EIADMM Cc1nnc(-c2ccc(NC(=O)c3ccc(C(C)C)cc3[O-])cc2)o1 ZINC000740747188 1045212026 /nfs/dbraw/zinc/21/20/26/1045212026.db2.gz PLEBXFMDQNJXHG-UHFFFAOYSA-N -1 1 337.379 4.126 20 0 EIADMM O=C([N-]c1cnoc1)c1cnc(-c2ccc(C(F)(F)F)cc2)s1 ZINC000673720252 1045231394 /nfs/dbraw/zinc/23/13/94/1045231394.db2.gz LZOCUENKDSYTIX-UHFFFAOYSA-N -1 1 339.298 4.069 20 0 EIADMM O=c1nc(-c2ccc[nH]2)[n-]c2cc(-c3cccc(Cl)c3)sc21 ZINC000762441344 1045242458 /nfs/dbraw/zinc/24/24/58/1045242458.db2.gz KXQJJYXOWUSGMF-UHFFFAOYSA-N -1 1 327.796 4.300 20 0 EIADMM C[C@H]1CC[C@H](NC(=O)c2ccc(NC(=O)OC(C)(C)C)cc2[O-])CC1 ZINC000740926615 1045245261 /nfs/dbraw/zinc/24/52/61/1045245261.db2.gz PNDSXQGERVIELS-JOCQHMNTSA-N -1 1 348.443 4.048 20 0 EIADMM CC(C)(C)c1ccc(S(=O)(=O)[N-]c2ccc3ncsc3c2)cc1 ZINC000008675751 1045326795 /nfs/dbraw/zinc/32/67/95/1045326795.db2.gz KWZBDDNSICMZMO-UHFFFAOYSA-N -1 1 346.477 4.395 20 0 EIADMM C[C@H](C(=O)[N-]OCc1ccc(C(F)(F)F)cc1)c1cccc(F)c1 ZINC000746920982 1045527855 /nfs/dbraw/zinc/52/78/55/1045527855.db2.gz DJSINSBLXSXJTC-NSHDSACASA-N -1 1 341.304 4.196 20 0 EIADMM Cc1nc(C(C)C)[n-]c(=O)c1C(=O)N(CCC(C)C)CCC(C)C ZINC000791124489 1045692145 /nfs/dbraw/zinc/69/21/45/1045692145.db2.gz YEFLAQWAUCJBSE-UHFFFAOYSA-N -1 1 335.492 4.148 20 0 EIADMM CN(Cc1ccc(Cl)c(F)c1)C(=O)c1c([O-])cccc1Cl ZINC000763224081 1045784307 /nfs/dbraw/zinc/78/43/07/1045784307.db2.gz SJTRPQFBOLPNMK-UHFFFAOYSA-N -1 1 328.170 4.110 20 0 EIADMM N#C[C@H](c1ccccc1)c1ccc([N-]S(=O)(=O)c2ccccc2)cc1 ZINC000032631262 1045809136 /nfs/dbraw/zinc/80/91/36/1045809136.db2.gz ZDNLWCLJLZUDQR-HXUWFJFHSA-N -1 1 348.427 4.143 20 0 EIADMM O=C(Nc1ccc(-c2cc[nH]n2)cc1)c1ccc2ccccc2c1[O-] ZINC000326523623 1045822035 /nfs/dbraw/zinc/82/20/35/1045822035.db2.gz VDWJJTIUVVFPDB-UHFFFAOYSA-N -1 1 329.359 4.188 20 0 EIADMM CCCOc1ccc([N-]S(=O)(=O)c2cc(F)ccc2C)c(C)c1 ZINC000614883730 1045904473 /nfs/dbraw/zinc/90/44/73/1045904473.db2.gz VSQXXMVZYQMHJX-UHFFFAOYSA-N -1 1 337.416 4.032 20 0 EIADMM O=C([O-])CC[C@H](NCc1ccoc1)c1ccc(Cl)c(Cl)c1 ZINC000841796750 1045917171 /nfs/dbraw/zinc/91/71/71/1045917171.db2.gz USBPBYCZZRUYLH-AWEZNQCLSA-N -1 1 328.195 4.282 20 0 EIADMM C[C@H](SCCC[N-]C(=O)C(F)(F)F)c1ccc(Cl)cc1 ZINC000769351085 1045935050 /nfs/dbraw/zinc/93/50/50/1045935050.db2.gz BUFTZIVQRNLRBJ-VIFPVBQESA-N -1 1 325.783 4.203 20 0 EIADMM C[C@@H]1CCCC[C@@]1(C)[N-]S(=O)(=O)c1cc(Cl)sc1Cl ZINC001212077128 1046058813 /nfs/dbraw/zinc/05/88/13/1046058813.db2.gz GUZRYMOVVUQBLU-PRHODGIISA-N -1 1 342.313 4.302 20 0 EIADMM O=C(N[C@@H](c1nccs1)c1ccccc1)c1c([O-])cccc1Cl ZINC000769765521 1046060691 /nfs/dbraw/zinc/06/06/91/1046060691.db2.gz MGGZVDPKZIQVPQ-OAHLLOKOSA-N -1 1 344.823 4.022 20 0 EIADMM [O-]c1cccc(CN2CCC(C(F)(F)F)(C(F)(F)F)C2)c1Cl ZINC000508674350 1046070727 /nfs/dbraw/zinc/07/07/27/1046070727.db2.gz ZBZHZLDFQSQATG-UHFFFAOYSA-N -1 1 347.686 4.362 20 0 EIADMM CC(=O)Nc1c(C)ccc(NC(=O)c2ccc3ccccc3c2[O-])c1C ZINC000615076177 1046128640 /nfs/dbraw/zinc/12/86/40/1046128640.db2.gz ITYLBJBVFHZVFX-UHFFFAOYSA-N -1 1 348.402 4.373 20 0 EIADMM O=S(=O)(/C=C\c1ccc(Cl)cc1)[N-]c1ccc2ccccc2n1 ZINC000729811466 1046178884 /nfs/dbraw/zinc/17/88/84/1046178884.db2.gz KGHLWEYOTANMRH-QXMHVHEDSA-N -1 1 344.823 4.301 20 0 EIADMM Cc1cccc(-c2n[n-]c(=S)n2Cc2nc(C3CCCC3)no2)c1 ZINC000171794299 1046255867 /nfs/dbraw/zinc/25/58/67/1046255867.db2.gz FNQDCUCGFUWOPI-UHFFFAOYSA-N -1 1 341.440 4.005 20 0 EIADMM COc1cc(C(=O)Nc2ccc3sc(C)nc3c2)cc(Cl)c1[O-] ZINC000785628324 1046731525 /nfs/dbraw/zinc/73/15/25/1046731525.db2.gz LRLSKQWTOFUILE-UHFFFAOYSA-N -1 1 348.811 4.225 20 0 EIADMM CC(C)Oc1ccc([N-]S(=O)(=O)c2ccc(Cl)s2)c(F)c1 ZINC000127951948 1046740296 /nfs/dbraw/zinc/74/02/96/1046740296.db2.gz LPUKZZISVCRTBL-UHFFFAOYSA-N -1 1 349.836 4.129 20 0 EIADMM CC(C)O[C@@H](C(=O)Nc1cc(F)c([O-])cc1Cl)c1ccccc1 ZINC001157900383 1046829123 /nfs/dbraw/zinc/82/91/23/1046829123.db2.gz YCPVPVKMUIGJHE-MRXNPFEDSA-N -1 1 337.778 4.290 20 0 EIADMM Cc1cnc(C(=O)N2CCC[C@@H]2c2cccc3ccccc32)c([O-])c1 ZINC000460186620 1047147358 /nfs/dbraw/zinc/14/73/58/1047147358.db2.gz GJHUWRBYXUNQAQ-GOSISDBHSA-N -1 1 332.403 4.226 20 0 EIADMM COc1cc([N-]S(=O)(=O)c2cccc(C(F)F)c2)ccc1Cl ZINC000788488454 1047201219 /nfs/dbraw/zinc/20/12/19/1047201219.db2.gz JIMYWSSPJMCUPH-UHFFFAOYSA-N -1 1 347.770 4.087 20 0 EIADMM O=C(N[C@H](c1ccccc1)C1CCCCC1)C(=O)c1ccc([O-])cc1 ZINC000806457881 1047266397 /nfs/dbraw/zinc/26/63/97/1047266397.db2.gz BVHPHQDCCRGMPK-LJQANCHMSA-N -1 1 337.419 4.013 20 0 EIADMM O=S(=O)([N-]c1csc2ccccc12)C1=Cc2ccccc2OC1 ZINC000788747846 1047302261 /nfs/dbraw/zinc/30/22/61/1047302261.db2.gz CEFRBHQOJJIYJF-UHFFFAOYSA-N -1 1 343.429 4.077 20 0 EIADMM CCc1c(C(=O)Nc2ccc([O-])c(Cl)c2)cnn1C1CCCC1 ZINC000476331368 1047465002 /nfs/dbraw/zinc/46/50/02/1047465002.db2.gz MDYUJJBZKJHUIJ-UHFFFAOYSA-N -1 1 333.819 4.172 20 0 EIADMM Cc1nc(-c2cccc(C(=O)Nc3nc(Cl)ccc3[O-])c2)cs1 ZINC000789930485 1047485849 /nfs/dbraw/zinc/48/58/49/1047485849.db2.gz RHWFHZAUXJKTMB-UHFFFAOYSA-N -1 1 345.811 4.125 20 0 EIADMM Cc1nc(C2CCCC2)sc1C(=O)Nc1nc(Cl)ccc1[O-] ZINC000789929766 1047486280 /nfs/dbraw/zinc/48/62/80/1047486280.db2.gz FOSCIDCHZZMELX-UHFFFAOYSA-N -1 1 337.832 4.115 20 0 EIADMM C[C@@H]1CCCN(Cc2cc(Cl)cc(C(F)(F)F)c2)[C@H]1C(=O)[O-] ZINC000424424869 1047767646 /nfs/dbraw/zinc/76/76/46/1047767646.db2.gz XPGICPBUMHDFCJ-NOZJJQNGSA-N -1 1 335.753 4.044 20 0 EIADMM CSc1ccc([N-]S(=O)(=O)c2cccc(F)c2)cc1Cl ZINC000476406969 1047795639 /nfs/dbraw/zinc/79/56/39/1047795639.db2.gz OXYNGKTVSLSEFY-UHFFFAOYSA-N -1 1 331.821 4.002 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cc(F)c(F)c(F)c3)n2)c(Cl)c1 ZINC000445444940 1047816050 /nfs/dbraw/zinc/81/60/50/1047816050.db2.gz HYLHXHYFBNUCEW-UHFFFAOYSA-N -1 1 326.661 4.180 20 0 EIADMM O=C(N[C@@H]1CCC[C@H]1Cc1ccccc1)c1c([O-])cccc1Cl ZINC001136901138 1047889020 /nfs/dbraw/zinc/88/90/20/1047889020.db2.gz DPTQMMYOEDNUHV-GOEBONIOSA-N -1 1 329.827 4.187 20 0 EIADMM Cc1ccc(CN(C(=O)c2ccc(Cl)cc2[O-])C2CC2)cc1C ZINC001136923906 1047902412 /nfs/dbraw/zinc/90/24/12/1047902412.db2.gz IYIMJGCLADMOFJ-UHFFFAOYSA-N -1 1 329.827 4.467 20 0 EIADMM Cc1ccc(N2CCCC2)c(-c2nc(-c3ccc([O-])cc3F)no2)c1 ZINC000809469048 1048362240 /nfs/dbraw/zinc/36/22/40/1048362240.db2.gz GBZOKBOEMHXLKU-UHFFFAOYSA-N -1 1 339.370 4.157 20 0 EIADMM Cc1ccc(Cl)cc1S(=O)(=O)[N-]c1ccc2scnc2c1 ZINC000499236783 1048466773 /nfs/dbraw/zinc/46/67/73/1048466773.db2.gz ZCYVODRMAZQBAF-UHFFFAOYSA-N -1 1 338.841 4.059 20 0 EIADMM Cc1nc(-c2cccc(-c3nc4ccc(C)cc4c(=O)[n-]3)c2)cs1 ZINC000074797511 1048568939 /nfs/dbraw/zinc/56/89/39/1048568939.db2.gz GYHQXKWIVOWBKT-UHFFFAOYSA-N -1 1 333.416 4.330 20 0 EIADMM CCc1sc(C(=O)Nc2c([O-])cccc2F)cc1Br ZINC000815877389 1048621252 /nfs/dbraw/zinc/62/12/52/1048621252.db2.gz OMPQBGOLVNYZND-UHFFFAOYSA-N -1 1 344.205 4.170 20 0 EIADMM CC(C)c1ccsc1C(=O)OCc1cc(=O)oc2cc([O-])ccc12 ZINC000920552551 1048707458 /nfs/dbraw/zinc/70/74/58/1048707458.db2.gz ALODVCUZOVLALT-UHFFFAOYSA-N -1 1 344.388 4.041 20 0 EIADMM CCC[C@@H](C(=O)c1ccccc1)N(C)Cc1c(F)cc([O-])cc1F ZINC001144562089 1048730089 /nfs/dbraw/zinc/73/00/89/1048730089.db2.gz YFDMKJVVKSNVJO-SFHVURJKSA-N -1 1 333.378 4.154 20 0 EIADMM Cc1sc2[n-]c(-c3ncc(C)cn3)nc(=O)c2c1-c1ccc(C)cc1 ZINC000133649927 1048754990 /nfs/dbraw/zinc/75/49/90/1048754990.db2.gz GPFPCXWANSTIGB-UHFFFAOYSA-N -1 1 348.431 4.034 20 0 EIADMM COc1ccc([C@H]2CCCN2Cc2cc(F)c([O-])cc2F)cc1OC ZINC001144667143 1048783694 /nfs/dbraw/zinc/78/36/94/1048783694.db2.gz UPTJVULELJDSPS-MRXNPFEDSA-N -1 1 349.377 4.025 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N1CCCC[C@@H]1Cc1ccc(F)cc1 ZINC001144672113 1048788978 /nfs/dbraw/zinc/78/89/78/1048788978.db2.gz CGDBEFZLWYUSRK-MRXNPFEDSA-N -1 1 347.817 4.422 20 0 EIADMM O=C([O-])c1ccoc1CN1CCC[C@@H]1c1ccccc1C(F)(F)F ZINC000846243850 1048846787 /nfs/dbraw/zinc/84/67/87/1048846787.db2.gz JBIBTHAVNHZIOT-CQSZACIVSA-N -1 1 339.313 4.334 20 0 EIADMM O=C(N[C@@H]1CC[C@@H]2CCCC[C@@H]2C1)c1c([O-])cnc2c(F)cccc21 ZINC001135794393 1048887541 /nfs/dbraw/zinc/88/75/41/1048887541.db2.gz KAJNRMMEVFXELL-BFHYXJOUSA-N -1 1 342.414 4.168 20 0 EIADMM O=C(Nc1c([O-])cccc1F)c1ccc(Oc2cccc(F)c2)cn1 ZINC001146491977 1049031702 /nfs/dbraw/zinc/03/17/02/1049031702.db2.gz HUSGLLVWQVVVHO-UHFFFAOYSA-N -1 1 342.301 4.110 20 0 EIADMM Cc1ccc(SCC(F)(F)F)c(NC(=O)c2ccc([O-])cn2)c1 ZINC001146588795 1049035436 /nfs/dbraw/zinc/03/54/36/1049035436.db2.gz QLBPZMROMHKQFK-UHFFFAOYSA-N -1 1 342.342 4.002 20 0 EIADMM COc1ccc(NC(=O)c2cc(F)ccc2[O-])cc1OC1CCCC1 ZINC001136120971 1049095858 /nfs/dbraw/zinc/09/58/58/1049095858.db2.gz JNQGDOSWCMUTGO-UHFFFAOYSA-N -1 1 345.370 4.114 20 0 EIADMM O=C(CSCc1ccc(F)cc1)Nc1ccc([O-])c(Cl)c1 ZINC000609551100 1049165045 /nfs/dbraw/zinc/16/50/45/1049165045.db2.gz JLUXWQLVXPQEPW-UHFFFAOYSA-N -1 1 325.792 4.057 20 0 EIADMM O=C(N[C@H](c1ccccc1)C1CC1)c1cc(Br)ccc1[O-] ZINC001136149688 1049177791 /nfs/dbraw/zinc/17/77/91/1049177791.db2.gz VDSLOHQCERCOJJ-MRXNPFEDSA-N -1 1 346.224 4.036 20 0 EIADMM O=C(Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)[C@@H]1CCC[C@H]2CCCC[C@@H]21 ZINC001136190950 1049268892 /nfs/dbraw/zinc/26/88/92/1049268892.db2.gz UMGWVPYWNCWPOM-XOKHGSTOSA-N -1 1 339.439 4.327 20 0 EIADMM Cc1ccc2c(CC(=O)Nc3ccc(-c4cc(=O)[nH][n-]4)cc3)coc2c1 ZINC001136190962 1049268972 /nfs/dbraw/zinc/26/89/72/1049268972.db2.gz UYIUNZRLFKSJIA-UHFFFAOYSA-N -1 1 347.374 4.018 20 0 EIADMM Cn1cc(Cl)cc1C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC001148252934 1049290250 /nfs/dbraw/zinc/29/02/50/1049290250.db2.gz NRLXNOGEOZFIQO-UHFFFAOYSA-N -1 1 335.190 4.443 20 0 EIADMM CC(C)(CNC(=O)c1ccc(C(F)(F)F)cc1[O-])CC(F)(F)F ZINC001148806328 1049382123 /nfs/dbraw/zinc/38/21/23/1049382123.db2.gz QGODHAHEKBRJOF-UHFFFAOYSA-N -1 1 343.267 4.119 20 0 EIADMM O=C(Nc1ccccc1-c1cnco1)c1ccc(C(F)(F)F)cc1[O-] ZINC001148801133 1049382733 /nfs/dbraw/zinc/38/27/33/1049382733.db2.gz UAPRDWLGYOGGES-UHFFFAOYSA-N -1 1 348.280 4.318 20 0 EIADMM O=C(Nc1ccc2ncncc2c1)c1cccc(-c2ccccc2)c1[O-] ZINC001148869287 1049392032 /nfs/dbraw/zinc/39/20/32/1049392032.db2.gz HEFFNFKTJMUVLX-UHFFFAOYSA-N -1 1 341.370 4.255 20 0 EIADMM CC(C)n1ccc(NC(=O)c2cccc(-c3ccccc3)c2[O-])cc1=O ZINC001148872637 1049394085 /nfs/dbraw/zinc/39/40/85/1049394085.db2.gz LMWMEDDYOCLXFV-UHFFFAOYSA-N -1 1 348.402 4.054 20 0 EIADMM CC(C)c1ccc(C(=O)Nc2ccc(N=S(C)(C)=O)cc2)c([O-])c1 ZINC000820373694 1049497654 /nfs/dbraw/zinc/49/76/54/1049497654.db2.gz OTHOPNISWJOBAG-UHFFFAOYSA-N -1 1 346.452 4.127 20 0 EIADMM CCCN(C(=O)c1cc(Cl)ccc1[O-])[C@@H]1CCc2ccccc2C1 ZINC001136387947 1049563375 /nfs/dbraw/zinc/56/33/75/1049563375.db2.gz CPVGPPLYMOTCGP-QGZVFWFLSA-N -1 1 343.854 4.455 20 0 EIADMM COC(=O)Cc1ccc(Nc2cc(Cl)cc(Cl)c2[O-])cc1 ZINC001212620064 1049658710 /nfs/dbraw/zinc/65/87/10/1049658710.db2.gz BUEKJYYKCOVVJM-UHFFFAOYSA-N -1 1 326.179 4.158 20 0 EIADMM O=C(NCCc1c[nH]c2cc(Cl)ccc12)c1cc(Cl)ccc1[O-] ZINC001136476580 1049669774 /nfs/dbraw/zinc/66/97/74/1049669774.db2.gz AEPUPNJRTTVPKZ-UHFFFAOYSA-N -1 1 349.217 4.153 20 0 EIADMM COC(=O)Cc1ccc(Nc2c(Cl)ccc([O-])c2Cl)cc1 ZINC001212620684 1049720586 /nfs/dbraw/zinc/72/05/86/1049720586.db2.gz CSZRNAJQPPZLAK-UHFFFAOYSA-N -1 1 326.179 4.158 20 0 EIADMM COc1cc(Cl)ccc1NC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000753028858 1049788381 /nfs/dbraw/zinc/78/83/81/1049788381.db2.gz YVOZJWNTIZRUAW-UHFFFAOYSA-N -1 1 327.167 4.352 20 0 EIADMM N#CC(=C([O-])c1ccc(N2CCCCC2)cc1)c1nc2ccccc2o1 ZINC000179916173 1049800724 /nfs/dbraw/zinc/80/07/24/1049800724.db2.gz ZHNMOBKAILHOBO-KRWDZBQOSA-N -1 1 345.402 4.308 20 0 EIADMM O=C(NCC1(c2cccc(Cl)c2)CCC1)c1ccc([O-])c(F)c1 ZINC001171824106 1049802560 /nfs/dbraw/zinc/80/25/60/1049802560.db2.gz SKROHZNTRUCCFD-UHFFFAOYSA-N -1 1 333.790 4.036 20 0 EIADMM Cc1[nH]nc(C(=O)Nc2cccc(Oc3ccc(C)cc3C)c2)c1[O-] ZINC001171949776 1049820426 /nfs/dbraw/zinc/82/04/26/1049820426.db2.gz JUGMBZPHTJAGLH-UHFFFAOYSA-N -1 1 337.379 4.085 20 0 EIADMM Cc1cccc2c1CCCN2C(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC001136758942 1049867259 /nfs/dbraw/zinc/86/72/59/1049867259.db2.gz PCXCHVMOKASHPL-UHFFFAOYSA-N -1 1 335.325 4.312 20 0 EIADMM CCCc1cc(=O)[n-]c(SCc2nc(-c3cccs3)oc2C)n1 ZINC000010503377 1049883554 /nfs/dbraw/zinc/88/35/54/1049883554.db2.gz DOALNHZZZDHVNS-UHFFFAOYSA-N -1 1 347.465 4.452 20 0 EIADMM Cc1nc([C@@H](C)[N@H+]2CC[C@](C)(C(=O)[O-])C2)oc1-c1ccc(Cl)cc1 ZINC000263571523 1049995522 /nfs/dbraw/zinc/99/55/22/1049995522.db2.gz JMOUNCCPEQSCDO-XIKOKIGWSA-N -1 1 348.830 4.161 20 0 EIADMM CCOc1cc(C(=O)N2C[C@H](C)[C@@H]3CCCC[C@H]32)cc(Cl)c1[O-] ZINC000248390805 1050052299 /nfs/dbraw/zinc/05/22/99/1050052299.db2.gz CJHFJYMHGNULKA-CORIIIEPSA-N -1 1 337.847 4.095 20 0 EIADMM Cc1nc([C@H](C)[N@H+]2CCC[C@@H](C(=O)[O-])C2)oc1-c1ccc(Cl)cc1 ZINC000263582060 1050090283 /nfs/dbraw/zinc/09/02/83/1050090283.db2.gz YAYBINXBGRKHAM-GXTWGEPZSA-N -1 1 348.830 4.161 20 0 EIADMM O=S(=O)([N-]c1ccccc1-c1ccccc1)c1ccc2n[nH]cc2c1 ZINC001185987248 1050198832 /nfs/dbraw/zinc/19/88/32/1050198832.db2.gz ISFUINWEYCBXCX-UHFFFAOYSA-N -1 1 349.415 4.031 20 0 EIADMM CCOc1cc(C(=O)N2CC[C@@H]2c2ccc(F)cc2)cc(Cl)c1[O-] ZINC000618050851 1050203216 /nfs/dbraw/zinc/20/32/16/1050203216.db2.gz FPOWTLCWJAYUAP-OAHLLOKOSA-N -1 1 349.789 4.171 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2csc3ccccc32)c(F)c1F ZINC001186495259 1050338496 /nfs/dbraw/zinc/33/84/96/1050338496.db2.gz FKVGVGYSVASWLD-UHFFFAOYSA-N -1 1 339.388 4.289 20 0 EIADMM C=Cc1ccc(C(=O)Nc2cc(OC)cc(Br)c2[O-])cc1 ZINC001186510915 1050347008 /nfs/dbraw/zinc/34/70/08/1050347008.db2.gz CPYGFTJHFSMOKE-UHFFFAOYSA-N -1 1 348.196 4.059 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2cc3c(s2)CCCC3)c(F)c1F ZINC001187209435 1050508547 /nfs/dbraw/zinc/50/85/47/1050508547.db2.gz NETQWHNIWISDBY-UHFFFAOYSA-N -1 1 343.420 4.014 20 0 EIADMM O=S(=O)([N-]c1cc(F)ccc1Cl)c1cc2c(s1)CCCC2 ZINC001187207248 1050508674 /nfs/dbraw/zinc/50/86/74/1050508674.db2.gz WUOBHCVCENCRGC-UHFFFAOYSA-N -1 1 345.848 4.220 20 0 EIADMM O=C(Nc1cccc(C(F)(F)F)c1[O-])c1ccoc1C(F)(F)F ZINC001187721396 1050608438 /nfs/dbraw/zinc/60/84/38/1050608438.db2.gz OMCDDXIUEWYJCE-UHFFFAOYSA-N -1 1 339.191 4.275 20 0 EIADMM COc1ccc(Nc2ccc(F)c(Br)c2[O-])cc1OC ZINC001173888147 1050639994 /nfs/dbraw/zinc/63/99/94/1050639994.db2.gz NQBRIKBXCDIVGV-UHFFFAOYSA-N -1 1 342.164 4.055 20 0 EIADMM COCc1ccccc1Nc1ccc(F)c(Br)c1[O-] ZINC001174106067 1050732202 /nfs/dbraw/zinc/73/22/02/1050732202.db2.gz IHQNDBBQLMGUES-UHFFFAOYSA-N -1 1 326.165 4.184 20 0 EIADMM O=C(Nc1cc(F)c([O-])cc1Cl)C1(Cc2ccc(F)cc2)CC1 ZINC001179660496 1050741367 /nfs/dbraw/zinc/74/13/67/1050741367.db2.gz UJLUNLNVVHFXNB-UHFFFAOYSA-N -1 1 337.753 4.285 20 0 EIADMM O=C(NC1CCCCC1)c1ccc(Nc2ccc(F)c(F)c2[O-])cc1 ZINC001174082253 1050757904 /nfs/dbraw/zinc/75/79/04/1050757904.db2.gz JJERGVVOSOYZTE-UHFFFAOYSA-N -1 1 346.377 4.477 20 0 EIADMM O=C(Nc1ccc2ccccc2c1)Nc1cc2ccc([O-])cc2oc1=O ZINC001188583795 1050809552 /nfs/dbraw/zinc/80/95/52/1050809552.db2.gz HTFLRCYWBUMECZ-UHFFFAOYSA-N -1 1 346.342 4.296 20 0 EIADMM O=C(c1cccc(Nc2cc([O-])c(Cl)cc2F)c1)N1CCCC1 ZINC001174171386 1050813312 /nfs/dbraw/zinc/81/33/12/1050813312.db2.gz RQLBWWXXMHYHAK-UHFFFAOYSA-N -1 1 334.778 4.164 20 0 EIADMM CCS[C@@H]1CCCCN(C(=O)c2ccc(C(F)(F)F)c([O-])c2)C1 ZINC000619582533 1050825009 /nfs/dbraw/zinc/82/50/09/1050825009.db2.gz QZRCXNZKGTZDCF-GFCCVEGCSA-N -1 1 347.402 4.159 20 0 EIADMM CC(C)[C@H]1CCc2nc(NC(=O)c3ccc([O-])cc3F)sc2C1 ZINC001180109920 1050888119 /nfs/dbraw/zinc/88/81/19/1050888119.db2.gz IZNGFAWCVTVZIW-JTQLQIEISA-N -1 1 334.416 4.001 20 0 EIADMM Cc1nc(S[C@@H](C)C(=O)c2ccc(C(C)(C)C)cc2)[n-]c(=O)c1C ZINC001189060846 1050896350 /nfs/dbraw/zinc/89/63/50/1050896350.db2.gz DYGRDIUARLRGMH-ZDUSSCGKSA-N -1 1 344.480 4.460 20 0 EIADMM O=C(Nc1n[nH]cc1-c1ccccc1)c1ccc(C(F)(F)F)cc1[O-] ZINC001180155444 1050904364 /nfs/dbraw/zinc/90/43/64/1050904364.db2.gz ADJOQHYVBWNDKO-UHFFFAOYSA-N -1 1 347.296 4.053 20 0 EIADMM COc1ccc(Cn2cc(Nc3cc([O-])c(Cl)cc3F)cn2)cc1 ZINC001174438160 1050968985 /nfs/dbraw/zinc/96/89/85/1050968985.db2.gz ZYRSWKYCFPCTPD-UHFFFAOYSA-N -1 1 347.777 4.182 20 0 EIADMM Cc1cnc(SCc2csc(-c3ccccc3F)n2)[n-]c1=O ZINC001189399537 1050985030 /nfs/dbraw/zinc/98/50/30/1050985030.db2.gz UUIAFHUMCQPNNT-UHFFFAOYSA-N -1 1 333.413 4.046 20 0 EIADMM CCc1nc(SCC(=O)c2cc(C)c(C)c(C)c2C)[n-]c(=O)c1C ZINC001189494936 1051000533 /nfs/dbraw/zinc/00/05/33/1051000533.db2.gz BAQFJVNYRMGFFJ-UHFFFAOYSA-N -1 1 344.480 4.262 20 0 EIADMM CNc1ncc2cc(Nc3ccc(Cl)c(Cl)c3[O-])ccc2n1 ZINC001174533580 1051028098 /nfs/dbraw/zinc/02/80/98/1051028098.db2.gz FIKXBQRLGKHHQS-UHFFFAOYSA-N -1 1 335.194 4.428 20 0 EIADMM CC1(C)CCC[C@@H](CSc2nc(-c3ccccc3)cc(=O)[n-]2)O1 ZINC001190209814 1051136483 /nfs/dbraw/zinc/13/64/83/1051136483.db2.gz JSZDKEPNQTUTDF-AWEZNQCLSA-N -1 1 330.453 4.289 20 0 EIADMM O=S(=O)([N-]c1cnc2cccc(F)c2c1)c1ccc(C2CC2)cc1 ZINC001190471688 1051193945 /nfs/dbraw/zinc/19/39/45/1051193945.db2.gz HJSVHGIPGXMVLU-UHFFFAOYSA-N -1 1 342.395 4.052 20 0 EIADMM Cn1cncc1Nc1ccc(-c2cc(C(=O)[O-])c3ccccc3n2)cc1 ZINC001174855176 1051215936 /nfs/dbraw/zinc/21/59/36/1051215936.db2.gz FZEDVVLTDSFCNM-UHFFFAOYSA-N -1 1 344.374 4.077 20 0 EIADMM CC1(C)CCC[C@@H]1C[N-]S(=O)(=O)c1cc(Cl)sc1Cl ZINC001190611968 1051233782 /nfs/dbraw/zinc/23/37/82/1051233782.db2.gz KAAQMGFYVZJUGG-MRVPVSSYSA-N -1 1 342.313 4.160 20 0 EIADMM CCCCOc1ccccc1Nc1cc2ccc([O-])cc2oc1=O ZINC001175000804 1051288233 /nfs/dbraw/zinc/28/82/33/1051288233.db2.gz ZWMGHHJNEVCVHW-UHFFFAOYSA-N -1 1 325.364 4.421 20 0 EIADMM Cc1cc(NC(=O)c2ccc(C(C)(C)C)cc2[O-])n(C2CCC2)n1 ZINC001192315166 1051689574 /nfs/dbraw/zinc/68/95/74/1051689574.db2.gz YJZFDEVZKOXRSY-UHFFFAOYSA-N -1 1 327.428 4.172 20 0 EIADMM COc1cccc2c(NC(=O)c3c(F)ccc([O-])c3F)cccc12 ZINC001192540188 1051765208 /nfs/dbraw/zinc/76/52/08/1051765208.db2.gz SMOXADUGYXBFOO-UHFFFAOYSA-N -1 1 329.302 4.085 20 0 EIADMM C[C@]12CC3CC(NC(=O)c4cc([O-])cc(F)c4F)(C1)C[C@@](C)(C3)C2 ZINC001192678412 1051789607 /nfs/dbraw/zinc/78/96/07/1051789607.db2.gz ACHAIEUGOPSZNR-PDPGNDQDSA-N -1 1 335.394 4.149 20 0 EIADMM Cc1cc(Cl)cc(Cl)c1CNC(=O)c1cc([O-])cc(F)c1F ZINC001192678764 1051790492 /nfs/dbraw/zinc/79/04/92/1051790492.db2.gz JXRHLTCUEIVUQA-UHFFFAOYSA-N -1 1 346.160 4.216 20 0 EIADMM O=C(c1cc([O-])cc(F)c1F)N1CCC[C@@H]1c1cc2ccccc2[nH]1 ZINC001192664468 1051796254 /nfs/dbraw/zinc/79/62/54/1051796254.db2.gz MCPRSNWSGRIIGP-QGZVFWFLSA-N -1 1 342.345 4.129 20 0 EIADMM O=C(c1cc([O-])cc(F)c1F)N1CCC[C@H]1c1cc2ccccc2[nH]1 ZINC001192664466 1051796948 /nfs/dbraw/zinc/79/69/48/1051796948.db2.gz MCPRSNWSGRIIGP-KRWDZBQOSA-N -1 1 342.345 4.129 20 0 EIADMM O=C(c1cc([O-])cc(F)c1F)N(Cc1ccccn1)C1CCCCC1 ZINC001192665354 1051797828 /nfs/dbraw/zinc/79/78/28/1051797828.db2.gz WTVPOSGSOAKXLP-UHFFFAOYSA-N -1 1 346.377 4.041 20 0 EIADMM O=C(N[C@@H](c1cccc(Cl)c1)C(F)F)c1cc(Cl)ccc1[O-] ZINC001175805098 1051802644 /nfs/dbraw/zinc/80/26/44/1051802644.db2.gz HXYBISXWRXJZGJ-ZDUSSCGKSA-N -1 1 346.160 4.435 20 0 EIADMM Cc1c(Cl)cc(NC(=O)c2c(O)ccc(F)c2F)c([O-])c1Cl ZINC001192763999 1051806152 /nfs/dbraw/zinc/80/61/52/1051806152.db2.gz AMQPRIAGCJFLPY-UHFFFAOYSA-N -1 1 348.132 4.244 20 0 EIADMM CCCCOc1ccc(C(=O)N2CCc3cc(C)ccc32)c([O-])c1 ZINC001183359842 1051827458 /nfs/dbraw/zinc/82/74/58/1051827458.db2.gz SOXBWORKFLWGQK-UHFFFAOYSA-N -1 1 325.408 4.082 20 0 EIADMM O=C(Nc1ccc([C@@H](F)C(F)(F)F)cc1)c1cccc([O-])c1F ZINC001175871675 1051829795 /nfs/dbraw/zinc/82/97/95/1051829795.db2.gz KHEURGJXGDDATK-CYBMUJFWSA-N -1 1 331.240 4.357 20 0 EIADMM C[C@H](NC(=O)c1ccc(Br)c([O-])c1)[C@H]1CCC[C@@H](C)C1 ZINC001183706136 1051886994 /nfs/dbraw/zinc/88/69/94/1051886994.db2.gz FKJKXSQSIIEZIB-WOPDTQHZSA-N -1 1 340.261 4.099 20 0 EIADMM COc1ccc(Nc2c([O-])c(Br)ccc2Cl)cc1O ZINC001176259312 1051984821 /nfs/dbraw/zinc/98/48/21/1051984821.db2.gz FUVVRCKNZYVKMJ-UHFFFAOYSA-N -1 1 344.592 4.266 20 0 EIADMM C[C@H](OC(=O)c1ccc([O-])cc1F)c1ncc(-c2ccccc2)o1 ZINC000773576862 1052057700 /nfs/dbraw/zinc/05/77/00/1052057700.db2.gz DHMCFIJPODUFRS-NSHDSACASA-N -1 1 327.311 4.104 20 0 EIADMM [O-]c1c(Cl)cc(Br)cc1Nc1ccc(O)cc1F ZINC001176417397 1052066786 /nfs/dbraw/zinc/06/67/86/1052066786.db2.gz OXBWAWBFUZBYAF-UHFFFAOYSA-N -1 1 332.556 4.396 20 0 EIADMM Cc1c(Cl)cccc1NC(=O)Nc1cc(=O)n(-c2ccccc2)[n-]1 ZINC001184656200 1052072401 /nfs/dbraw/zinc/07/24/01/1052072401.db2.gz YSASVJULFKSBTR-UHFFFAOYSA-N -1 1 342.786 4.184 20 0 EIADMM CCS(=O)(=O)c1ccc([O-])c(Nc2ccc(Cl)c(Cl)c2)c1 ZINC001176540899 1052117402 /nfs/dbraw/zinc/11/74/02/1052117402.db2.gz DBYIXZZTIULJCL-UHFFFAOYSA-N -1 1 346.235 4.236 20 0 EIADMM Cc1cc(Nc2c(F)cc(F)c([O-])c2F)n(-c2cccc(C)c2)n1 ZINC001176664877 1052157874 /nfs/dbraw/zinc/15/78/74/1052157874.db2.gz WSULPHLJPUBYAM-UHFFFAOYSA-N -1 1 333.313 4.356 20 0 EIADMM COc1ccc(-n2nc(C)cc2Nc2c(F)cc(F)c([O-])c2F)cc1 ZINC001176663720 1052157959 /nfs/dbraw/zinc/15/79/59/1052157959.db2.gz KZMXMJNVHDYJII-UHFFFAOYSA-N -1 1 349.312 4.056 20 0 EIADMM [O-]c1c(F)cc(F)c(Nc2cc(F)ccc2Br)c1F ZINC001176669272 1052158149 /nfs/dbraw/zinc/15/81/49/1052158149.db2.gz FWWGVFDXGYBKAM-UHFFFAOYSA-N -1 1 336.082 4.455 20 0 EIADMM COc1cccc(Br)c1Nc1c(F)cc(F)c([O-])c1F ZINC001176670657 1052158297 /nfs/dbraw/zinc/15/82/97/1052158297.db2.gz JOYADIPPVGKNSN-UHFFFAOYSA-N -1 1 348.118 4.324 20 0 EIADMM Cc1cc(O)c(Nc2c(F)cc(F)c([O-])c2F)cc1Br ZINC001176671419 1052159718 /nfs/dbraw/zinc/15/97/18/1052159718.db2.gz YJFCVLQSHWDBNJ-UHFFFAOYSA-N -1 1 348.118 4.330 20 0 EIADMM CC(=O)Nc1ccc(Cl)c(Nc2c(F)cc(F)c([O-])c2F)c1 ZINC001176671403 1052160265 /nfs/dbraw/zinc/16/02/65/1052160265.db2.gz CFUKTWLVCRAQTQ-UHFFFAOYSA-N -1 1 330.693 4.165 20 0 EIADMM [O-]c1c(F)cc(F)c(Nc2ccc3ncnc(Cl)c3c2)c1F ZINC001176674876 1052161051 /nfs/dbraw/zinc/16/10/51/1052161051.db2.gz ZQHRKJHJCSRSIW-UHFFFAOYSA-N -1 1 325.677 4.150 20 0 EIADMM [O-]c1c(F)cc(F)c(Nc2c(F)cccc2N2CCCC2)c1F ZINC001176674294 1052161655 /nfs/dbraw/zinc/16/16/55/1052161655.db2.gz UHZVBYWLBUOXLV-UHFFFAOYSA-N -1 1 326.293 4.292 20 0 EIADMM O=S(=O)(Cc1cc(F)cc(F)c1)[N-]c1ccccc1-c1ccco1 ZINC001185137842 1052174590 /nfs/dbraw/zinc/17/45/90/1052174590.db2.gz MYKKUSCNMGDRFV-UHFFFAOYSA-N -1 1 349.358 4.167 20 0 EIADMM Cc1cccc(C)c1S(=O)(=O)[N-]c1ccc(-c2ccccc2)nc1 ZINC001194604764 1052176071 /nfs/dbraw/zinc/17/60/71/1052176071.db2.gz JZHYANYDDSSABM-UHFFFAOYSA-N -1 1 338.432 4.166 20 0 EIADMM Cc1cccc(C)c1S(=O)(=O)Nc1c(Cl)ccc([O-])c1Cl ZINC001194639499 1052184331 /nfs/dbraw/zinc/18/43/31/1052184331.db2.gz UNVFCUDIEPJBKF-UHFFFAOYSA-N -1 1 346.235 4.117 20 0 EIADMM O=C(c1cc(F)ccc1[O-])N(Cc1ccc(F)cc1F)C1CCCC1 ZINC000622363707 1052231815 /nfs/dbraw/zinc/23/18/15/1052231815.db2.gz XIXBPKTXKUJVKQ-UHFFFAOYSA-N -1 1 349.352 4.395 20 0 EIADMM CCC[C@@]1(C)CCCN(C(=O)c2ccc(C(F)(F)F)cc2[O-])C1 ZINC000622403502 1052248508 /nfs/dbraw/zinc/24/85/08/1052248508.db2.gz XKQMHQFVISEHAD-INIZCTEOSA-N -1 1 329.362 4.453 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2ccnc(C(C)(C)C)c2)ccc1Cl ZINC001185496283 1052252590 /nfs/dbraw/zinc/25/25/90/1052252590.db2.gz KDSQMCTXIFARTC-UHFFFAOYSA-N -1 1 338.860 4.142 20 0 EIADMM CC(C)(C)Oc1c(F)cc(NC(=O)c2cc(F)ccc2[O-])cc1F ZINC000622504449 1052304496 /nfs/dbraw/zinc/30/44/96/1052304496.db2.gz ZZCINZRSQJYZAX-UHFFFAOYSA-N -1 1 339.313 4.239 20 0 EIADMM O=C(Nc1cc(Cl)ccc1OC(F)F)c1cc(F)ccc1[O-] ZINC000622733484 1052398751 /nfs/dbraw/zinc/39/87/51/1052398751.db2.gz AGEIEUOVSKNRQV-UHFFFAOYSA-N -1 1 331.677 4.038 20 0 EIADMM CCOc1cc(C(=O)N2C[C@H](C)[C@@H]3CCCC[C@@H]32)cc(Cl)c1[O-] ZINC000183551323 1052978040 /nfs/dbraw/zinc/97/80/40/1052978040.db2.gz CJHFJYMHGNULKA-WHOFXGATSA-N -1 1 337.847 4.095 20 0 EIADMM Cc1sc(C)c2c1[n-]c(CCCOCCc1ccccc1)nc2=O ZINC000864355445 1053247612 /nfs/dbraw/zinc/24/76/12/1053247612.db2.gz MQFPHDNQMWKUQS-UHFFFAOYSA-N -1 1 342.464 4.206 20 0 EIADMM CC(C)c1cccc(S(=O)(=O)[N-]c2ccc3c(c2)CCCC3=O)c1 ZINC001195159727 1053309754 /nfs/dbraw/zinc/30/97/54/1053309754.db2.gz UCXIEHZBGHZTBK-UHFFFAOYSA-N -1 1 343.448 4.130 20 0 EIADMM O=C(Nc1c(F)cc([O-])cc1F)Oc1ccccc1C(F)(F)F ZINC001195200585 1053326706 /nfs/dbraw/zinc/32/67/06/1053326706.db2.gz OMPPGZQXBFTXEZ-UHFFFAOYSA-N -1 1 333.212 4.300 20 0 EIADMM C[C@@H](CC(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)c1ccccc1F ZINC000338933273 1053442235 /nfs/dbraw/zinc/44/22/35/1053442235.db2.gz JODFELVWZDZMQU-LBPRGKRZSA-N -1 1 339.370 4.054 20 0 EIADMM Cc1c(=O)[n-]c(S[C@H](C)C(=O)C(C)(C)C)nc1-c1ccccc1 ZINC000865364998 1053483800 /nfs/dbraw/zinc/48/38/00/1053483800.db2.gz YVUKCRHFRDXXTK-GFCCVEGCSA-N -1 1 330.453 4.253 20 0 EIADMM CCN(C)c1ccc(CSc2nc(C)c(C3CC3)c(=O)[n-]2)cc1 ZINC000865373245 1053486568 /nfs/dbraw/zinc/48/65/68/1053486568.db2.gz LTUDWEMQYCQZGR-UHFFFAOYSA-N -1 1 329.469 4.116 20 0 EIADMM O=C(Nc1cccc(C(F)(F)F)c1[O-])c1cc2sccc2[nH]1 ZINC001152267944 1053669921 /nfs/dbraw/zinc/66/99/21/1053669921.db2.gz AAIODQFQFKNOBF-UHFFFAOYSA-N -1 1 326.299 4.206 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1cc(Cl)cc2cccnc21 ZINC000111668698 1053719467 /nfs/dbraw/zinc/71/94/67/1053719467.db2.gz IAKYQWHRVVCGJA-UHFFFAOYSA-N -1 1 333.174 4.500 20 0 EIADMM CC(C)c1nnc([N-]C(=O)c2occc2COc2ccccc2)s1 ZINC000022281897 1053754279 /nfs/dbraw/zinc/75/42/79/1053754279.db2.gz AAGYLDCBKQMAJO-UHFFFAOYSA-N -1 1 343.408 4.086 20 0 EIADMM [O-]c1cccc(NC(=S)Nc2ccc(F)cc2)c1Br ZINC001196948344 1053812075 /nfs/dbraw/zinc/81/20/75/1053812075.db2.gz AMZGXTYSBJEIBP-UHFFFAOYSA-N -1 1 341.205 4.103 20 0 EIADMM CC1(C)CC[C@@H]1C(=O)Nc1c([O-])cc(Br)cc1Cl ZINC000854432020 1053814673 /nfs/dbraw/zinc/81/46/73/1053814673.db2.gz HZKYDVLPXLFBPH-MRVPVSSYSA-N -1 1 332.625 4.183 20 0 EIADMM CCCCN(CC(F)(F)F)C(=O)c1cc2ccccc2cc1[O-] ZINC000387094582 1053841934 /nfs/dbraw/zinc/84/19/34/1053841934.db2.gz HTUOOVSINYZVQO-UHFFFAOYSA-N -1 1 325.330 4.350 20 0 EIADMM Nc1cc(Nc2cc(Br)cc(Cl)c2[O-])ccc1F ZINC001212350132 1053869401 /nfs/dbraw/zinc/86/94/01/1053869401.db2.gz PEYYNLQNBOSOBK-UHFFFAOYSA-N -1 1 331.572 4.273 20 0 EIADMM [O-]c1c(F)cc(-c2nc3ccc(Cl)cc3[nH]2)cc1Br ZINC001251168327 1053871799 /nfs/dbraw/zinc/87/17/99/1053871799.db2.gz DGFWMSGFBCCAGY-UHFFFAOYSA-N -1 1 341.567 4.491 20 0 EIADMM Cc1cc(F)ccc1S(=O)(=O)[N-]c1cccc(OC2CCCC2)c1 ZINC000028260341 1053975897 /nfs/dbraw/zinc/97/58/97/1053975897.db2.gz SERQPEKRJGEVCR-UHFFFAOYSA-N -1 1 349.427 4.256 20 0 EIADMM O=S(=O)([N-]c1ccc(OC(F)F)cc1)c1cccc2ccccc21 ZINC000033900281 1054129557 /nfs/dbraw/zinc/12/95/57/1054129557.db2.gz UMQZMAZGTXNBKA-UHFFFAOYSA-N -1 1 349.358 4.242 20 0 EIADMM Cc1cncc2cccc([N-]S(=O)(=O)c3ccc4occc4c3)c12 ZINC001198858572 1054283104 /nfs/dbraw/zinc/28/31/04/1054283104.db2.gz DVUODIXGFHPLNP-UHFFFAOYSA-N -1 1 338.388 4.090 20 0 EIADMM O=S(=O)([N-]c1cccc2ccc(O)cc21)c1ccc2occc2c1 ZINC001198859114 1054283191 /nfs/dbraw/zinc/28/31/91/1054283191.db2.gz PVZOPIZTWLFOHV-UHFFFAOYSA-N -1 1 339.372 4.092 20 0 EIADMM Cc1cc(CN[C@@H](CC(=O)[O-])c2ccccc2Cl)cnc1Cl ZINC000871883460 1054319193 /nfs/dbraw/zinc/31/91/93/1054319193.db2.gz NWUVNZLYTQNHEM-AWEZNQCLSA-N -1 1 339.222 4.002 20 0 EIADMM CCCOc1c(F)c(F)c(Nc2ncc(F)cc2[O-])c(F)c1F ZINC001201297671 1054743206 /nfs/dbraw/zinc/74/32/06/1054743206.db2.gz JOFFHEUBNBRHHB-UHFFFAOYSA-N -1 1 334.244 4.015 20 0 EIADMM O=C(Nc1cccc(C(F)(F)F)c1[O-])N[C@@H]1C[C@H]1c1ccccc1 ZINC001201937034 1054944606 /nfs/dbraw/zinc/94/46/06/1054944606.db2.gz LOBHWEGNEBNGJX-SMDDNHRTSA-N -1 1 336.313 4.089 20 0 EIADMM O=C(Nc1cccc(Cl)c1)Nc1cccc([O-])c1Br ZINC001202248580 1055116305 /nfs/dbraw/zinc/11/63/05/1055116305.db2.gz OJVMWYSVVUYFTR-UHFFFAOYSA-N -1 1 341.592 4.452 20 0 EIADMM O=C(Nc1ccc(Br)cc1)Nc1ccc([O-])c(F)c1F ZINC001202334049 1055142331 /nfs/dbraw/zinc/14/23/31/1055142331.db2.gz VFOPMMYTLCSHIS-UHFFFAOYSA-N -1 1 343.127 4.077 20 0 EIADMM Cc1c(=O)[n-]c(SCCC(F)(F)Cl)nc1-c1ccccc1 ZINC000863320599 1055187405 /nfs/dbraw/zinc/18/74/05/1055187405.db2.gz CFNPZIYSTPMDON-UHFFFAOYSA-N -1 1 330.787 4.471 20 0 EIADMM COc1cccc(N[C@@H](C)c2cc(Br)cc(F)c2[O-])c1 ZINC000186243257 1055263373 /nfs/dbraw/zinc/26/33/73/1055263373.db2.gz JESUDJAJRSQOCO-VIFPVBQESA-N -1 1 340.192 4.476 20 0 EIADMM CC(=O)c1cc(-c2nc(-c3ccccc3Oc3ccccc3)no2)n[n-]1 ZINC001212429751 1055923510 /nfs/dbraw/zinc/92/35/10/1055923510.db2.gz OAWQWEZQVCSPBE-UHFFFAOYSA-N -1 1 346.346 4.122 20 0 EIADMM CC(=O)c1cc(-c2nc(-c3ccccc3Oc3ccccc3)no2)[n-]n1 ZINC001212429751 1055923521 /nfs/dbraw/zinc/92/35/21/1055923521.db2.gz OAWQWEZQVCSPBE-UHFFFAOYSA-N -1 1 346.346 4.122 20 0 EIADMM CCOc1cc(C(=O)N(C)Cc2sccc2C)cc(Cl)c1[O-] ZINC000338742759 1056708616 /nfs/dbraw/zinc/70/86/16/1056708616.db2.gz FQVSTTFCQZLZFE-UHFFFAOYSA-N -1 1 339.844 4.086 20 0 EIADMM Cc1oc(-c2ccccc2)nc1CC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000111667391 1056812028 /nfs/dbraw/zinc/81/20/28/1056812028.db2.gz RZJDSHKPLZDBEC-UHFFFAOYSA-N -1 1 342.782 4.190 20 0 EIADMM O=C(c1c([O-])cccc1Cl)N1CC[C@H](CSc2ccccc2)C1 ZINC000743751845 1059103293 /nfs/dbraw/zinc/10/32/93/1059103293.db2.gz CWAWSXAONVAOIN-ZDUSSCGKSA-N -1 1 347.867 4.300 20 0 EIADMM CC(=O)c1ccc([O-])c(CCOC(=O)c2csc3ccccc23)c1 ZINC000744626939 1059600929 /nfs/dbraw/zinc/60/09/29/1059600929.db2.gz JLEYGVUFAKURIE-UHFFFAOYSA-N -1 1 340.400 4.209 20 0 EIADMM CCC(=CC(=O)OCCc1cc(C(C)=O)ccc1[O-])c1ccccc1 ZINC000744957025 1059677106 /nfs/dbraw/zinc/67/71/06/1059677106.db2.gz LBMCVYIVJXQIJL-JQIJEIRASA-N -1 1 338.403 4.174 20 0 EIADMM CC(=O)c1ccc([O-])c(CCOC(=O)[C@H](c2ccccc2)C(C)C)c1 ZINC000745551184 1059846518 /nfs/dbraw/zinc/84/65/18/1059846518.db2.gz KFQVPECMQFARMY-FQEVSTJZSA-N -1 1 340.419 4.120 20 0 EIADMM CC[C@H](CC(=O)Nc1ccc(-n2ccc(=O)[n-]2)cc1)c1ccc(C)cc1 ZINC001168915286 1060517371 /nfs/dbraw/zinc/51/73/71/1060517371.db2.gz UKJXEJHSXJGMEC-MRXNPFEDSA-N -1 1 349.434 4.409 20 0 EIADMM COc1c(Cl)ccc(Nc2cc3ccc([O-])cc3oc2=O)c1F ZINC001212584275 1060610337 /nfs/dbraw/zinc/61/03/37/1060610337.db2.gz ZBOPKPSYUYSDBH-UHFFFAOYSA-N -1 1 335.718 4.043 20 0 EIADMM CCOC(=O)c1cc2cc(C)c(N)cc2n1-c1ccc(Cl)c([O-])c1 ZINC001212593704 1060911550 /nfs/dbraw/zinc/91/15/50/1060911550.db2.gz FYKMOQIPJOMPQD-UHFFFAOYSA-N -1 1 344.798 4.057 20 0 EIADMM C[C@@H](Sc1nc2ccccc2s1)C(=O)Nc1c([O-])cccc1F ZINC000767170556 1061125452 /nfs/dbraw/zinc/12/54/52/1061125452.db2.gz MKXVWBHBSIWNKF-SECBINFHSA-N -1 1 348.424 4.260 20 0 EIADMM O=C(Nc1ccc(N2CCCCC2)c(Cl)c1)c1ccc([O-])c(F)c1 ZINC000767314185 1061195732 /nfs/dbraw/zinc/19/57/32/1061195732.db2.gz VRVUCKCLCVYDTE-UHFFFAOYSA-N -1 1 348.805 4.427 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1CCC[C@@H](c2nccs2)C1 ZINC000170890837 1032231232 /nfs/dbraw/zinc/23/12/32/1032231232.db2.gz XXFSAJNMGDUTOO-OAHLLOKOSA-N -1 1 338.432 4.022 20 0 EIADMM CCCc1nc(C)c(NC(=O)c2cc(Cl)c([O-])c(OC)c2)s1 ZINC000443208809 1032233568 /nfs/dbraw/zinc/23/35/68/1032233568.db2.gz PTLDUQBKSDPAKA-UHFFFAOYSA-N -1 1 340.832 4.024 20 0 EIADMM O=C(COc1cc(Cl)ccc1Cl)Nc1ccc([O-])c(Cl)c1 ZINC000532749233 1032286900 /nfs/dbraw/zinc/28/69/00/1032286900.db2.gz PUVSSECTXWNROJ-UHFFFAOYSA-N -1 1 346.597 4.370 20 0 EIADMM C[C@@H](C(=O)Nc1cc(Cl)c([O-])c2ccccc12)C1CCOCC1 ZINC000529540292 1032428986 /nfs/dbraw/zinc/42/89/86/1032428986.db2.gz XLAPPGXLTLJRBH-LLVKDONJSA-N -1 1 333.815 4.200 20 0 EIADMM CC(C)c1nnc([N-]C(=O)c2ccc(Oc3ccccc3)o2)s1 ZINC000176150620 1032460127 /nfs/dbraw/zinc/46/01/27/1032460127.db2.gz GNYZWFNHXVOAJO-UHFFFAOYSA-N -1 1 329.381 4.299 20 0 EIADMM C[C@@H](CSc1ccccc1)c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445476358 1032565335 /nfs/dbraw/zinc/56/53/35/1032565335.db2.gz BMUAFAGGLAAMEA-NSHDSACASA-N -1 1 330.384 4.477 20 0 EIADMM O=C([O-])[C@H](NCc1ccc2ccccc2c1)c1cc(F)ccc1F ZINC000683172622 1019093398 /nfs/dbraw/zinc/09/33/98/1019093398.db2.gz FJVMNGXBSDFILS-GOSISDBHSA-N -1 1 327.330 4.034 20 0 EIADMM CCCCOc1ccc(CN[C@H](C(=O)[O-])c2cc(F)ccc2F)cc1 ZINC000683174931 1019109489 /nfs/dbraw/zinc/10/94/89/1019109489.db2.gz SATUGPQZKYIZPG-SFHVURJKSA-N -1 1 349.377 4.059 20 0 EIADMM CCCCOc1ccc(F)c([N-]c2cnns2)c1Br ZINC001211493675 1019200152 /nfs/dbraw/zinc/20/01/52/1019200152.db2.gz JTYLBNBYSCSOHL-UHFFFAOYSA-N -1 1 346.225 4.362 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1CC(F)(c2ccccc2F)C1 ZINC000646892280 1019617599 /nfs/dbraw/zinc/61/75/99/1019617599.db2.gz SPLCJKJMTNISRL-UHFFFAOYSA-N -1 1 339.341 4.005 20 0 EIADMM Cc1cccc(S(=O)(=O)[N-]c2ccccc2Cc2ccccc2)c1 ZINC000069118633 1019691630 /nfs/dbraw/zinc/69/16/30/1019691630.db2.gz JIWYCTOPGMKWFC-UHFFFAOYSA-N -1 1 337.444 4.387 20 0 EIADMM CC(C)c1nn(C)c2sc(C(=O)Nc3ccc([O-])c(Cl)c3)cc12 ZINC000182875337 1019947880 /nfs/dbraw/zinc/94/78/80/1019947880.db2.gz WIGLOIRLHMDTBD-UHFFFAOYSA-N -1 1 349.843 4.370 20 0 EIADMM Cc1ccc(C)c(S(=O)(=O)[N-]c2cccc(-c3nccs3)c2)c1 ZINC000047417301 1020063668 /nfs/dbraw/zinc/06/36/68/1020063668.db2.gz FANOLEGREAVBDP-UHFFFAOYSA-N -1 1 344.461 4.228 20 0 EIADMM Cc1cc(C)c(-c2csc(NC(=O)c3cncc([O-])c3)n2)cc1C ZINC000339940225 1020142108 /nfs/dbraw/zinc/14/21/08/1020142108.db2.gz VYHJPNKUCZMIRM-UHFFFAOYSA-N -1 1 339.420 4.088 20 0 EIADMM COc1c(Cl)cc([N-]S(=O)(=O)c2cccc(C)c2)cc1Cl ZINC000509536452 1032882233 /nfs/dbraw/zinc/88/22/33/1032882233.db2.gz BGFKEHNKJISJGY-UHFFFAOYSA-N -1 1 346.235 4.111 20 0 EIADMM CCOc1cc(-c2noc(C=C(C)C)n2)cc(Br)c1[O-] ZINC000109507761 1020235871 /nfs/dbraw/zinc/23/58/71/1020235871.db2.gz GYCRHDMUHHYAQJ-UHFFFAOYSA-N -1 1 339.189 4.027 20 0 EIADMM O=C(c1ccc(C(F)(F)F)c([O-])c1)N1CCC[C@H]1c1ccsc1 ZINC001625854050 1020300508 /nfs/dbraw/zinc/30/05/08/1020300508.db2.gz REUCZXPXBPAMEZ-ZDUSSCGKSA-N -1 1 341.354 4.450 20 0 EIADMM CCc1c(=O)n([C@H](C)c2ccncc2)[n-]c1-c1ccc(F)cc1Cl ZINC000634626542 1020348767 /nfs/dbraw/zinc/34/87/67/1020348767.db2.gz GVQHYPGHHQAKKW-BXUZGUMPSA-N -1 1 345.805 4.208 20 0 EIADMM Cc1cc(C)c([N-]S(=O)(=O)c2ccc(F)cc2Cl)c(C)c1 ZINC000119658840 1020554570 /nfs/dbraw/zinc/55/45/70/1020554570.db2.gz KVVBZWNMCQDWKR-UHFFFAOYSA-N -1 1 327.808 4.205 20 0 EIADMM O=C(c1cc(Cl)ccc1[O-])N1CC=C(c2ccc(Cl)nc2)CC1 ZINC000376147788 1021597876 /nfs/dbraw/zinc/59/78/76/1021597876.db2.gz GQKYGANZYOSINO-UHFFFAOYSA-N -1 1 349.217 4.024 20 0 EIADMM CCc1nc2c(s1)[C@@H](N(C)Cc1ccc(C(=O)[O-])c(F)c1)CCC2 ZINC000580214325 1021771389 /nfs/dbraw/zinc/77/13/89/1021771389.db2.gz RPOBVVSKJYEGNG-HNNXBMFYSA-N -1 1 348.443 4.052 20 0 EIADMM CCCC(C)(C)CC(=O)N1CCC(C(=O)c2ccc([O-])cc2)CC1 ZINC000683860978 1021842763 /nfs/dbraw/zinc/84/27/63/1021842763.db2.gz LEGNOUOJVROLBN-UHFFFAOYSA-N -1 1 331.456 4.030 20 0 EIADMM Cc1ccccc1[N-]S(=O)(=O)c1ccc(SC(F)(F)F)cc1 ZINC000064937621 1022069839 /nfs/dbraw/zinc/06/98/39/1022069839.db2.gz HBYWUEMLBOAGTP-UHFFFAOYSA-N -1 1 347.383 4.408 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N(C[C@@H]1CCCO1)C1CCCC1 ZINC000174514926 1022095343 /nfs/dbraw/zinc/09/53/43/1022095343.db2.gz MWXACTLUTIQQOE-SFHVURJKSA-N -1 1 339.435 4.109 20 0 EIADMM COc1ccc2cc(C(=O)Nc3cc([O-])c(F)cc3F)ccc2c1 ZINC001625893365 1022141150 /nfs/dbraw/zinc/14/11/50/1022141150.db2.gz HUAGPAMELUYRNJ-UHFFFAOYSA-N -1 1 329.302 4.085 20 0 EIADMM CCOC(=O)c1cc2cc(-c3cc(F)c([O-])cc3F)ccc2cn1 ZINC001211353432 1022541949 /nfs/dbraw/zinc/54/19/49/1022541949.db2.gz WGUUIRHKGNJHMO-UHFFFAOYSA-N -1 1 329.302 4.062 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cccc([C@@H]4CCCOC4)c3)n2)c(F)c1 ZINC000580872511 1022639943 /nfs/dbraw/zinc/63/99/43/1022639943.db2.gz QXJXQIUXHAGFAA-CQSZACIVSA-N -1 1 340.354 4.142 20 0 EIADMM CCc1nc(S[C@H](C)C(=O)c2ccc(C)c(C)c2)[n-]c(=O)c1C ZINC000581022989 1022804037 /nfs/dbraw/zinc/80/40/37/1022804037.db2.gz QGPKLCPDWPPFGO-CYBMUJFWSA-N -1 1 330.453 4.033 20 0 EIADMM Cc1cc(C)c([N-]S(=O)(=O)c2ccc(Cl)s2)c(Cl)c1 ZINC000096659514 1022882934 /nfs/dbraw/zinc/88/29/34/1022882934.db2.gz ZIEAVHBRYOONRL-UHFFFAOYSA-N -1 1 336.265 4.473 20 0 EIADMM [O-]c1ccc(F)cc1-c1nc(-c2sccc2Br)no1 ZINC000723210653 1023151354 /nfs/dbraw/zinc/15/13/54/1023151354.db2.gz LYCOSSBQNQLDFR-UHFFFAOYSA-N -1 1 341.161 4.072 20 0 EIADMM CCc1cccc2cc(CN[C@H](CC(=O)[O-])c3ccsc3)oc21 ZINC000656564704 1023226215 /nfs/dbraw/zinc/22/62/15/1023226215.db2.gz VTLQMWHQQZNNPT-MRXNPFEDSA-N -1 1 329.421 4.362 20 0 EIADMM C[C@H](c1ncc(-c2ccc(Cl)cc2)o1)[N@H+]1CC[C@H](C(=O)[O-])[C@H](C)C1 ZINC000659801017 1023281919 /nfs/dbraw/zinc/28/19/19/1023281919.db2.gz FVDQBMROCQMWRP-JMSVASOKSA-N -1 1 348.830 4.099 20 0 EIADMM O=C([O-])C[C@@H](NCc1cnc(C2CCCC2)s1)c1ccsc1 ZINC000417537242 1023349164 /nfs/dbraw/zinc/34/91/64/1023349164.db2.gz SBWJZMNQTCKATD-CQSZACIVSA-N -1 1 336.482 4.168 20 0 EIADMM COc1cc(C(=O)N2CCCCC[C@H]2c2ccco2)cc(Cl)c1[O-] ZINC000153858776 1023355091 /nfs/dbraw/zinc/35/50/91/1023355091.db2.gz BSKODUPAADWJHU-AWEZNQCLSA-N -1 1 349.814 4.405 20 0 EIADMM O=C(Nc1cnn(Cc2ccccc2)c1)c1cc2ccccc2cc1[O-] ZINC000390344343 1023472735 /nfs/dbraw/zinc/47/27/35/1023472735.db2.gz VLQWIHFVGAQDGI-UHFFFAOYSA-N -1 1 343.386 4.043 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N1CC[C@@H](C(F)(F)F)C2(CCC2)C1 ZINC000283165440 1023551379 /nfs/dbraw/zinc/55/13/79/1023551379.db2.gz PDTXXBMXMSGIDV-CYBMUJFWSA-N -1 1 347.764 4.240 20 0 EIADMM O=C([O-])CC[C@@H]1CCCN(Cc2cc(Cl)ccc2OC(F)F)C1 ZINC000390893758 1023614989 /nfs/dbraw/zinc/61/49/89/1023614989.db2.gz BPNCFIPFTYJBRR-NSHDSACASA-N -1 1 347.789 4.018 20 0 EIADMM Cc1ccc(-c2cc(=NC(=O)c3cccc(C)c3Cl)[nH][n-]2)s1 ZINC000549760525 1033156904 /nfs/dbraw/zinc/15/69/04/1033156904.db2.gz IUUKQVKPNYEPEJ-UHFFFAOYSA-N -1 1 331.828 4.083 20 0 EIADMM O=C(Nc1ccc(Cl)cc1OC(F)F)c1ccc([O-])cc1F ZINC000183991543 1023961562 /nfs/dbraw/zinc/96/15/62/1023961562.db2.gz YBOBKOOIFPLMLH-UHFFFAOYSA-N -1 1 331.677 4.038 20 0 EIADMM O=C([O-])C[C@H](NCc1cc(C(F)(F)F)ccc1F)c1ccsc1 ZINC000276967132 1024840456 /nfs/dbraw/zinc/84/04/56/1024840456.db2.gz GOVWSTXBUFWNHC-ZDUSSCGKSA-N -1 1 347.333 4.212 20 0 EIADMM CO[C@@H](CSc1nc(-c2ccccc2)c(C)c(=O)[n-]1)C1CCC1 ZINC000657256967 1025418851 /nfs/dbraw/zinc/41/88/51/1025418851.db2.gz IHAXOGUQCQVJKB-HNNXBMFYSA-N -1 1 330.453 4.065 20 0 EIADMM CCc1nc(SCCO[C@@H](CC)c2ccccc2)[n-]c(=O)c1C ZINC000657264055 1025460963 /nfs/dbraw/zinc/46/09/63/1025460963.db2.gz BJWONSOBAVLKQS-INIZCTEOSA-N -1 1 332.469 4.313 20 0 EIADMM C[C@@H](Cc1ccccc1)N(Cc1ccccc1)C(=O)c1ncccc1[O-] ZINC001167518967 1025912452 /nfs/dbraw/zinc/91/24/52/1025912452.db2.gz YPVBVQBDXKLOGW-KRWDZBQOSA-N -1 1 346.430 4.061 20 0 EIADMM Cn1c2ccc(Cl)cc2nc1-c1ccc([O-])c(Br)c1 ZINC000048526471 1026015536 /nfs/dbraw/zinc/01/55/36/1026015536.db2.gz UKDOHEPZFDRIGB-UHFFFAOYSA-N -1 1 337.604 4.362 20 0 EIADMM CCc1onc(C)c1[N-]C(=O)c1cc(F)c(C(F)(F)F)cc1F ZINC000342411751 1026152760 /nfs/dbraw/zinc/15/27/60/1026152760.db2.gz PWDLXMWKJSHQTK-UHFFFAOYSA-N -1 1 334.244 4.095 20 0 EIADMM C[C@@H](Oc1ccccc1Cl)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000111666564 1026314773 /nfs/dbraw/zinc/31/47/73/1026314773.db2.gz RFVJIXIDGZDMLF-SECBINFHSA-N -1 1 326.179 4.105 20 0 EIADMM Cc1cccc([C@@H](NCc2csc3ccccc23)C(=O)[O-])c1C ZINC000426723780 1026500962 /nfs/dbraw/zinc/50/09/62/1026500962.db2.gz NTZBCPXZFAMRSP-GOSISDBHSA-N -1 1 325.433 4.434 20 0 EIADMM O=C(NCC(F)(F)c1ccc(F)cc1)c1cc2ccccc2cc1[O-] ZINC001167877243 1026511095 /nfs/dbraw/zinc/51/10/95/1026511095.db2.gz QUTLFKXCPUFCBY-UHFFFAOYSA-N -1 1 345.320 4.206 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N(CCC(F)(F)F)CC(F)(F)F ZINC000279581977 1026519226 /nfs/dbraw/zinc/51/92/26/1026519226.db2.gz NFJXCTMMYIQETA-UHFFFAOYSA-N -1 1 349.658 4.003 20 0 EIADMM CCCCOc1ccc(CN[C@H](CC(=O)[O-])c2ccc(C)o2)cc1 ZINC000426764431 1026530582 /nfs/dbraw/zinc/53/05/82/1026530582.db2.gz JGRNUGULPHOKKA-QGZVFWFLSA-N -1 1 331.412 4.073 20 0 EIADMM O=C([O-])[C@H](NCc1ccc(Cl)c(F)c1)c1ccc(Cl)c(F)c1 ZINC000426756145 1026540453 /nfs/dbraw/zinc/54/04/53/1026540453.db2.gz IHCBFIHPYRWDGS-CQSZACIVSA-N -1 1 346.160 4.187 20 0 EIADMM O=C([O-])[C@H](NCc1ccc(Cl)cc1F)c1ccc(Cl)c(F)c1 ZINC000426754548 1026540989 /nfs/dbraw/zinc/54/09/89/1026540989.db2.gz RCHFPDRJGXMNLU-CQSZACIVSA-N -1 1 346.160 4.187 20 0 EIADMM CCCSC[C@@H](NCc1ccc(-c2ccc(C)cc2)s1)C(=O)[O-] ZINC000426773583 1026551855 /nfs/dbraw/zinc/55/18/55/1026551855.db2.gz PSUAVWGOWVVITA-MRXNPFEDSA-N -1 1 349.521 4.410 20 0 EIADMM Cc1cc(F)ccc1-c1ccc(CN[C@H](CC(C)(C)C)C(=O)[O-])o1 ZINC000426777385 1026553102 /nfs/dbraw/zinc/55/31/02/1026553102.db2.gz MXJZRJAJDJCBCG-MRXNPFEDSA-N -1 1 333.403 4.373 20 0 EIADMM Cc1cc([C@@H](NCc2cccc(Cl)c2F)C(=O)[O-])ccc1Cl ZINC000426801167 1026568564 /nfs/dbraw/zinc/56/85/64/1026568564.db2.gz SETYSWGCJSNRSS-OAHLLOKOSA-N -1 1 342.197 4.356 20 0 EIADMM O=C([O-])[C@@H](NCc1cc(C(F)(F)F)ccc1Cl)c1cccs1 ZINC000426798226 1026568817 /nfs/dbraw/zinc/56/88/17/1026568817.db2.gz DGSJRIFJXKKPNL-LBPRGKRZSA-N -1 1 349.761 4.336 20 0 EIADMM CC[C@@H](C)c1ccc(S(=O)(=O)[N-]c2ccc3c(c2)COC3)cc1 ZINC000506995349 1026581099 /nfs/dbraw/zinc/58/10/99/1026581099.db2.gz QGSNJXCVNGEDTH-CYBMUJFWSA-N -1 1 331.437 4.031 20 0 EIADMM CCOc1ccc(NC(=O)c2ccc(C(F)(F)F)c([O-])c2)cc1 ZINC000684868943 1026623204 /nfs/dbraw/zinc/62/32/04/1026623204.db2.gz KNKVYWSXYAMQKT-UHFFFAOYSA-N -1 1 325.286 4.062 20 0 EIADMM O=C(c1ccc(C(F)(F)F)c([O-])c1)N1CCC[C@H]1c1cccs1 ZINC000684870203 1026626740 /nfs/dbraw/zinc/62/67/40/1026626740.db2.gz SCNREYIWICGFHN-LBPRGKRZSA-N -1 1 341.354 4.450 20 0 EIADMM CC[C@@H](NC(=O)c1ccc(C(F)(F)F)c([O-])c1)c1nc(C)cs1 ZINC000684874232 1026642585 /nfs/dbraw/zinc/64/25/85/1026642585.db2.gz RUCFDSPXAMHKST-LLVKDONJSA-N -1 1 344.358 4.057 20 0 EIADMM O=C(c1ccc(C(F)(F)F)c([O-])c1)N1CC[C@H](Cc2ccccc2)C1 ZINC000684875284 1026648970 /nfs/dbraw/zinc/64/89/70/1026648970.db2.gz DYRGFFMDSRZGLL-CQSZACIVSA-N -1 1 349.352 4.116 20 0 EIADMM Cc1ccc(C[C@@H](C)NC(=O)c2ccc(C(F)(F)F)c([O-])c2)s1 ZINC000684876265 1026652859 /nfs/dbraw/zinc/65/28/59/1026652859.db2.gz SGMPAKMDQKLZKR-SECBINFHSA-N -1 1 343.370 4.142 20 0 EIADMM COC(=O)c1c[n-]c(S[C@H](C)c2ccc(Cl)c(Cl)c2)n1 ZINC000432669898 1026697918 /nfs/dbraw/zinc/69/79/18/1026697918.db2.gz ZJLUWZAWLWVAGT-SSDOTTSWSA-N -1 1 331.224 4.356 20 0 EIADMM COc1ccc([N-]S(=O)(=O)c2cccc(Cl)c2C)cc1Cl ZINC000511158290 1026800305 /nfs/dbraw/zinc/80/03/05/1026800305.db2.gz VLVDJVSWOVAJEK-UHFFFAOYSA-N -1 1 346.235 4.111 20 0 EIADMM Cc1c([N-]S(=O)(=O)c2cccc(Cl)c2)cccc1-c1ncco1 ZINC000427292396 1026806050 /nfs/dbraw/zinc/80/60/50/1026806050.db2.gz PWOMTEPJDHPRQY-UHFFFAOYSA-N -1 1 348.811 4.104 20 0 EIADMM Cc1ccc(-c2nsc([N-]C(=O)c3oc(C(C)C)nc3C)n2)s1 ZINC000550289897 1026838932 /nfs/dbraw/zinc/83/89/32/1026838932.db2.gz UTKHOKYWAPZBAG-UHFFFAOYSA-N -1 1 348.453 4.247 20 0 EIADMM COc1cc(C(=O)N([C@@H](C)c2ccccc2)C2CC2)cc(Cl)c1[O-] ZINC000342692328 1026851572 /nfs/dbraw/zinc/85/15/72/1026851572.db2.gz QCEABMRWBJHEMW-LBPRGKRZSA-N -1 1 345.826 4.420 20 0 EIADMM CN(C(=O)c1ccc2ccccc2c1[O-])c1cccc2cccnc21 ZINC000684935191 1026853465 /nfs/dbraw/zinc/85/34/65/1026853465.db2.gz VIHGPOXAIQPPHN-UHFFFAOYSA-N -1 1 328.371 4.370 20 0 EIADMM Cc1sc2[nH]c(-c3ccc([O-])cn3)nc(=O)c2c1-c1ccc(C)cc1 ZINC000427443755 1026856964 /nfs/dbraw/zinc/85/69/64/1026856964.db2.gz MWSFQDXQRRRJCL-UHFFFAOYSA-N -1 1 349.415 4.448 20 0 EIADMM Cc1cnc(SCc2ccc([C@@H](C)C(F)(F)F)cc2)[n-]c1=O ZINC000519703049 1026951845 /nfs/dbraw/zinc/95/18/45/1026951845.db2.gz DWMFIRSMNWNHIK-SNVBAGLBSA-N -1 1 328.359 4.449 20 0 EIADMM COc1cc(-c2noc(-c3ccc4ccccc4c3[O-])n2)ccc1F ZINC000327551165 1027164556 /nfs/dbraw/zinc/16/45/56/1027164556.db2.gz ULVWOFIVEZKGJX-UHFFFAOYSA-N -1 1 336.322 4.410 20 0 EIADMM Cc1cccc([C@@H](C)Nc2ccc(-c3nc(C)c(C)c(=O)[n-]3)cn2)c1C ZINC000078264624 1027263261 /nfs/dbraw/zinc/26/32/61/1027263261.db2.gz IGCRRZBQUKTVPO-MRXNPFEDSA-N -1 1 348.450 4.239 20 0 EIADMM O=C(Nc1cccc(CSC2CCOCC2)c1)c1ccccc1[O-] ZINC000116132855 1027292024 /nfs/dbraw/zinc/29/20/24/1027292024.db2.gz QUSQJXZWDQZESV-UHFFFAOYSA-N -1 1 343.448 4.057 20 0 EIADMM CC(C)Cn1cc([N-]c2nn3cc(C4CCCC4)nc3s2)cn1 ZINC000302513253 1027326704 /nfs/dbraw/zinc/32/67/04/1027326704.db2.gz GPLWQWQMEFNGGT-UHFFFAOYSA-N -1 1 330.461 4.045 20 0 EIADMM O=C([O-])CC[C@@H]1CCCN(Cc2coc(-c3ccc(Cl)cc3)n2)C1 ZINC000261614591 1027681951 /nfs/dbraw/zinc/68/19/51/1027681951.db2.gz BLXCLVWISFCTJJ-ZDUSSCGKSA-N -1 1 348.830 4.072 20 0 EIADMM Cc1cc([C@@H](C)N2CCC(Oc3ccc(F)cc3)CC2)oc1C(=O)[O-] ZINC000582246648 1027767050 /nfs/dbraw/zinc/76/70/50/1027767050.db2.gz KUJQJDNLAYUVMF-CYBMUJFWSA-N -1 1 347.386 4.030 20 0 EIADMM Cc1ccc(F)c(-c2cc(=NC(=O)c3cccc(C(F)F)c3)[nH][n-]2)c1 ZINC000444782903 1028044500 /nfs/dbraw/zinc/04/45/00/1028044500.db2.gz RUTKFWYOZCOLOM-UHFFFAOYSA-N -1 1 345.324 4.136 20 0 EIADMM O=C(Nc1ccccc1Oc1cc(F)cc(F)c1)c1cncc([O-])c1 ZINC000346499047 1028472372 /nfs/dbraw/zinc/47/23/72/1028472372.db2.gz LQHOFWWNLHVVJA-UHFFFAOYSA-N -1 1 342.301 4.110 20 0 EIADMM CCC(CC)c1nc(-c2cc(Br)c([O-])c(OC)c2)no1 ZINC000445396621 1028512004 /nfs/dbraw/zinc/51/20/04/1028512004.db2.gz ZWGSAOILLZARPU-UHFFFAOYSA-N -1 1 341.205 4.117 20 0 EIADMM CCOc1cc(-c2noc(-c3oc(C)cc3C)n2)cc(Cl)c1[O-] ZINC000445407924 1028519534 /nfs/dbraw/zinc/51/95/34/1028519534.db2.gz WIAFEUNHBVUTSB-UHFFFAOYSA-N -1 1 334.759 4.371 20 0 EIADMM Cc1cccc(OCCc2nc(-c3ccc([O-])cc3Cl)no2)c1 ZINC000445448805 1028534067 /nfs/dbraw/zinc/53/40/67/1028534067.db2.gz MLDKXPYDGXZEQU-UHFFFAOYSA-N -1 1 330.771 4.026 20 0 EIADMM COc1ccc(CCc2nc(-c3ccc([O-])cc3Cl)no2)cc1F ZINC000445442836 1028565129 /nfs/dbraw/zinc/56/51/29/1028565129.db2.gz ARBFGHUQNOOYFF-UHFFFAOYSA-N -1 1 348.761 4.029 20 0 EIADMM [O-]c1ccc(-c2noc([C@@H]3CCOc4ccccc43)n2)c(Cl)c1 ZINC000445444556 1028572859 /nfs/dbraw/zinc/57/28/59/1028572859.db2.gz GVYCDNOEXUPKRG-GFCCVEGCSA-N -1 1 328.755 4.010 20 0 EIADMM COc1ccc([C@H](C)Cc2nc(-c3ccc([O-])cc3Cl)no2)cc1 ZINC000445446576 1028577395 /nfs/dbraw/zinc/57/73/95/1028577395.db2.gz FBJMUXXALUNUHY-LLVKDONJSA-N -1 1 344.798 4.450 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cccnc3C(F)(F)F)n2)c(Cl)c1 ZINC000445447587 1028584111 /nfs/dbraw/zinc/58/41/11/1028584111.db2.gz IHODEJUKWMVAGP-UHFFFAOYSA-N -1 1 341.676 4.176 20 0 EIADMM COc1ccc(/C=C(/C)c2nc(-c3ccc([O-])c(F)c3)no2)cc1F ZINC000445469191 1028597541 /nfs/dbraw/zinc/59/75/41/1028597541.db2.gz ARBZMNRXYBQNOE-YFHOEESVSA-N -1 1 344.317 4.290 20 0 EIADMM [O-]c1ccc(-c2noc(-c3ccc(Br)cc3)n2)c(F)c1 ZINC000445454535 1028608162 /nfs/dbraw/zinc/60/81/62/1028608162.db2.gz LLQPFRHLXCVMTG-UHFFFAOYSA-N -1 1 335.132 4.011 20 0 EIADMM [O-]c1ccc(-c2noc(CCc3ccc(-c4ccccc4)[nH]3)n2)c(F)c1 ZINC000445456673 1028610255 /nfs/dbraw/zinc/61/02/55/1028610255.db2.gz PPVSCYRFMKYRNX-UHFFFAOYSA-N -1 1 349.365 4.362 20 0 EIADMM COc1ccc(/C(C)=C/c2nc(-c3ccc([O-])cc3F)no2)cc1 ZINC000445456819 1028610817 /nfs/dbraw/zinc/61/08/17/1028610817.db2.gz QEOZQTJEVKXXAL-PKNBQFBNSA-N -1 1 326.327 4.150 20 0 EIADMM [O-]c1ccc(-c2noc([C@@H]3C[C@@H]3c3cc(F)ccc3F)n2)c(F)c1 ZINC000445457674 1028613783 /nfs/dbraw/zinc/61/37/83/1028613783.db2.gz ZGKXEWFZFOFNTA-DGCLKSJQSA-N -1 1 332.281 4.131 20 0 EIADMM [O-]c1ccc(-c2noc(-c3ccc(Oc4ccccc4)nc3)n2)c(F)c1 ZINC000445459877 1028615667 /nfs/dbraw/zinc/61/56/67/1028615667.db2.gz IWFOJQUXPPMDTN-UHFFFAOYSA-N -1 1 349.321 4.436 20 0 EIADMM [O-]c1ccc(-c2noc(-c3ccc4ccc(Cl)cc4n3)n2)cc1F ZINC000445478236 1028623123 /nfs/dbraw/zinc/62/31/23/1028623123.db2.gz GDMFCRSGHMWLJT-UHFFFAOYSA-N -1 1 341.729 4.450 20 0 EIADMM [O-]c1ccc(-c2noc(C3(c4ccc(F)cc4F)CCC3)n2)cc1F ZINC000445478480 1028625262 /nfs/dbraw/zinc/62/52/62/1028625262.db2.gz RCTQTLRRXJIXBX-UHFFFAOYSA-N -1 1 346.308 4.330 20 0 EIADMM CC(C)(C)n1nc(-c2nc(-c3ccc([O-])c(F)c3)no2)cc1C1CC1 ZINC000445480682 1028627711 /nfs/dbraw/zinc/62/77/11/1028627711.db2.gz IRKZLRJAPKZJIB-UHFFFAOYSA-N -1 1 342.374 4.077 20 0 EIADMM Cc1cccc(OCCCCc2nc(-c3ccc([O-])c(F)c3)no2)c1 ZINC000445481104 1028629411 /nfs/dbraw/zinc/62/94/11/1028629411.db2.gz OKKFRUXVUONHIU-UHFFFAOYSA-N -1 1 342.370 4.291 20 0 EIADMM [O-]c1ccc(-c2noc(-c3ccc(OC4CCC4)cc3)n2)cc1F ZINC000445482378 1028631390 /nfs/dbraw/zinc/63/13/90/1028631390.db2.gz PAKTZNPPLLRILS-UHFFFAOYSA-N -1 1 326.327 4.180 20 0 EIADMM CSc1ccc(O[C@@H](C)c2nc(-c3ccc([O-])c(F)c3)no2)cc1 ZINC000445483708 1028633657 /nfs/dbraw/zinc/63/36/57/1028633657.db2.gz QKUBXQYOMNTLPP-JTQLQIEISA-N -1 1 346.383 4.443 20 0 EIADMM CCOc1cc(C(=O)N[C@H]2C[C@H]2C2CCCCC2)cc(Cl)c1[O-] ZINC000545146389 1028765440 /nfs/dbraw/zinc/76/54/40/1028765440.db2.gz CUQZYBOANLKPKJ-ZFWWWQNUSA-N -1 1 337.847 4.143 20 0 EIADMM COc1cc(-c2nc(-c3ccc(Cl)o3)no2)cc(Cl)c1[O-] ZINC000445595967 1028781308 /nfs/dbraw/zinc/78/13/08/1028781308.db2.gz IUIUBUQZEQACSE-UHFFFAOYSA-N -1 1 327.123 4.018 20 0 EIADMM CC[C@@H](Oc1[n-]c(=S)ncc1F)c1ccc(Br)cc1 ZINC001227382146 1028972041 /nfs/dbraw/zinc/97/20/41/1028972041.db2.gz AZFZNSFQGADZHR-LLVKDONJSA-N -1 1 343.221 4.197 20 0 EIADMM CCOc1cc(-c2nc(-c3cc(C)oc3C)no2)cc(Cl)c1[O-] ZINC000445862499 1028973202 /nfs/dbraw/zinc/97/32/02/1028973202.db2.gz QVBRRJUYIVLPKI-UHFFFAOYSA-N -1 1 334.759 4.371 20 0 EIADMM CC(C)c1ccccc1[N-]S(=O)(=O)c1ccc2ncccc2c1 ZINC000524812804 1029238063 /nfs/dbraw/zinc/23/80/63/1029238063.db2.gz NEKQEANVXUZJJH-UHFFFAOYSA-N -1 1 326.421 4.159 20 0 EIADMM CCOc1ccccc1NC(=O)c1cc(Cl)c([O-])c(OCC)c1 ZINC000192796007 1029389239 /nfs/dbraw/zinc/38/92/39/1029389239.db2.gz DSQHKZLFAOXPLA-UHFFFAOYSA-N -1 1 335.787 4.095 20 0 EIADMM O=C(CSCc1cccc(Cl)c1)Nc1c([O-])cccc1F ZINC000609851136 1029645455 /nfs/dbraw/zinc/64/54/55/1029645455.db2.gz GJUAMKKLJRXTGJ-UHFFFAOYSA-N -1 1 325.792 4.057 20 0 EIADMM Cc1nc(-c2ccc(N[C@@H]3CCCc4ccccc43)nc2)[n-]c(=O)c1C ZINC000301158529 1029678736 /nfs/dbraw/zinc/67/87/36/1029678736.db2.gz DXJWLWHAERCFID-GOSISDBHSA-N -1 1 346.434 4.351 20 0 EIADMM COc1cc(C(=O)N(C)[C@H](C)Cc2ccccc2C)cc(Cl)c1[O-] ZINC000447073540 1029688665 /nfs/dbraw/zinc/68/86/65/1029688665.db2.gz WOEHISHTFGZYEN-CYBMUJFWSA-N -1 1 347.842 4.066 20 0 EIADMM Cc1nc(-c2ccc(NCCCC3CCCC3)nc2)[n-]c(=O)c1C ZINC000301377548 1029719969 /nfs/dbraw/zinc/71/99/69/1029719969.db2.gz SAMCLSQOKREJBC-UHFFFAOYSA-N -1 1 326.444 4.243 20 0 EIADMM Cc1nc(-c2ccc(N(C)CCC3CCCCC3)nc2)[n-]c(=O)c1C ZINC000301393415 1029724458 /nfs/dbraw/zinc/72/44/58/1029724458.db2.gz CIQNCOWGGUVVJK-UHFFFAOYSA-N -1 1 340.471 4.268 20 0 EIADMM Cc1nc(-c2ccc(N[C@H]3C[C@@H]3C3CCCCC3)nc2)[n-]c(=O)c1C ZINC000301429893 1029732287 /nfs/dbraw/zinc/73/22/87/1029732287.db2.gz QDAJWGYTGUBIRW-SJORKVTESA-N -1 1 338.455 4.242 20 0 EIADMM COc1cc(C)cc([N-]S(=O)(=O)c2ccc(Cl)cc2C)c1C ZINC000447273266 1029938906 /nfs/dbraw/zinc/93/89/06/1029938906.db2.gz ZJYWRLMYRLJBBY-UHFFFAOYSA-N -1 1 339.844 4.075 20 0 EIADMM COc1cc(C(=O)N(C)[C@@H](C)C2CCCCC2)cc(Cl)c1[O-] ZINC000447314760 1029983680 /nfs/dbraw/zinc/98/36/80/1029983680.db2.gz GZLDMUMNTVBPEU-NSHDSACASA-N -1 1 325.836 4.095 20 0 EIADMM O=C([O-])c1ccc(F)c2c1CN(CCCc1ccccc1Cl)CC2 ZINC000530167537 1030167511 /nfs/dbraw/zinc/16/75/11/1030167511.db2.gz CFGRELQINVTIAE-UHFFFAOYSA-N -1 1 347.817 4.168 20 0 EIADMM Cc1cc(NC(=O)c2c(F)ccc([O-])c2F)cc(C(F)(F)F)c1 ZINC000685482746 1030360019 /nfs/dbraw/zinc/36/00/19/1030360019.db2.gz LPMNYRFACNTEQF-UHFFFAOYSA-N -1 1 331.240 4.250 20 0 EIADMM Cc1cccc(S(=O)(=O)[N-]c2ccc(OC(F)F)c(Cl)c2)c1 ZINC000612062829 1030840343 /nfs/dbraw/zinc/84/03/43/1030840343.db2.gz ZOEICAIADHYOIP-UHFFFAOYSA-N -1 1 347.770 4.051 20 0 EIADMM Cc1ccccc1[C@H](CC(F)(F)F)NCc1cccc(C(=O)[O-])c1 ZINC000263394410 1030849268 /nfs/dbraw/zinc/84/92/68/1030849268.db2.gz GDMDZYLTHXPNJA-INIZCTEOSA-N -1 1 337.341 4.477 20 0 EIADMM O=C(c1ncc2ccccc2c1[O-])N1CC2(CCCC2)[C@H]1c1ccco1 ZINC000617922291 1031078885 /nfs/dbraw/zinc/07/88/85/1031078885.db2.gz IMUYOWGWKDIQOV-LJQANCHMSA-N -1 1 348.402 4.291 20 0 EIADMM CCC[C@@H](OCC)c1nc(-c2cc(Cl)c([O-])c(OCC)c2)no1 ZINC000528166478 1031199180 /nfs/dbraw/zinc/19/91/80/1031199180.db2.gz LLYWLIJXPFJEQY-GFCCVEGCSA-N -1 1 340.807 4.372 20 0 EIADMM CCCCCOc1ccc(S(=O)(=O)[N-]c2ccc(C)nc2C)cc1 ZINC000531514465 1031322956 /nfs/dbraw/zinc/32/29/56/1031322956.db2.gz BRHLEZKRGUZBEW-UHFFFAOYSA-N -1 1 348.468 4.068 20 0 EIADMM O=C(CSc1cccc(C(F)(F)F)c1)Nc1ccc(F)cc1[O-] ZINC000532622206 1031432164 /nfs/dbraw/zinc/43/21/64/1031432164.db2.gz LKSBPOPDPDTYCI-UHFFFAOYSA-N -1 1 345.317 4.281 20 0 EIADMM Cc1ccc(-c2cnc(CCC(=O)Nc3ccc(F)cc3[O-])o2)cc1 ZINC000532622184 1031433556 /nfs/dbraw/zinc/43/35/56/1031433556.db2.gz JCDVFRVQCDVEFW-UHFFFAOYSA-N -1 1 340.354 4.066 20 0 EIADMM Cc1nc(-c2ccccc2)sc1C(=O)Nc1ccc(F)cc1[O-] ZINC000531756067 1031535589 /nfs/dbraw/zinc/53/55/89/1031535589.db2.gz XETFDVIXJHFKHH-UHFFFAOYSA-N -1 1 328.368 4.216 20 0 EIADMM O=C(CCC(=O)c1csc2ccccc12)Nc1ccc(F)cc1[O-] ZINC000531756345 1031535860 /nfs/dbraw/zinc/53/58/60/1031535860.db2.gz REBOFNFOMNBLJS-UHFFFAOYSA-N -1 1 343.379 4.348 20 0 EIADMM [O-]c1cccc(CN[C@@H]2CCc3cc(F)c(F)c(F)c32)c1Cl ZINC000449589225 1031864116 /nfs/dbraw/zinc/86/41/16/1031864116.db2.gz SANAHOSCUBIZQY-LLVKDONJSA-N -1 1 327.733 4.240 20 0 EIADMM Cc1cccc(-c2nc(CC(=O)Nc3ccc(F)cc3[O-])cs2)c1 ZINC000532012668 1031975942 /nfs/dbraw/zinc/97/59/42/1031975942.db2.gz JSFXEDBJPCLNSJ-UHFFFAOYSA-N -1 1 342.395 4.144 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2c(C)c(F)ccc2Cl)c(F)cc1F ZINC000433135322 1033905545 /nfs/dbraw/zinc/90/55/45/1033905545.db2.gz UICKOLWMCSSVMF-UHFFFAOYSA-N -1 1 349.761 4.175 20 0 EIADMM O=C([N-]c1nnc(-c2cc3ccccc3o2)s1)c1ccoc1Cl ZINC000433877849 1034984302 /nfs/dbraw/zinc/98/43/02/1034984302.db2.gz NURHDEUONXVKLZ-UHFFFAOYSA-N -1 1 345.767 4.450 20 0 EIADMM CCC(C)(C)c1ccc(S(=O)(=O)[N-]c2c(C)ccnc2C)cc1 ZINC000414451138 1035526526 /nfs/dbraw/zinc/52/65/26/1035526526.db2.gz ITAYLUBWJWPONB-UHFFFAOYSA-N -1 1 332.469 4.187 20 0 EIADMM CCOc1cc(-c2noc(COC(C)(C)CC)n2)cc(Cl)c1[O-] ZINC000420490260 1035639382 /nfs/dbraw/zinc/63/93/82/1035639382.db2.gz BPPRYIOBKYMUQA-UHFFFAOYSA-N -1 1 340.807 4.200 20 0 EIADMM CC(C)(C)OCc1cc(-c2nc(-c3ccc([O-])cc3Cl)no2)no1 ZINC000420491795 1035640054 /nfs/dbraw/zinc/64/00/54/1035640054.db2.gz HMDZHHIFGXNDIR-UHFFFAOYSA-N -1 1 349.774 4.066 20 0 EIADMM CSCc1ccccc1[N-]S(=O)(=O)c1c(C)cc(F)cc1C ZINC000485392282 1035855020 /nfs/dbraw/zinc/85/50/20/1035855020.db2.gz FTPISJOCWVSCGL-UHFFFAOYSA-N -1 1 339.457 4.106 20 0 EIADMM O=S(=O)([N-]c1cc(F)ccc1F)c1ccc(Cl)cc1Cl ZINC000485403938 1035862552 /nfs/dbraw/zinc/86/25/52/1035862552.db2.gz KQYAWSFMYWIRLL-UHFFFAOYSA-N -1 1 338.162 4.072 20 0 EIADMM Cc1cccc([N-]S(=O)(=O)c2ccc(Cl)cc2Cl)c1F ZINC000485394178 1035864250 /nfs/dbraw/zinc/86/42/50/1035864250.db2.gz FVGKBRAGFJMJBY-UHFFFAOYSA-N -1 1 334.199 4.242 20 0 EIADMM Cc1cc(C)cc(N(C)C(=O)c2cc(Br)ccc2[O-])c1 ZINC000195711877 1035882364 /nfs/dbraw/zinc/88/23/64/1035882364.db2.gz COAPEGQAPSVVDE-UHFFFAOYSA-N -1 1 334.213 4.048 20 0 EIADMM Cc1cccc(C2=CCN(Cc3ccc(/C=C\C(=O)[O-])o3)CC2)c1C ZINC000905820145 1035919464 /nfs/dbraw/zinc/91/94/64/1035919464.db2.gz PBBFMYYFHXQJCM-HJWRWDBZSA-N -1 1 337.419 4.284 20 0 EIADMM CCOc1cc(-c2noc(CSC(C)C)n2)cc(Cl)c1[O-] ZINC000571863801 1036273409 /nfs/dbraw/zinc/27/34/09/1036273409.db2.gz QJEDRJMIEPBDJB-UHFFFAOYSA-N -1 1 328.821 4.136 20 0 EIADMM CCSCc1cc(C(=O)[N-]c2cccc(F)c2SC)no1 ZINC000597901989 1036382592 /nfs/dbraw/zinc/38/25/92/1036382592.db2.gz JMSIHGDAAWRXRY-UHFFFAOYSA-N -1 1 326.418 4.041 20 0 EIADMM CCC[C@H](C)c1cc([N-]S(=O)(=O)c2ccc(C(F)F)cc2)[nH]n1 ZINC000572199010 1036464811 /nfs/dbraw/zinc/46/48/11/1036464811.db2.gz BBUNTYLDVMLLSJ-JTQLQIEISA-N -1 1 343.399 4.052 20 0 EIADMM CC(C)C(=O)Nc1ccc(NC(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000486165596 1036534035 /nfs/dbraw/zinc/53/40/35/1036534035.db2.gz NIKCQVJZSLLGKJ-UHFFFAOYSA-N -1 1 347.802 4.284 20 0 EIADMM CCCC(=O)Nc1cccc(NC(=O)Nc2ccc([O-])c(Cl)c2)c1 ZINC000486235931 1036584652 /nfs/dbraw/zinc/58/46/52/1036584652.db2.gz RZCAXVVKNHZQPU-UHFFFAOYSA-N -1 1 347.802 4.428 20 0 EIADMM COc1cccc(S(=O)(=O)[N-]c2cccc(-c3cccs3)c2)c1 ZINC000589436372 1036794821 /nfs/dbraw/zinc/79/48/21/1036794821.db2.gz HLYUIOLAVAPDPE-UHFFFAOYSA-N -1 1 345.445 4.225 20 0 EIADMM Cc1cccc([C@@H](C)NC(=O)c2ccc(Br)c([O-])c2)c1C ZINC000486721392 1036828554 /nfs/dbraw/zinc/82/85/54/1036828554.db2.gz CWIFKOYVVUPIHV-GFCCVEGCSA-N -1 1 348.240 4.263 20 0 EIADMM O=C(Nc1cccc(N2CCCC2)c1)Nc1ccc([O-])c(Cl)c1 ZINC000486927275 1036893428 /nfs/dbraw/zinc/89/34/28/1036893428.db2.gz LARFVTBWKVJANT-UHFFFAOYSA-N -1 1 331.803 4.290 20 0 EIADMM O=C(Nc1ccc(OCC(F)F)cc1)Nc1ccc([O-])c(Cl)c1 ZINC000486950553 1036899899 /nfs/dbraw/zinc/89/98/99/1036899899.db2.gz LUFYDTLFALVEPH-UHFFFAOYSA-N -1 1 342.729 4.334 20 0 EIADMM CSCCCCCCC(=O)Nc1cccc([O-])c1Br ZINC000908718286 1036905273 /nfs/dbraw/zinc/90/52/73/1036905273.db2.gz UXXLKLMIMMMERO-UHFFFAOYSA-N -1 1 346.290 4.407 20 0 EIADMM CC(C)(C)C1CC(C(=O)Nc2cccc([O-])c2Br)C1 ZINC000908708242 1036920294 /nfs/dbraw/zinc/92/02/94/1036920294.db2.gz RYIBFBATFZCCBX-UHFFFAOYSA-N -1 1 326.234 4.166 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1cc2cc(Cl)sc2[nH]1 ZINC000486989219 1036939403 /nfs/dbraw/zinc/93/94/03/1036939403.db2.gz SHEUYNLJTVRDDM-UHFFFAOYSA-N -1 1 327.192 4.494 20 0 EIADMM COC(=O)c1cc(NC(=O)Nc2ccc([O-])c(Cl)c2)c(C)cc1C ZINC000487095431 1036991296 /nfs/dbraw/zinc/99/12/96/1036991296.db2.gz CQXNLOQGBFUXAU-UHFFFAOYSA-N -1 1 348.786 4.093 20 0 EIADMM O=C([O-])C[C@@H](NCc1c(Cl)cccc1Cl)c1cccs1 ZINC000037088041 1037001181 /nfs/dbraw/zinc/00/11/81/1037001181.db2.gz NMBJBIAPEXXKHL-GFCCVEGCSA-N -1 1 330.236 4.361 20 0 EIADMM CCS(=O)(=O)c1ccc([O-])c(Nc2cc(F)cc(C)c2Cl)c1 ZINC001214076458 1037008593 /nfs/dbraw/zinc/00/85/93/1037008593.db2.gz UPSXQYDRVFICAG-UHFFFAOYSA-N -1 1 343.807 4.030 20 0 EIADMM O=c1cc(C(F)F)nc(SCc2ccccc2Br)[n-]1 ZINC000573047713 1037242377 /nfs/dbraw/zinc/24/23/77/1037242377.db2.gz YSOQGOGCKSTYLB-UHFFFAOYSA-N -1 1 347.184 4.175 20 0 EIADMM Cc1nc(C(=O)[N-]c2nc(C(C)(C)C)ns2)c(-c2ccccc2)o1 ZINC000273575956 1037513726 /nfs/dbraw/zinc/51/37/26/1037513726.db2.gz FYXSVTBXJNQIKA-UHFFFAOYSA-N -1 1 342.424 4.051 20 0 EIADMM CCN(CCC(=O)[O-])Cc1csc(-c2ccc(C(C)C)cc2)n1 ZINC000573734058 1037679817 /nfs/dbraw/zinc/67/98/17/1037679817.db2.gz QMVAQAHYAQMUMG-UHFFFAOYSA-N -1 1 332.469 4.230 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1cnccc1Oc1ccccc1 ZINC000503725465 1037892752 /nfs/dbraw/zinc/89/27/52/1037892752.db2.gz FTSUJKUOOSWXQW-UHFFFAOYSA-N -1 1 340.766 4.485 20 0 EIADMM CC=Cc1ccc(NC(=O)c2c(C)nc(C(C)(C)C)[n-]c2=O)cc1 ZINC000489967799 1038291468 /nfs/dbraw/zinc/29/14/68/1038291468.db2.gz SGOVCILRFCSUCL-SREVYHEPSA-N -1 1 325.412 4.074 20 0 EIADMM CCOc1cc(-c2noc([C@H]3CCC[C@H](F)C3)n2)cc(Cl)c1[O-] ZINC000424355506 1038820415 /nfs/dbraw/zinc/82/04/15/1038820415.db2.gz JQYSAVSFZBROIA-ONGXEEELSA-N -1 1 340.782 4.490 20 0 EIADMM O=C(NCc1ccc([O-])c(Cl)c1)[C@H](c1ccncc1)C1CCCC1 ZINC000899192684 1038860551 /nfs/dbraw/zinc/86/05/51/1038860551.db2.gz MRCKTEULOXNLNN-SFHVURJKSA-N -1 1 344.842 4.031 20 0 EIADMM Cc1cccc([N-]S(=O)(=O)c2ccc3c(cnn3C(C)C)c2)c1C ZINC000476500243 1038875783 /nfs/dbraw/zinc/87/57/83/1038875783.db2.gz SDWQPJPZAKGLTE-UHFFFAOYSA-N -1 1 343.452 4.035 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N(Cc1ccco1)CC(F)(F)F ZINC000120327209 1039086041 /nfs/dbraw/zinc/08/60/41/1039086041.db2.gz ATLGZASPFFSMKW-UHFFFAOYSA-N -1 1 349.308 4.343 20 0 EIADMM C[C@@H]1C[C@@H]1c1ccc([C@H]2C[C@H]2C(=O)Nc2ccc([O-])c(F)c2F)o1 ZINC000456793745 1039611323 /nfs/dbraw/zinc/61/13/23/1039611323.db2.gz OGOHNSVZJATQBM-VPOLOUISSA-N -1 1 333.334 4.129 20 0 EIADMM O=C(Nc1ccc([O-])c(F)c1F)[C@H](OC1CCCC1)c1ccccc1 ZINC000456795869 1039613797 /nfs/dbraw/zinc/61/37/97/1039613797.db2.gz VKMSJXDCWFZDID-GOSISDBHSA-N -1 1 347.361 4.309 20 0 EIADMM COc1cc(C(=O)Nc2cccc(C(F)(F)F)c2)cc(Cl)c1[O-] ZINC000476623479 1039806786 /nfs/dbraw/zinc/80/67/86/1039806786.db2.gz HPEBBSAUOGKCDK-UHFFFAOYSA-N -1 1 345.704 4.325 20 0 EIADMM Cc1cc(-c2nc(-c3ccc([O-])cc3Cl)no2)nn1[C@@H](C)C1CC1 ZINC000556002686 1039856934 /nfs/dbraw/zinc/85/69/34/1039856934.db2.gz ISUSBFPMOFONFV-JTQLQIEISA-N -1 1 344.802 4.239 20 0 EIADMM C[C@H](N=c1ccc(N2CCC[C@@H]2c2ccco2)n[n-]1)c1ccccc1 ZINC000425230657 1039889404 /nfs/dbraw/zinc/88/94/04/1039889404.db2.gz RMPUFPCTKBYRHK-DOTOQJQBSA-N -1 1 334.423 4.006 20 0 EIADMM CCC1(CC)CCC(NC(=O)c2c(C)nc(C(C)(C)C)[n-]c2=O)CC1 ZINC000476840449 1039964398 /nfs/dbraw/zinc/96/43/98/1039964398.db2.gz FEWBXXRDBTUTPU-UHFFFAOYSA-N -1 1 347.503 4.267 20 0 EIADMM CCc1ccc(S(=O)(=O)[N-]c2ccnc(-c3ccccc3)c2)cc1 ZINC000479318775 1040267838 /nfs/dbraw/zinc/26/78/38/1040267838.db2.gz SZAFBJDAHCZKAV-UHFFFAOYSA-N -1 1 338.432 4.112 20 0 EIADMM O=C(Nc1nc(-c2ccncc2)cs1)c1ccc2ccccc2c1[O-] ZINC000669821637 1040391705 /nfs/dbraw/zinc/39/17/05/1040391705.db2.gz AUWQGTGPCJJAQS-UHFFFAOYSA-N -1 1 347.399 4.316 20 0 EIADMM Cc1coc2ccc([N-]S(=O)(=O)c3ccc4ncsc4c3)cc12 ZINC000479562253 1040475799 /nfs/dbraw/zinc/47/57/99/1040475799.db2.gz IRFWUQRZOMDXCR-UHFFFAOYSA-N -1 1 344.417 4.152 20 0 EIADMM Cc1nc(-c2ccc(N[C@@H](C)c3ccsc3)nc2)[n-]c(=O)c1C ZINC000669826965 1040479025 /nfs/dbraw/zinc/47/90/25/1040479025.db2.gz AGJFLRWHCIKFIE-LBPRGKRZSA-N -1 1 326.425 4.096 20 0 EIADMM Cc1oc(-c2ccccc2)nc1-c1nc(-c2ccc([O-])cc2F)no1 ZINC000445454953 1040795957 /nfs/dbraw/zinc/79/59/57/1040795957.db2.gz BOCJYAXRTKMSNQ-UHFFFAOYSA-N -1 1 337.310 4.212 20 0 EIADMM O=C(CCc1cncc2ccccc21)Nc1ccc([O-])c(Cl)c1 ZINC000462779469 1040916664 /nfs/dbraw/zinc/91/66/64/1040916664.db2.gz UGXSTJUCSBKESD-UHFFFAOYSA-N -1 1 326.783 4.165 20 0 EIADMM O=C([O-])c1csc(CN2CCC[C@@H](CCCc3ccccc3)C2)n1 ZINC000515660320 1040962802 /nfs/dbraw/zinc/96/28/02/1040962802.db2.gz WAJIVYLPIZNXQE-MRXNPFEDSA-N -1 1 344.480 4.076 20 0 EIADMM CO[C@@H](C)c1cccc([N-]S(=O)(=O)c2ccccc2C(C)(C)C)c1 ZINC000460830599 1040991798 /nfs/dbraw/zinc/99/17/98/1040991798.db2.gz PKMCRCFQABBZBP-AWEZNQCLSA-N -1 1 347.480 4.492 20 0 EIADMM CCc1cc(=O)[n-]c(SCCOc2cc(Cl)cc(Cl)c2)n1 ZINC000436256089 1041012079 /nfs/dbraw/zinc/01/20/79/1041012079.db2.gz XPFBSCORBYYFLB-UHFFFAOYSA-N -1 1 345.251 4.223 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2ccc(CC(F)(F)F)cc2)cc1C ZINC000480209067 1041081822 /nfs/dbraw/zinc/08/18/22/1041081822.db2.gz LGZDEMTXTPMOOS-UHFFFAOYSA-N -1 1 343.370 4.209 20 0 EIADMM Cc1cc(N2CCCC[C@H]2C)ccc1NC(=O)c1ccc(O)cc1[O-] ZINC000163416586 1041112684 /nfs/dbraw/zinc/11/26/84/1041112684.db2.gz LAMGKEZBDJYBIT-CQSZACIVSA-N -1 1 340.423 4.037 20 0 EIADMM CC(C)c1cccc(NC(=O)c2nc[n-]c2C(=O)c2ccccc2)c1 ZINC000484252704 1041176350 /nfs/dbraw/zinc/17/63/50/1041176350.db2.gz BSDIJIFHPAWSDB-UHFFFAOYSA-N -1 1 333.391 4.016 20 0 EIADMM CC1(C)C[C@@H](c2ccccc2)N(Cc2nc(=O)c3sccc3[n-]2)C1 ZINC000425546215 1041237743 /nfs/dbraw/zinc/23/77/43/1041237743.db2.gz SUJYUKXMYLTZDY-HNNXBMFYSA-N -1 1 339.464 4.370 20 0 EIADMM CSc1ccc(C)c([N-]S(=O)(=O)c2cccc(Cl)c2)c1 ZINC000538295546 1041248550 /nfs/dbraw/zinc/24/85/50/1041248550.db2.gz CCUHRIUPOVYRCG-UHFFFAOYSA-N -1 1 327.858 4.171 20 0 EIADMM C=Cc1ccc(S(=O)(=O)[N-]c2ccc(-c3cnc(C)o3)cc2)cc1 ZINC000436478987 1041266156 /nfs/dbraw/zinc/26/61/56/1041266156.db2.gz PAAFIXXJTHYUTP-UHFFFAOYSA-N -1 1 340.404 4.094 20 0 EIADMM Cc1ccccc1[C@@]1(F)CCN(C(=O)c2ccc(Cl)cc2[O-])C1 ZINC000436513143 1041299626 /nfs/dbraw/zinc/29/96/26/1041299626.db2.gz LMRGQHIYGHXELL-GOSISDBHSA-N -1 1 333.790 4.065 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cnc4c(F)ccc(F)c4c3)n2)c(F)c1 ZINC000436521352 1041304235 /nfs/dbraw/zinc/30/42/35/1041304235.db2.gz MBOCWZGGXODTLX-UHFFFAOYSA-N -1 1 343.264 4.075 20 0 EIADMM C[C@@H](NC(=O)c1ccc(Cl)cc1[O-])c1ncc(-c2ccccc2)o1 ZINC000436531873 1041314756 /nfs/dbraw/zinc/31/47/56/1041314756.db2.gz QDNSKSHUZGGVQE-LLVKDONJSA-N -1 1 342.782 4.192 20 0 EIADMM O=C(c1cc(Cl)ccc1[O-])N1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000436554313 1041329383 /nfs/dbraw/zinc/32/93/83/1041329383.db2.gz KCVCREOSVHSWLL-LBPRGKRZSA-N -1 1 336.218 4.329 20 0 EIADMM COCCN(C(=O)c1cc2ccccc2cc1[O-])[C@@H](C)c1ccccc1 ZINC000436541441 1041336015 /nfs/dbraw/zinc/33/60/15/1041336015.db2.gz XKNFMDNZDFDMED-INIZCTEOSA-N -1 1 349.430 4.395 20 0 EIADMM C[C@@H]1CN(C(=O)c2cc3ccccc3cc2[O-])[C@@H](c2ccccc2)CO1 ZINC000436575119 1041337378 /nfs/dbraw/zinc/33/73/78/1041337378.db2.gz NNSKGIGTOYMSKF-FOIQADDNSA-N -1 1 347.414 4.148 20 0 EIADMM Cn1cccc1[C@@H]1CCCCN1C(=O)c1cc2ccccc2cc1[O-] ZINC000436576847 1041341408 /nfs/dbraw/zinc/34/14/08/1041341408.db2.gz RNIPATSSMZWKAQ-IBGZPJMESA-N -1 1 334.419 4.251 20 0 EIADMM Cc1ccc(C(C)(C)CN(C)C(=O)c2cc(Cl)ccc2[O-])cc1 ZINC000436565800 1041345644 /nfs/dbraw/zinc/34/56/44/1041345644.db2.gz JPEXDKVSTTWVEU-UHFFFAOYSA-N -1 1 331.843 4.404 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1Cc2ccccc2C2(CC2)C1 ZINC000436567436 1041347159 /nfs/dbraw/zinc/34/71/59/1041347159.db2.gz XLFJNFSTJZEHME-UHFFFAOYSA-N -1 1 329.399 4.233 20 0 EIADMM C[C@H](c1ccc(Cl)cc1)[C@H](C)N(C)C(=O)c1cc(F)ccc1[O-] ZINC000436573108 1041351367 /nfs/dbraw/zinc/35/13/67/1041351367.db2.gz GZWBCOSXEQWLAE-RYUDHWBXSA-N -1 1 335.806 4.449 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1CCc2c(F)ccc(F)c2C1 ZINC000436591250 1041351458 /nfs/dbraw/zinc/35/14/58/1041351458.db2.gz WFQKIRSGKLHRSB-UHFFFAOYSA-N -1 1 339.341 4.022 20 0 EIADMM O=C(c1ccc(Br)cc1[O-])N1CCCC12CCCCC2 ZINC000436598889 1041354501 /nfs/dbraw/zinc/35/45/01/1041354501.db2.gz BYIZJMLLMFBSME-UHFFFAOYSA-N -1 1 338.245 4.094 20 0 EIADMM COc1cc(F)c(NC(=O)c2ccc3ccccc3c2[O-])cc1F ZINC000436585898 1041360542 /nfs/dbraw/zinc/36/05/42/1041360542.db2.gz KQEDNXGACSKURJ-UHFFFAOYSA-N -1 1 329.302 4.085 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N(Cc1ccco1)Cc1ccccc1 ZINC000436605881 1041368625 /nfs/dbraw/zinc/36/86/25/1041368625.db2.gz MBWNQDQCXCECGV-UHFFFAOYSA-N -1 1 341.794 4.481 20 0 EIADMM CCCCCN(CCCOC)C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436627140 1041379886 /nfs/dbraw/zinc/37/98/86/1041379886.db2.gz NSLTZPNLESDOTL-UHFFFAOYSA-N -1 1 347.377 4.080 20 0 EIADMM Cc1oc(-c2cccs2)nc1CSc1nc(C)c(C)c(=O)[n-]1 ZINC000538515988 1041400410 /nfs/dbraw/zinc/40/04/10/1041400410.db2.gz AYPZYNXOZZDNIF-UHFFFAOYSA-N -1 1 333.438 4.116 20 0 EIADMM [O-]c1ccc(-c2nc(-c3ccc(Oc4ccccc4)nc3)no2)c(F)c1 ZINC000436685490 1041421901 /nfs/dbraw/zinc/42/19/01/1041421901.db2.gz BDPNZAIODXNNTQ-UHFFFAOYSA-N -1 1 349.321 4.436 20 0 EIADMM COc1ccc(C(=O)N2CCc3c2cccc3-c2ccccc2)c([O-])c1 ZINC000436695267 1041427365 /nfs/dbraw/zinc/42/73/65/1041427365.db2.gz FMZWTXVCVGSJKQ-UHFFFAOYSA-N -1 1 345.398 4.271 20 0 EIADMM O=C(C(=O)N1CCCCC[C@H]1/C=C/c1ccccc1)c1ccc([O-])cc1 ZINC000436704457 1041433844 /nfs/dbraw/zinc/43/38/44/1041433844.db2.gz PBYMNVYKUDGSQV-QHSLDKKCSA-N -1 1 349.430 4.060 20 0 EIADMM CC(C)c1cc(C(=O)Nc2ccc(Cl)cc2[O-])nn1C(C)(C)C ZINC000436735614 1041445815 /nfs/dbraw/zinc/44/58/15/1041445815.db2.gz DTPMUHMMMABXTR-UHFFFAOYSA-N -1 1 335.835 4.373 20 0 EIADMM Cc1cc(F)ccc1CN(C)C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436736637 1041446794 /nfs/dbraw/zinc/44/67/94/1041446794.db2.gz JKYZZWXRQAHZIK-UHFFFAOYSA-N -1 1 341.304 4.131 20 0 EIADMM O=C(N[C@@H]1CCCc2sc(Cl)cc21)c1ccc([O-])cc1F ZINC000436738705 1041447855 /nfs/dbraw/zinc/44/78/55/1041447855.db2.gz OTMRGKUOEQQRAM-GFCCVEGCSA-N -1 1 325.792 4.054 20 0 EIADMM CCc1cc(=O)[n-]c(S[C@H](C)c2ccc(C(F)(F)F)cc2)n1 ZINC000195063378 1041457692 /nfs/dbraw/zinc/45/76/92/1041457692.db2.gz FWENTLIHXNCOCN-SECBINFHSA-N -1 1 328.359 4.204 20 0 EIADMM CCc1cc(=O)[n-]c(S[C@@H](C)c2ccc(C(F)(F)F)cc2)n1 ZINC000195063356 1041457969 /nfs/dbraw/zinc/45/79/69/1041457969.db2.gz FWENTLIHXNCOCN-VIFPVBQESA-N -1 1 328.359 4.204 20 0 EIADMM O=C(c1ccc(C(F)(F)F)cc1[O-])N1CCC[C@H]1c1ccsc1 ZINC000436762229 1041460001 /nfs/dbraw/zinc/46/00/01/1041460001.db2.gz DEXLAPMXDRMIHO-ZDUSSCGKSA-N -1 1 341.354 4.450 20 0 EIADMM C[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436752414 1041465775 /nfs/dbraw/zinc/46/57/75/1041465775.db2.gz RJJZWEMMSGEYMS-SUNKGSAMSA-N -1 1 327.346 4.204 20 0 EIADMM CC[C@]1(C(=O)[O-])CCCN(Cc2c(Cl)cccc2OC(F)F)C1 ZINC000904400476 1041467850 /nfs/dbraw/zinc/46/78/50/1041467850.db2.gz HWPPYGBTRDHJKC-INIZCTEOSA-N -1 1 347.789 4.018 20 0 EIADMM Cn1cc(NC(=O)c2cc3ccccc3cc2[O-])c(-c2ccccc2)n1 ZINC000436815199 1041494287 /nfs/dbraw/zinc/49/42/87/1041494287.db2.gz NMXIEUGBUIEJHT-UHFFFAOYSA-N -1 1 343.386 4.198 20 0 EIADMM CC1(C)CN(C(=O)c2ccc3ccccc3c2[O-])[C@@H]1c1cccnc1 ZINC000436840079 1041509399 /nfs/dbraw/zinc/50/93/99/1041509399.db2.gz VPRPYHVFTSEKRK-LJQANCHMSA-N -1 1 332.403 4.164 20 0 EIADMM O=C(c1ccc([O-])cc1F)N1CCC([C@H](F)c2ccccc2F)CC1 ZINC000436842359 1041511234 /nfs/dbraw/zinc/51/12/34/1041511234.db2.gz DBMQEEMLXKZKKV-SFHVURJKSA-N -1 1 349.352 4.233 20 0 EIADMM Cc1ccc([C@@H]2CCN(C(=O)c3ccc(Cl)cc3[O-])C2)c(C)c1 ZINC000436848541 1041514919 /nfs/dbraw/zinc/51/49/19/1041514919.db2.gz AKULUSAKGWTIJC-CQSZACIVSA-N -1 1 329.827 4.292 20 0 EIADMM COc1ccc(CN(C(=O)c2ccc3ccccc3c2[O-])C2CC2)cc1 ZINC000436860289 1041519894 /nfs/dbraw/zinc/51/98/94/1041519894.db2.gz NWGZMDJDVFQULS-UHFFFAOYSA-N -1 1 347.414 4.359 20 0 EIADMM CCOc1cc(-c2noc(-c3nc(CC)oc3C)n2)cc(Cl)c1[O-] ZINC000436867189 1041526038 /nfs/dbraw/zinc/52/60/38/1041526038.db2.gz BDYXAHONLSPUSE-UHFFFAOYSA-N -1 1 349.774 4.020 20 0 EIADMM O=C(c1cc(Cl)ccc1[O-])N1CC=C(c2c(F)cccc2F)CC1 ZINC000436868693 1041528729 /nfs/dbraw/zinc/52/87/29/1041528729.db2.gz IADVQJXFFMZWCZ-UHFFFAOYSA-N -1 1 349.764 4.253 20 0 EIADMM CC(=O)Nc1ccc(C)c(-c2nc(-c3ccc([O-])cc3Cl)no2)c1 ZINC000436870690 1041530398 /nfs/dbraw/zinc/53/03/98/1041530398.db2.gz HZINZVDKSXFBAY-UHFFFAOYSA-N -1 1 343.770 4.029 20 0 EIADMM C[C@H](Cn1ccc2ccccc21)c1nc(-c2ccc([O-])cc2F)no1 ZINC000436881660 1041539353 /nfs/dbraw/zinc/53/93/53/1041539353.db2.gz XUIREQRIYCOWCN-GFCCVEGCSA-N -1 1 337.354 4.340 20 0 EIADMM Cc1ccc(F)cc1C1(c2noc(-c3cc(F)ccc3[O-])n2)CC1 ZINC000436888656 1041543854 /nfs/dbraw/zinc/54/38/54/1041543854.db2.gz VIWQROAIRINVBV-UHFFFAOYSA-N -1 1 328.318 4.109 20 0 EIADMM COc1ccc(-c2nc(-c3ccc(C(F)(F)F)cc3)no2)c([O-])c1 ZINC000436890471 1041545591 /nfs/dbraw/zinc/54/55/91/1041545591.db2.gz BXAVHKLMUIVSFM-UHFFFAOYSA-N -1 1 336.269 4.137 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1CC[C@@H](COc2ccccc2)C1 ZINC000436918977 1041557994 /nfs/dbraw/zinc/55/79/94/1041557994.db2.gz LLWWGXWANKXRIK-MRXNPFEDSA-N -1 1 347.414 4.087 20 0 EIADMM CC[C@H](C(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)c1ccc(F)cc1 ZINC000461697972 1041560473 /nfs/dbraw/zinc/56/04/73/1041560473.db2.gz IVUKFSUBIVGPTE-INIZCTEOSA-N -1 1 339.370 4.054 20 0 EIADMM CCC(C)(C)OCc1ccccc1NC(=O)c1ccc(OC)cc1[O-] ZINC000436942451 1041568784 /nfs/dbraw/zinc/56/87/84/1041568784.db2.gz VUTJEABKGOVZPV-UHFFFAOYSA-N -1 1 343.423 4.358 20 0 EIADMM CCC[C@H](C)[C@@H]1CCCN1C(=O)c1cc(Cl)c([O-])c(OCC)c1 ZINC000436963347 1041571762 /nfs/dbraw/zinc/57/17/62/1041571762.db2.gz CBFXQMVSRDUGHS-WFASDCNBSA-N -1 1 339.863 4.485 20 0 EIADMM CCOc1cc(-c2nc(C(CC)(CC)OC)no2)cc(Cl)c1[O-] ZINC000436951566 1041573749 /nfs/dbraw/zinc/57/37/49/1041573749.db2.gz GBVJJQZSGQAYJF-UHFFFAOYSA-N -1 1 340.807 4.156 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1CC=C(c2ccccc2F)C1 ZINC000436958717 1041576596 /nfs/dbraw/zinc/57/65/96/1041576596.db2.gz JLELHJWWXZYJQC-UHFFFAOYSA-N -1 1 333.362 4.224 20 0 EIADMM O=C(N[C@@H](CC1CCCC1)c1ccccc1)C(=O)c1ccc([O-])cc1 ZINC000436968512 1041581903 /nfs/dbraw/zinc/58/19/03/1041581903.db2.gz VTODSRKPUANQQV-IBGZPJMESA-N -1 1 337.419 4.013 20 0 EIADMM O=C(c1ccc([O-])cc1F)N1CCC(c2ccc(Cl)cc2)CC1 ZINC000436986930 1041582139 /nfs/dbraw/zinc/58/21/39/1041582139.db2.gz KUJQAGNKWPVRBE-UHFFFAOYSA-N -1 1 333.790 4.205 20 0 EIADMM COc1cc(-c2noc(-c3cc(F)ccc3[O-])n2)ccc1OC(C)C ZINC000436997670 1041586219 /nfs/dbraw/zinc/58/62/19/1041586219.db2.gz GWFSTSMYQQTPET-UHFFFAOYSA-N -1 1 344.342 4.044 20 0 EIADMM CN(Cc1cc(F)cc(F)c1)C(=O)c1ccc2ccccc2c1[O-] ZINC000437007058 1041590711 /nfs/dbraw/zinc/59/07/11/1041590711.db2.gz XNYFKIVCHNFYCJ-UHFFFAOYSA-N -1 1 327.330 4.096 20 0 EIADMM Cc1csc(-c2cccc([N-]S(=O)(=O)c3ccccc3C)c2)n1 ZINC000516751443 1041732046 /nfs/dbraw/zinc/73/20/46/1041732046.db2.gz CZJZDRWVNONQQM-UHFFFAOYSA-N -1 1 344.461 4.228 20 0 EIADMM O=C(COc1c(Cl)cccc1Cl)Nc1ccc([O-])c(Cl)c1 ZINC000541888247 1042157045 /nfs/dbraw/zinc/15/70/45/1042157045.db2.gz UOLUUMJDYUJJBP-UHFFFAOYSA-N -1 1 346.597 4.370 20 0 EIADMM Cc1cccc([N-]S(=O)(=O)c2ccc(C)c(C(F)(F)F)c2)c1C ZINC000303064143 1042280112 /nfs/dbraw/zinc/28/01/12/1042280112.db2.gz ZFJOXXQPHPHXPX-UHFFFAOYSA-N -1 1 343.370 4.431 20 0 EIADMM CC[C@H](C)Oc1ccc([N-]S(=O)(=O)c2cccc(F)c2C)cc1 ZINC000438793319 1042352236 /nfs/dbraw/zinc/35/22/36/1042352236.db2.gz PHWQIIJZGQQXAJ-LBPRGKRZSA-N -1 1 337.416 4.112 20 0 EIADMM COc1cc(C(=O)N(C)c2ccccc2C(C)C)cc(Cl)c1[O-] ZINC000426177315 1042371925 /nfs/dbraw/zinc/37/19/25/1042371925.db2.gz DYFSSRPSAIICKX-UHFFFAOYSA-N -1 1 333.815 4.454 20 0 EIADMM CCC[C@H](C)[C@H]1CCCN1C(=O)c1ccc(Br)c([O-])c1 ZINC000492031907 1042538039 /nfs/dbraw/zinc/53/80/39/1042538039.db2.gz DMZIKZWOEBNQAU-SMDDNHRTSA-N -1 1 340.261 4.196 20 0 EIADMM CCC[C@H](C)[C@@H]1CCCN1C(=O)c1ccc(Br)c([O-])c1 ZINC000492031905 1042538611 /nfs/dbraw/zinc/53/86/11/1042538611.db2.gz DMZIKZWOEBNQAU-FZMZJTMJSA-N -1 1 340.261 4.196 20 0 EIADMM O=S(=O)([N-]c1ccc(Cl)cc1F)c1csc2ccccc21 ZINC000506552525 1042597852 /nfs/dbraw/zinc/59/78/52/1042597852.db2.gz JZNUZUCCMLISPJ-UHFFFAOYSA-N -1 1 341.816 4.495 20 0 EIADMM O=S(=O)([N-]c1ccc2c[nH]nc2c1)c1cccc(-c2ccccc2)c1 ZINC000506597621 1042662329 /nfs/dbraw/zinc/66/23/29/1042662329.db2.gz ZUKBTYUKCMGQIU-UHFFFAOYSA-N -1 1 349.415 4.031 20 0 EIADMM O=S(=O)([N-]c1cc(F)c(F)cc1F)c1csc2ccccc21 ZINC000506610583 1042682822 /nfs/dbraw/zinc/68/28/22/1042682822.db2.gz IZMUYVAKYYHWBI-UHFFFAOYSA-N -1 1 343.351 4.119 20 0 EIADMM Cc1cnc(C(=O)N(C)[C@@H](C)c2ccc(Cl)c(Cl)c2)c([O-])c1 ZINC000426452014 1042719868 /nfs/dbraw/zinc/71/98/68/1042719868.db2.gz UEMLDVWFGALLRP-JTQLQIEISA-N -1 1 339.222 4.236 20 0 EIADMM CCCOc1ccc(F)cc1Nc1cc2ccc([O-])cc2oc1=O ZINC001212197929 1042757685 /nfs/dbraw/zinc/75/76/85/1042757685.db2.gz KQZREJYFPQFHQR-UHFFFAOYSA-N -1 1 329.327 4.170 20 0 EIADMM CC(=O)Nc1ccc([O-])c(-c2nc(-c3cccc(C(F)F)c3)no2)c1 ZINC000350943628 1042781370 /nfs/dbraw/zinc/78/13/70/1042781370.db2.gz XZNMQOLZXNHOLS-UHFFFAOYSA-N -1 1 345.305 4.005 20 0 EIADMM O=C(Nc1nc(-c2ccccn2)cs1)c1cc2ccccc2cc1[O-] ZINC000006969724 1042915897 /nfs/dbraw/zinc/91/58/97/1042915897.db2.gz FCRAYDQZSSSZHX-UHFFFAOYSA-N -1 1 347.399 4.316 20 0 EIADMM C[C@H](c1ccc(Cl)c(Cl)c1)N1CCC2(C[C@H]2C(=O)[O-])CC1 ZINC000405359314 1042953367 /nfs/dbraw/zinc/95/33/67/1042953367.db2.gz NBSFLEINEZKZQO-PWSUYJOCSA-N -1 1 328.239 4.241 20 0 EIADMM Cc1c(F)cccc1-c1ccc(CN[C@H](CC2CCC2)C(=O)[O-])o1 ZINC000417698238 1042982206 /nfs/dbraw/zinc/98/22/06/1042982206.db2.gz GCAFMLBCTAZIFL-QGZVFWFLSA-N -1 1 331.387 4.127 20 0 EIADMM Cc1c(F)cccc1-c1ccc(CN[C@@H](CC2CCC2)C(=O)[O-])o1 ZINC000417698237 1042983210 /nfs/dbraw/zinc/98/32/10/1042983210.db2.gz GCAFMLBCTAZIFL-KRWDZBQOSA-N -1 1 331.387 4.127 20 0 EIADMM Cc1ccc(C)c(S(=O)(=O)[N-]c2ccc3oc(C(C)C)nc3c2)c1 ZINC000032097626 1043021521 /nfs/dbraw/zinc/02/15/21/1043021521.db2.gz XFCNRGCSLCFNKU-UHFFFAOYSA-N -1 1 344.436 4.369 20 0 EIADMM CCOc1cc(C(=O)N[C@H](C)CCc2ccccc2)cc(Cl)c1[O-] ZINC000215949754 1043200261 /nfs/dbraw/zinc/20/02/61/1043200261.db2.gz ACXROJCEDKPIJE-CYBMUJFWSA-N -1 1 347.842 4.195 20 0 EIADMM O=S(=O)(/C=C\c1ccccc1Cl)[N-]c1cccc2cccnc21 ZINC000727352776 1043204310 /nfs/dbraw/zinc/20/43/10/1043204310.db2.gz KNLBCKRMOIIAIX-BENRWUELSA-N -1 1 344.823 4.301 20 0 EIADMM CC[C@@H](Oc1ccccc1Cl)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000509181516 1043224290 /nfs/dbraw/zinc/22/42/90/1043224290.db2.gz GTXXSXWSKJFRKK-CQSZACIVSA-N -1 1 340.206 4.495 20 0 EIADMM C[C@H](CC(=O)Nc1ccc([O-])c(Cl)c1)c1ccc(F)cc1F ZINC000509183327 1043234005 /nfs/dbraw/zinc/23/40/05/1043234005.db2.gz JXSQWSRGPVTIIK-SECBINFHSA-N -1 1 325.742 4.456 20 0 EIADMM CC(C)c1cccc([N-]S(=O)(=O)c2cccc3ncccc32)c1 ZINC000508037470 1043247314 /nfs/dbraw/zinc/24/73/14/1043247314.db2.gz TUDOWPICDLDBQS-UHFFFAOYSA-N -1 1 326.421 4.159 20 0 EIADMM COCC1(c2noc(-c3ccc4ccccc4c3[O-])n2)CCCCC1 ZINC000521124100 1043559158 /nfs/dbraw/zinc/55/91/58/1043559158.db2.gz UBPVHMSTTOGRNP-UHFFFAOYSA-N -1 1 338.407 4.444 20 0 EIADMM O=S(=O)([N-]c1cc(Cl)cc(F)c1F)c1ccccc1Cl ZINC000442253244 1043585717 /nfs/dbraw/zinc/58/57/17/1043585717.db2.gz VDFDQXWHDJLCBL-UHFFFAOYSA-N -1 1 338.162 4.072 20 0 EIADMM Cc1ccc(-c2nsc([N-]C(=O)c3ccc(Cl)o3)n2)s1 ZINC000066413232 1043688611 /nfs/dbraw/zinc/68/86/11/1043688611.db2.gz JMQOCNAZGITHDU-UHFFFAOYSA-N -1 1 325.802 4.074 20 0 EIADMM O=C(/C=C/c1ccc(Br)o1)Nc1ccc([O-])c(Cl)c1 ZINC000701130710 1043700658 /nfs/dbraw/zinc/70/06/58/1043700658.db2.gz IRWBISRNZHNICX-ZZXKWVIFSA-N -1 1 342.576 4.053 20 0 EIADMM Cc1cnc(-c2cccc([N-]S(=O)(=O)c3ccc(C)c(C)c3)c2)o1 ZINC000066814803 1043813191 /nfs/dbraw/zinc/81/31/91/1043813191.db2.gz IJJKZRSXGZVXQR-UHFFFAOYSA-N -1 1 342.420 4.068 20 0 EIADMM O=C(Nc1cc(-c2ccccc2)on1)Nc1ccc([O-])c(Cl)c1 ZINC000192221647 1043893744 /nfs/dbraw/zinc/89/37/44/1043893744.db2.gz BZDAMLXXMLFYPG-UHFFFAOYSA-N -1 1 329.743 4.345 20 0 EIADMM COc1cc(C(=O)N(CC(C)C)C2CCCC2)cc(Cl)c1[O-] ZINC000442951043 1043898779 /nfs/dbraw/zinc/89/87/79/1043898779.db2.gz MXVJKJOLZPITMZ-UHFFFAOYSA-N -1 1 325.836 4.095 20 0 EIADMM Cc1ccc(-n2cccn2)cc1NC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000192315588 1043905468 /nfs/dbraw/zinc/90/54/68/1043905468.db2.gz RJDRCOZQBCCSEB-UHFFFAOYSA-N -1 1 342.786 4.184 20 0 EIADMM CC[C@@H](C)[C@H]1CCCCN1C(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC000442961386 1043922170 /nfs/dbraw/zinc/92/21/70/1043922170.db2.gz FETPIZPUACJIPB-BXUZGUMPSA-N -1 1 325.836 4.095 20 0 EIADMM COc1cc(C(=O)N[C@H](c2ccccc2C)C2CC2)cc(Cl)c1[O-] ZINC000442982556 1043947329 /nfs/dbraw/zinc/94/73/29/1043947329.db2.gz YAZMSCOPNRBABM-KRWDZBQOSA-N -1 1 345.826 4.244 20 0 EIADMM COc1cc(C(=O)Nc2cccc3ccc(O)cc32)cc(Cl)c1[O-] ZINC000443043333 1043977771 /nfs/dbraw/zinc/97/77/71/1043977771.db2.gz ALMNFQXQKMRQPX-UHFFFAOYSA-N -1 1 343.766 4.165 20 0 EIADMM COc1cc(C(=O)N[C@@H]2c3ccccc3CC[C@H]2C)cc(Cl)c1[O-] ZINC000443059157 1043982343 /nfs/dbraw/zinc/98/23/43/1043982343.db2.gz BNSOHMLNQHQPCH-DIFFPNOSSA-N -1 1 345.826 4.108 20 0 EIADMM Cc1nc(C(C)(C)C)[n-]c(=O)c1C(=O)N1CCC(C)(CC(C)C)CC1 ZINC000494739657 1043987366 /nfs/dbraw/zinc/98/73/66/1043987366.db2.gz XSEQLCGNUNDLAU-UHFFFAOYSA-N -1 1 347.503 4.077 20 0 EIADMM COc1cc(C(=O)N2CCCC[C@@H]2CCC(C)C)cc(Cl)c1[O-] ZINC000443066891 1043988571 /nfs/dbraw/zinc/98/85/71/1043988571.db2.gz FUAWXSGESCIWQP-CQSZACIVSA-N -1 1 339.863 4.485 20 0 EIADMM C[C@H](c1cc(F)ccc1F)N1CCC(C(=O)c2ccc([O-])cc2)CC1 ZINC000079877918 1044029277 /nfs/dbraw/zinc/02/92/77/1044029277.db2.gz CJRKJNAKRXVMGK-CYBMUJFWSA-N -1 1 345.389 4.326 20 0 EIADMM CCOc1cc(C(=O)N(C)[C@@H]2CCc3ccccc32)cc(Cl)c1[O-] ZINC000193273423 1044029482 /nfs/dbraw/zinc/02/94/82/1044029482.db2.gz SLRSPILKWNRZDC-MRXNPFEDSA-N -1 1 345.826 4.204 20 0 EIADMM CCc1ccc(S(=O)(=O)[N-]c2ccc(-c3ccccn3)cc2)cc1 ZINC000521948070 1044085751 /nfs/dbraw/zinc/08/57/51/1044085751.db2.gz URJDJBHWWYNEHO-UHFFFAOYSA-N -1 1 338.432 4.112 20 0 EIADMM C[C@@H](NC(=O)c1ccc([O-])cc1F)c1ccc(Cl)cc1Cl ZINC000226266859 1044100060 /nfs/dbraw/zinc/10/00/60/1044100060.db2.gz OGNGCIGPEOLQPV-MRVPVSSYSA-N -1 1 328.170 4.329 20 0 EIADMM C[C@H]1CCCCC[N@H+]1Cc1csc(-c2cccc(C(=O)[O-])c2)n1 ZINC000522008805 1044151962 /nfs/dbraw/zinc/15/19/62/1044151962.db2.gz WFZWAJRTANUFQO-ZDUSSCGKSA-N -1 1 330.453 4.273 20 0 EIADMM CCC[C@@H]1[C@H](C)CCCN1C(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC000443278213 1044152841 /nfs/dbraw/zinc/15/28/41/1044152841.db2.gz DGKQQDKKGKYNDA-BXUZGUMPSA-N -1 1 325.836 4.095 20 0 EIADMM Cc1cc(C)c(-c2csc(NC(=O)c3cncc([O-])c3)n2)c(C)c1 ZINC000522050276 1044191883 /nfs/dbraw/zinc/19/18/83/1044191883.db2.gz FMZQWBPUQUCSEV-UHFFFAOYSA-N -1 1 339.420 4.088 20 0 EIADMM Cc1csc(-c2cccc(S(=O)(=O)[N-]c3cccc(C)c3)c2)n1 ZINC000443402181 1044258999 /nfs/dbraw/zinc/25/89/99/1044258999.db2.gz WUBJPCIPJKVOPB-UHFFFAOYSA-N -1 1 344.461 4.228 20 0 EIADMM O=C(c1cc(Cl)ccc1[O-])N1CC[C@H](C(F)(F)F)C2(CCC2)C1 ZINC000282652013 1044368269 /nfs/dbraw/zinc/36/82/69/1044368269.db2.gz CJDPFQIEMWKACQ-ZDUSSCGKSA-N -1 1 347.764 4.240 20 0 EIADMM C[C@H](NC(=O)c1cc(Cl)ccc1[O-])c1nc2ccccc2s1 ZINC000734116486 1044491470 /nfs/dbraw/zinc/49/14/70/1044491470.db2.gz ZLLLHKFBQUDNQF-VIFPVBQESA-N -1 1 332.812 4.146 20 0 EIADMM C[C@@H](NC(=O)c1cc(Cl)ccc1[O-])c1nc2ccccc2s1 ZINC000734116485 1044491849 /nfs/dbraw/zinc/49/18/49/1044491849.db2.gz ZLLLHKFBQUDNQF-SECBINFHSA-N -1 1 332.812 4.146 20 0 EIADMM Cc1nc(-c2ccc(N[C@@H]3CC[C@H](C)[C@@H](C)C3)nc2)[n-]c(=O)c1C ZINC000543450982 1044622664 /nfs/dbraw/zinc/62/26/64/1044622664.db2.gz AFTFCSDRKVUQSQ-MQIPJXDCSA-N -1 1 326.444 4.098 20 0 EIADMM CCc1nnc(C(=O)[N-]c2ccccc2SCC(F)(F)F)s1 ZINC000900096080 1045057433 /nfs/dbraw/zinc/05/74/33/1045057433.db2.gz QLVXDIPXONYXHG-UHFFFAOYSA-N -1 1 347.387 4.007 20 0 EIADMM CSc1cccc(S(=O)(=O)[N-]c2ccc(-c3ccc[nH]3)cc2)c1 ZINC000509393003 1045088609 /nfs/dbraw/zinc/08/86/09/1045088609.db2.gz VRDIXGJIQIYYEQ-UHFFFAOYSA-N -1 1 344.461 4.204 20 0 EIADMM CC(C)(C)OC(=O)Nc1ccc(C(=O)Nc2cccc(F)c2)c([O-])c1 ZINC000740922602 1045245194 /nfs/dbraw/zinc/24/51/94/1045245194.db2.gz OCHIDZZNWWTHIH-UHFFFAOYSA-N -1 1 346.358 4.131 20 0 EIADMM CCOc1cc(C(=O)N(C)c2ccc(C)c(C)c2)cc(Cl)c1[O-] ZINC000762582151 1045302590 /nfs/dbraw/zinc/30/25/90/1045302590.db2.gz MQSWMOWNHFXISL-UHFFFAOYSA-N -1 1 333.815 4.338 20 0 EIADMM CC(C)Oc1cc(O)ccc1NC(=O)c1ccc2ccccc2c1[O-] ZINC000762698118 1045335716 /nfs/dbraw/zinc/33/57/16/1045335716.db2.gz VFVSYOULUOVVAA-UHFFFAOYSA-N -1 1 337.375 4.291 20 0 EIADMM CC(C)Oc1cc(O)ccc1NC(=O)c1cc2ccccc2cc1[O-] ZINC000762697028 1045338747 /nfs/dbraw/zinc/33/87/47/1045338747.db2.gz KTALBQOCMVNZFC-UHFFFAOYSA-N -1 1 337.375 4.291 20 0 EIADMM CCC1(CC)CN(C(=O)c2ccc(NC(=O)OC(C)(C)C)cc2[O-])C1 ZINC000495843461 1045426245 /nfs/dbraw/zinc/42/62/45/1045426245.db2.gz UUUCMSJPXRBHCC-UHFFFAOYSA-N -1 1 348.443 4.001 20 0 EIADMM Cc1cc(Cl)ccc1O[C@@H](C)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000533540863 1045558427 /nfs/dbraw/zinc/55/84/27/1045558427.db2.gz QEJQWJXEQKANTN-JTQLQIEISA-N -1 1 340.206 4.413 20 0 EIADMM O=c1nc(CN2CCCCC[C@H]2c2ccccc2)[n-]c2ccsc21 ZINC000077195051 1045937224 /nfs/dbraw/zinc/93/72/24/1045937224.db2.gz BTEUIGLVGNTPSJ-INIZCTEOSA-N -1 1 339.464 4.102 20 0 EIADMM O=C([N-][C@H](c1ccccc1)C(F)(F)F)C(F)(F)c1ccccc1 ZINC000916390126 1046007709 /nfs/dbraw/zinc/00/77/09/1046007709.db2.gz RSAMQXMOYZJWPL-CYBMUJFWSA-N -1 1 329.268 4.198 20 0 EIADMM C[C@@H]1CO[C@H](c2ccccc2)[C@H](C)N1C(=O)c1c([O-])cccc1Cl ZINC000769812878 1046080592 /nfs/dbraw/zinc/08/05/92/1046080592.db2.gz UJQODZKQSPJMEC-VBHSOAQHSA-N -1 1 345.826 4.036 20 0 EIADMM C[C@H]1CCCCCN1C(=O)c1ccc(NC(=O)OC(C)(C)C)cc1[O-] ZINC000769858088 1046082949 /nfs/dbraw/zinc/08/29/49/1046082949.db2.gz FPAYXENNLPKNJX-ZDUSSCGKSA-N -1 1 348.443 4.144 20 0 EIADMM CC(C)(C)OC(=O)Nc1ccc(-c2nc(-c3ccoc3)no2)c([O-])c1 ZINC000771195796 1046342182 /nfs/dbraw/zinc/34/21/82/1046342182.db2.gz TZZRONPPGGDWDQ-UHFFFAOYSA-N -1 1 343.339 4.049 20 0 EIADMM Cc1ccccc1[C@H]1CN(Cc2cccc([O-])c2Cl)[C@H](C)CO1 ZINC000508708467 1046353124 /nfs/dbraw/zinc/35/31/24/1046353124.db2.gz AUJUOJMCOPSAPZ-RDTXWAMCSA-N -1 1 331.843 4.316 20 0 EIADMM Cc1ccc(C)c(CN(C)c2ccc(-c3nc(C)c(C)c(=O)[n-]3)cn2)c1 ZINC000428655192 1046458061 /nfs/dbraw/zinc/45/80/61/1046458061.db2.gz DZHBIROUSAWPDK-UHFFFAOYSA-N -1 1 348.450 4.114 20 0 EIADMM Cc1nc(-c2cccc(C)c2)[nH]c1C(=O)Nc1cccc(Cl)c1[O-] ZINC000533867333 1046559567 /nfs/dbraw/zinc/55/95/67/1046559567.db2.gz KUWMKZQCJVEDJB-UHFFFAOYSA-N -1 1 341.798 4.305 20 0 EIADMM CCN(C(=O)c1cc(Cl)c([O-])c(OC)c1)c1ccc(Cl)cc1 ZINC000785510636 1046712990 /nfs/dbraw/zinc/71/29/90/1046712990.db2.gz OWZLRVRYEUGEMV-UHFFFAOYSA-N -1 1 340.206 4.374 20 0 EIADMM COc1cc(C(=O)N(C)c2ccc(C)c(Cl)c2)cc(Cl)c1[O-] ZINC000785590382 1046713664 /nfs/dbraw/zinc/71/36/64/1046713664.db2.gz OCYCANJJXPUSFE-UHFFFAOYSA-N -1 1 340.206 4.293 20 0 EIADMM COc1cc(C(=O)N[C@@H](C)Cc2cc(C)cc(C)c2)cc(Cl)c1[O-] ZINC000460208825 1047167656 /nfs/dbraw/zinc/16/76/56/1047167656.db2.gz HMZUROUPXGMFGL-ZDUSSCGKSA-N -1 1 347.842 4.032 20 0 EIADMM COc1cc(C(=O)NC(C)(C)c2cccc(C)c2)cc(Cl)c1[O-] ZINC000460192285 1047172371 /nfs/dbraw/zinc/17/23/71/1047172371.db2.gz KBIXMNVDSHFGJT-UHFFFAOYSA-N -1 1 333.815 4.028 20 0 EIADMM O=C(Nc1c[nH]nc1-c1ccccc1)c1ccc(C(F)(F)F)c([O-])c1 ZINC000670419556 1047214198 /nfs/dbraw/zinc/21/41/98/1047214198.db2.gz KXLZAQCESMSNAE-UHFFFAOYSA-N -1 1 347.296 4.053 20 0 EIADMM CCN(CC)c1ccc(NC(=O)c2cc(Cl)c([O-])c(OC)c2)cc1 ZINC000788965257 1047335963 /nfs/dbraw/zinc/33/59/63/1047335963.db2.gz MQHFSWIJVVPKEB-UHFFFAOYSA-N -1 1 348.830 4.153 20 0 EIADMM COc1ccc(S(=O)(=O)[N-]c2cccc(Cl)c2)c2ccccc12 ZINC000035685421 1047383425 /nfs/dbraw/zinc/38/34/25/1047383425.db2.gz RJENSJOVIYHGIZ-UHFFFAOYSA-N -1 1 347.823 4.303 20 0 EIADMM CC(C)c1ccc(Cl)c(S(=O)(=O)[N-]c2cccnc2Cl)c1 ZINC000789727318 1047468214 /nfs/dbraw/zinc/46/82/14/1047468214.db2.gz LPVKXTZPXCOSAB-UHFFFAOYSA-N -1 1 345.251 4.313 20 0 EIADMM COc1c(C)ccc([N-]S(=O)(=O)c2cccc(C(C)C)c2)c1C ZINC000460407746 1047756463 /nfs/dbraw/zinc/75/64/63/1047756463.db2.gz ARLROUXWXDYEJX-UHFFFAOYSA-N -1 1 333.453 4.236 20 0 EIADMM Cc1cccc(S(=O)(=O)[N-]c2cccc(COC(C)(C)C)c2C)c1 ZINC000476392808 1047768138 /nfs/dbraw/zinc/76/81/38/1047768138.db2.gz OUYNHHMNHQEBOH-UHFFFAOYSA-N -1 1 347.480 4.419 20 0 EIADMM CCOc1ccc([N-]S(=O)(=O)c2cccc(C(C)C)c2)cc1OC ZINC000460414486 1047773176 /nfs/dbraw/zinc/77/31/76/1047773176.db2.gz WYRXNOUNAFXNEY-UHFFFAOYSA-N -1 1 349.452 4.018 20 0 EIADMM O=S(=O)([N-]c1cccc(Cl)c1F)c1ccc(F)cc1Cl ZINC000046541225 1047800147 /nfs/dbraw/zinc/80/01/47/1047800147.db2.gz BLGUYOVVPGSYNE-UHFFFAOYSA-N -1 1 338.162 4.072 20 0 EIADMM Cc1cc(F)cc(S(=O)(=O)[N-]c2cc(C(F)(F)F)ccc2C)c1 ZINC000476420987 1047802956 /nfs/dbraw/zinc/80/29/56/1047802956.db2.gz FESZFFKDUDUDNV-UHFFFAOYSA-N -1 1 347.333 4.262 20 0 EIADMM [O-]c1ccc(-c2noc([C@H]3C[C@@]34CCc3ccccc34)n2)c(Cl)c1 ZINC000445445794 1047821082 /nfs/dbraw/zinc/82/10/82/1047821082.db2.gz KIWYQCGHUHCOJI-DNVCBOLYSA-N -1 1 338.794 4.467 20 0 EIADMM CC(=O)Nc1cc(NC(=O)c2cc3ccccc3cc2[O-])ccc1C ZINC000131037850 1047821397 /nfs/dbraw/zinc/82/13/97/1047821397.db2.gz YMBBJQWIWHSDSR-UHFFFAOYSA-N -1 1 334.375 4.065 20 0 EIADMM O=C(N[C@@H]1CCO[C@H](c2ccccc2)C1)c1ccc2ccccc2c1[O-] ZINC000131128519 1047831734 /nfs/dbraw/zinc/83/17/34/1047831734.db2.gz ZGBWTABOEKCARG-XLIONFOSSA-N -1 1 347.414 4.196 20 0 EIADMM C[C@H](CC(=O)OCc1cc(=O)oc2cc([O-])ccc12)CC(C)(C)C ZINC000919496274 1047857756 /nfs/dbraw/zinc/85/77/56/1047857756.db2.gz MEVOXLSRYNJOJK-GFCCVEGCSA-N -1 1 332.396 4.004 20 0 EIADMM Cc1ccccc1O[C@@H](C)CNC(=O)c1ccc2ccccc2c1[O-] ZINC001137015305 1048065333 /nfs/dbraw/zinc/06/53/33/1048065333.db2.gz WBIPEPQAXJLLCT-HNNXBMFYSA-N -1 1 335.403 4.051 20 0 EIADMM COc1cc2c(cc1NC(=O)c1ccc(O)cc1[O-])oc1ccccc12 ZINC000825330992 1048072420 /nfs/dbraw/zinc/07/24/20/1048072420.db2.gz ORXSWGLTWUXMID-UHFFFAOYSA-N -1 1 349.342 4.258 20 0 EIADMM COc1ccccc1C[C@H](C)N(C)C(=O)c1ccc2ccccc2c1[O-] ZINC000131957100 1048174531 /nfs/dbraw/zinc/17/45/31/1048174531.db2.gz DHRGOIYTHBBJTF-HNNXBMFYSA-N -1 1 349.430 4.257 20 0 EIADMM O=C(c1ncc2ccccc2c1[O-])N1CCC[C@@H](Cc2ccccc2)C1 ZINC001144010926 1048365104 /nfs/dbraw/zinc/36/51/04/1048365104.db2.gz OFIGNOFBYCYMRI-KRWDZBQOSA-N -1 1 346.430 4.035 20 0 EIADMM Cc1ccc2ccnc(NC(=O)Cc3ccc([O-])c(Cl)c3)c2c1 ZINC001144069803 1048398447 /nfs/dbraw/zinc/39/84/47/1048398447.db2.gz FMDALZKDDKWUDA-UHFFFAOYSA-N -1 1 326.783 4.083 20 0 EIADMM CC(F)(F)C(=O)[N-][C@@H](c1ccccc1Cl)c1cc(F)ccc1F ZINC000815702185 1048587504 /nfs/dbraw/zinc/58/75/04/1048587504.db2.gz PRKFGJMAFBYOQS-AWEZNQCLSA-N -1 1 345.723 4.479 20 0 EIADMM COc1ccc2ccccc2c1CNC(=O)c1c([O-])cccc1Cl ZINC000920443545 1048674369 /nfs/dbraw/zinc/67/43/69/1048674369.db2.gz IQFHNBDIHOVAEU-UHFFFAOYSA-N -1 1 341.794 4.137 20 0 EIADMM CN(Cc1cccc(C(F)(F)F)c1)Cc1c(F)cc([O-])cc1F ZINC001144555074 1048725829 /nfs/dbraw/zinc/72/58/29/1048725829.db2.gz UEBZBZXTUSSBTR-UHFFFAOYSA-N -1 1 331.284 4.321 20 0 EIADMM [O-]c1cc(F)c(CN(Cc2ccccn2)C2CCCCC2)c(F)c1 ZINC001144559532 1048727230 /nfs/dbraw/zinc/72/72/30/1048727230.db2.gz NKHPQJILAWXVAU-UHFFFAOYSA-N -1 1 332.394 4.400 20 0 EIADMM [O-]c1cc(F)c(CN2CCC[C@H]2c2ccc(F)cc2F)c(F)c1 ZINC001144561848 1048729797 /nfs/dbraw/zinc/72/97/97/1048729797.db2.gz OXAQQUSCOQIQLB-KRWDZBQOSA-N -1 1 325.305 4.286 20 0 EIADMM Cc1nc(-c2ccccc2)sc1NC(=O)c1ccc([O-])cc1F ZINC000133671346 1048758426 /nfs/dbraw/zinc/75/84/26/1048758426.db2.gz VAHOGAITGQWERE-UHFFFAOYSA-N -1 1 328.368 4.216 20 0 EIADMM [O-]c1cc(F)c(CN(Cc2ccccc2)Cc2ccncc2)cc1F ZINC001144648865 1048771701 /nfs/dbraw/zinc/77/17/01/1048771701.db2.gz ZRDPLRSTTZRSQJ-UHFFFAOYSA-N -1 1 340.373 4.268 20 0 EIADMM [O-]c1cc(F)c(CN2CC[C@@H](c3ccccc3)C(F)(F)C2)cc1F ZINC001144663617 1048782631 /nfs/dbraw/zinc/78/26/31/1048782631.db2.gz HRULSJGOFFOHTA-AWEZNQCLSA-N -1 1 339.332 4.295 20 0 EIADMM [O-]c1cc(F)c(CN2CCC(Sc3ccccc3)CC2)cc1F ZINC001144659519 1048795259 /nfs/dbraw/zinc/79/52/59/1048795259.db2.gz LPAIMTUYEPCYGW-UHFFFAOYSA-N -1 1 335.419 4.427 20 0 EIADMM C[C@H]([N-]C(=O)C(F)(F)c1ccc(F)cc1)c1cc(F)ccc1F ZINC000920845084 1048802345 /nfs/dbraw/zinc/80/23/45/1048802345.db2.gz NBLIUNWHEYWXTH-VIFPVBQESA-N -1 1 329.268 4.073 20 0 EIADMM CCCOC(=O)c1ccc(NC(=O)c2ccc3ccccc3c2[O-])cc1 ZINC001135566519 1048802596 /nfs/dbraw/zinc/80/25/96/1048802596.db2.gz KPRUGDHLRATPFQ-UHFFFAOYSA-N -1 1 349.386 4.365 20 0 EIADMM C[C@@H]([N-]C(=O)C(F)(F)c1ccc(F)cc1)c1c(F)cccc1F ZINC000920845485 1048803746 /nfs/dbraw/zinc/80/37/46/1048803746.db2.gz SPKFHXVWCKAUKE-SECBINFHSA-N -1 1 329.268 4.073 20 0 EIADMM O=C(Nc1cccc(Oc2ccccc2)c1)c1cnc(C2CC2)[n-]c1=O ZINC001135583407 1048807878 /nfs/dbraw/zinc/80/78/78/1048807878.db2.gz VKVGIZZXOSBELM-UHFFFAOYSA-N -1 1 347.374 4.104 20 0 EIADMM CC(C)CN(C(=O)c1cc(F)ccc1[O-])[C@H]1CCCc2cccnc21 ZINC000133889663 1048844744 /nfs/dbraw/zinc/84/47/44/1048844744.db2.gz AMGCXZQDPWBCFI-KRWDZBQOSA-N -1 1 342.414 4.102 20 0 EIADMM O=C(N[C@@H](c1ccc(Cl)cc1)C1CCCC1)c1ccc([O-])cn1 ZINC001144844054 1048868322 /nfs/dbraw/zinc/86/83/22/1048868322.db2.gz ZDTLYJFGQODPDN-QGZVFWFLSA-N -1 1 330.815 4.102 20 0 EIADMM CC[C@@H]1CCCN(C(=O)c2cc(-c3ccc(C=O)o3)ccc2[O-])CC1 ZINC001146333230 1049015964 /nfs/dbraw/zinc/01/59/64/1049015964.db2.gz WHVVRILGNVQLFO-CQSZACIVSA-N -1 1 341.407 4.117 20 0 EIADMM Cc1ccc([C@@H](NC(=O)c2ncc3ccccc3c2[O-])C2CC2)cc1 ZINC001135984438 1049029185 /nfs/dbraw/zinc/02/91/85/1049029185.db2.gz AJQFVHJRVAMEIJ-GOSISDBHSA-N -1 1 332.403 4.130 20 0 EIADMM CC(C)c1ccc(C(=O)Nc2ccnn2Cc2ccccc2)c([O-])c1 ZINC001136022879 1049042082 /nfs/dbraw/zinc/04/20/82/1049042082.db2.gz AEZVLMTYGGRQAN-UHFFFAOYSA-N -1 1 335.407 4.013 20 0 EIADMM CC(C)(C)[C@@H]1OCCC[C@H]1CNC(=O)c1ccc2ccccc2c1[O-] ZINC001146821401 1049057370 /nfs/dbraw/zinc/05/73/70/1049057370.db2.gz CTIUQCIRQRPKRH-HNAYVOBHSA-N -1 1 341.451 4.117 20 0 EIADMM CC(C)(CCCc1ccccc1)CNC(=O)c1ccc([O-])c(F)c1 ZINC001146963603 1049077130 /nfs/dbraw/zinc/07/71/30/1049077130.db2.gz VKPFPMMPXNGHSX-UHFFFAOYSA-N -1 1 329.415 4.310 20 0 EIADMM O=C(c1ncc2ccccc2c1[O-])N1CCCCC[C@@H]1c1ccco1 ZINC001147162944 1049092972 /nfs/dbraw/zinc/09/29/72/1049092972.db2.gz GPUSONNFECZICX-MRXNPFEDSA-N -1 1 336.391 4.291 20 0 EIADMM O=C(N[C@@H](c1ccccc1)C1CC1)c1ccc(Br)cc1[O-] ZINC001136149378 1049173969 /nfs/dbraw/zinc/17/39/69/1049173969.db2.gz IMHGZETWJUHSTK-INIZCTEOSA-N -1 1 346.224 4.036 20 0 EIADMM CC(C)CCO[C@H]1CC[C@H](NC(=O)c2ccc(Cl)cc2[O-])CC1 ZINC001147846197 1049222413 /nfs/dbraw/zinc/22/24/13/1049222413.db2.gz SWXNEBVDKFLRAB-SHTZXODSSA-N -1 1 339.863 4.149 20 0 EIADMM O=C(Nc1cc(Cl)c([O-])c2ccccc12)c1cc(C(F)F)[nH]n1 ZINC001148252476 1049289169 /nfs/dbraw/zinc/28/91/69/1049289169.db2.gz KBYZINSXQWEYDU-UHFFFAOYSA-N -1 1 337.713 4.112 20 0 EIADMM O=C(Cc1ccc(Cl)cn1)Nc1cc(Cl)c([O-])c2ccccc12 ZINC001148253375 1049289687 /nfs/dbraw/zinc/28/96/87/1049289687.db2.gz QFNREKVGYNDBBZ-UHFFFAOYSA-N -1 1 347.201 4.428 20 0 EIADMM O=C(Nc1cc(Cl)c([O-])c2ccccc12)c1cncc(Cl)c1 ZINC001148251966 1049289909 /nfs/dbraw/zinc/28/99/09/1049289909.db2.gz DROBDQOAKYIKOF-UHFFFAOYSA-N -1 1 333.174 4.500 20 0 EIADMM O=C(Nc1cccc(NC(=O)C2CC2)c1)c1ccc2ccccc2c1[O-] ZINC000078912269 1049299468 /nfs/dbraw/zinc/29/94/68/1049299468.db2.gz SZZGDPWLDFOADQ-UHFFFAOYSA-N -1 1 346.386 4.146 20 0 EIADMM CC(C)Nc1ccc(Br)cc1NC(=O)c1ccccc1[O-] ZINC001148832618 1049379468 /nfs/dbraw/zinc/37/94/68/1049379468.db2.gz QMXWFMQJDCXCMY-UHFFFAOYSA-N -1 1 349.228 4.227 20 0 EIADMM O=C(Nc1ccc(SC(F)(F)F)cc1)c1cccc([O-])c1F ZINC001136278349 1049386122 /nfs/dbraw/zinc/38/61/22/1049386122.db2.gz QZSDLLPEHHTQJH-UHFFFAOYSA-N -1 1 331.290 4.396 20 0 EIADMM Cc1nc(Cl)cc(NC(=O)c2cccc(-c3ccccc3)c2[O-])n1 ZINC001148861821 1049390211 /nfs/dbraw/zinc/39/02/11/1049390211.db2.gz ZDMGZPUHOZJNKE-UHFFFAOYSA-N -1 1 339.782 4.063 20 0 EIADMM O=C(Nc1ccc2c(c1)OCO2)c1cccc(-c2ccccc2)c1[O-] ZINC001148860906 1049391292 /nfs/dbraw/zinc/39/12/92/1049391292.db2.gz ASLZOHXORAXTOW-UHFFFAOYSA-N -1 1 333.343 4.040 20 0 EIADMM O=C(Nc1ccc2c3c(cccc31)CC2)c1c(F)ccc([O-])c1F ZINC001136406622 1049586896 /nfs/dbraw/zinc/58/68/96/1049586896.db2.gz WSYMOSOITQRLEJ-UHFFFAOYSA-N -1 1 325.314 4.175 20 0 EIADMM CC(C)(C)c1ccc2c(c1)CCN(C(=O)c1ccc([O-])cc1F)C2 ZINC001136502863 1049697835 /nfs/dbraw/zinc/69/78/35/1049697835.db2.gz VLIOPVBWJSVWQD-UHFFFAOYSA-N -1 1 327.399 4.027 20 0 EIADMM C[C@H]1CCCC[C@H]1CNC(=O)c1cc(-c2ccc(C=O)o2)ccc1[O-] ZINC001136512336 1049705318 /nfs/dbraw/zinc/70/53/18/1049705318.db2.gz XVTRRTKCRGNCSM-ZFWWWQNUSA-N -1 1 341.407 4.021 20 0 EIADMM O=C(C[C@@H](c1ccccc1)C(F)(F)F)Nc1cccc(F)c1[O-] ZINC001171632939 1049764242 /nfs/dbraw/zinc/76/42/42/1049764242.db2.gz XVQYDNTWFLQWKE-NSHDSACASA-N -1 1 327.277 4.206 20 0 EIADMM CCc1ccc(S(=O)(=O)[N-]c2cccc(-c3nccs3)c2)cc1 ZINC000615958041 1049820835 /nfs/dbraw/zinc/82/08/35/1049820835.db2.gz DMCKSBQDBVLBOA-UHFFFAOYSA-N -1 1 344.461 4.173 20 0 EIADMM CC(C)[C@@H](Sc1nc(C(F)F)cc(=O)[n-]1)C(=O)c1ccccc1 ZINC000564391564 1050088415 /nfs/dbraw/zinc/08/84/15/1050088415.db2.gz HACCKQJLKVMTIK-CQSZACIVSA-N -1 1 338.379 4.119 20 0 EIADMM Fc1ccc(-c2noc(-c3ncc(C(F)(F)F)[n-]3)n2)c2ccccc12 ZINC001212689692 1050228897 /nfs/dbraw/zinc/22/88/97/1050228897.db2.gz MRHPHEALZQPGFY-UHFFFAOYSA-N -1 1 348.259 4.438 20 0 EIADMM Fc1ccc(-c2noc(-c3nc(C(F)(F)F)c[n-]3)n2)c2ccccc12 ZINC001212689692 1050228911 /nfs/dbraw/zinc/22/89/11/1050228911.db2.gz MRHPHEALZQPGFY-UHFFFAOYSA-N -1 1 348.259 4.438 20 0 EIADMM CC(CNC(=O)c1ccc([O-])c(F)c1)(c1ccccc1)c1ccccc1 ZINC001186236599 1050266113 /nfs/dbraw/zinc/26/61/13/1050266113.db2.gz HRFABDZLFIRWDR-UHFFFAOYSA-N -1 1 349.405 4.267 20 0 EIADMM CN(C(=O)c1ccc([O-])cc1F)C(c1ccccc1)c1ccccc1 ZINC001186311578 1050294058 /nfs/dbraw/zinc/29/40/58/1050294058.db2.gz YNVPQKRQKHNDTP-UHFFFAOYSA-N -1 1 335.378 4.393 20 0 EIADMM CC(C)[C@H](Cc1ccccc1)NC(=O)c1ccc2ccc(O)cc2c1[O-] ZINC001177910889 1050325078 /nfs/dbraw/zinc/32/50/78/1050325078.db2.gz DAIXHSJZENWWIF-FQEVSTJZSA-N -1 1 349.430 4.248 20 0 EIADMM [O-]c1cnccc1-c1nc(-c2ccccc2Oc2ccccc2)no1 ZINC001212722504 1050415767 /nfs/dbraw/zinc/41/57/67/1050415767.db2.gz KWOXORHJMZIHGL-UHFFFAOYSA-N -1 1 331.331 4.297 20 0 EIADMM O=S(=O)([N-]c1nccc2sccc21)C1=Cc2ccccc2CC1 ZINC000182020573 1050423586 /nfs/dbraw/zinc/42/35/86/1050423586.db2.gz QUOHGALSRZKWGI-UHFFFAOYSA-N -1 1 342.445 4.025 20 0 EIADMM C[C@@H](NC(=O)c1ccc2ccc(O)cc2c1[O-])c1c(F)cccc1F ZINC001178389278 1050451744 /nfs/dbraw/zinc/45/17/44/1050451744.db2.gz ZLBQAJRFLOYAOF-SNVBAGLBSA-N -1 1 343.329 4.020 20 0 EIADMM O=S(=O)(Cc1cccc(Cl)c1)[N-]c1ccccc1C(F)(F)F ZINC000253459353 1050476228 /nfs/dbraw/zinc/47/62/28/1050476228.db2.gz FCEDEOPSMLMQFY-UHFFFAOYSA-N -1 1 349.761 4.301 20 0 EIADMM C/C(=C/C1CCC(C)CC1)C(=O)NCCc1c(F)cc([O-])cc1F ZINC001178785211 1050553458 /nfs/dbraw/zinc/55/34/58/1050553458.db2.gz PXXNGFUXSMDJBN-LCYFTJDESA-N -1 1 337.410 4.102 20 0 EIADMM CCCC[C@@H](CCC)[N-]S(=O)(=O)c1cc(Cl)cnc1Cl ZINC001187751123 1050618666 /nfs/dbraw/zinc/61/86/66/1050618666.db2.gz FXXARMRZPFNRJZ-LLVKDONJSA-N -1 1 339.288 4.026 20 0 EIADMM COC(=O)[N-]C(=S)N(c1ccccc1N)c1ccccc1C(C)C ZINC001174047535 1050721546 /nfs/dbraw/zinc/72/15/46/1050721546.db2.gz UFSKBVKSWAOLKB-UHFFFAOYSA-N -1 1 343.452 4.171 20 0 EIADMM O=C(Nc1cc(F)c([O-])cc1Cl)c1cccc(OC(F)F)c1 ZINC001179656574 1050737509 /nfs/dbraw/zinc/73/75/09/1050737509.db2.gz TVOGIZNGBWCXPX-UHFFFAOYSA-N -1 1 331.677 4.038 20 0 EIADMM CCn1cc(CC(=O)Nc2cc(F)c([O-])cc2Cl)c2ccccc21 ZINC001179656623 1050738276 /nfs/dbraw/zinc/73/82/76/1050738276.db2.gz VXIFAVBKWZSGBX-UHFFFAOYSA-N -1 1 346.789 4.341 20 0 EIADMM CCOc1ccc(C)cc1NC(=O)c1ccc([O-])c(C(F)(F)F)c1 ZINC001188585650 1050809098 /nfs/dbraw/zinc/80/90/98/1050809098.db2.gz FVKFLXDPRJVNKH-UHFFFAOYSA-N -1 1 339.313 4.370 20 0 EIADMM CC(=O)c1cccc(NC(=O)c2ccc([O-])c(C(F)(F)F)c2)c1C ZINC001188589105 1050811013 /nfs/dbraw/zinc/81/10/13/1050811013.db2.gz NGHFMSROLJHBMW-UHFFFAOYSA-N -1 1 337.297 4.174 20 0 EIADMM CCS[C@@H]1CCC[C@H](NC(=O)c2ccc(C(F)(F)F)c([O-])c2)C1 ZINC000619582469 1050825766 /nfs/dbraw/zinc/82/57/66/1050825766.db2.gz ILUINLMNCZJKSQ-NWDGAFQWSA-N -1 1 347.402 4.205 20 0 EIADMM CC(C)[C@@H]1CCc2nc(NC(=O)c3ccc([O-])cc3F)sc2C1 ZINC001180109921 1050889236 /nfs/dbraw/zinc/88/92/36/1050889236.db2.gz IZNGFAWCVTVZIW-SNVBAGLBSA-N -1 1 334.416 4.001 20 0 EIADMM [O-]c1c(Cl)cc(Br)cc1Nc1cccc2n[nH]cc21 ZINC001174347868 1050903908 /nfs/dbraw/zinc/90/39/08/1050903908.db2.gz NWIMNKZFDYJRHK-UHFFFAOYSA-N -1 1 338.592 4.428 20 0 EIADMM Cc1cc(F)cc(C)c1C(=O)Nc1cccc(C(F)(F)F)c1[O-] ZINC001189285956 1050946026 /nfs/dbraw/zinc/94/60/26/1050946026.db2.gz CNJHIKTUUUBLOT-UHFFFAOYSA-N -1 1 327.277 4.419 20 0 EIADMM [O-]c1c(Br)ccc(Cl)c1Nc1ccc2cn[nH]c2c1 ZINC001174502659 1051036338 /nfs/dbraw/zinc/03/63/38/1051036338.db2.gz WPAKAWOBQRWIML-UHFFFAOYSA-N -1 1 338.592 4.428 20 0 EIADMM CCc1cccc(C)c1NC(=O)Nc1ccc(-n2ccc(=O)[n-]2)cc1 ZINC001189989076 1051098419 /nfs/dbraw/zinc/09/84/19/1051098419.db2.gz PRRKIRAFHBFDPS-UHFFFAOYSA-N -1 1 336.395 4.093 20 0 EIADMM O=C(NCc1ccc(Cl)cc1Cl)Nc1cccc(F)c1[O-] ZINC001190092809 1051112245 /nfs/dbraw/zinc/11/22/45/1051112245.db2.gz BBCTUMKAOVLJPQ-UHFFFAOYSA-N -1 1 329.158 4.160 20 0 EIADMM O=c1cc(-c2ccccc2)nc(SCC[C@H](O)c2ccccc2)[n-]1 ZINC001190209012 1051136928 /nfs/dbraw/zinc/13/69/28/1051136928.db2.gz BOBHKNIMAZYIKQ-KRWDZBQOSA-N -1 1 338.432 4.065 20 0 EIADMM [O-]c1ccc(Cl)c(Nc2ccc(N3CCOCC3)cc2)c1Cl ZINC001174709442 1051142803 /nfs/dbraw/zinc/14/28/03/1051142803.db2.gz OPVFKXJMMYNMGC-UHFFFAOYSA-N -1 1 339.222 4.279 20 0 EIADMM Cc1cc2cc([N-]S(=O)(=O)c3ccc(C4CC4)cc3)ccc2o1 ZINC001190499398 1051193596 /nfs/dbraw/zinc/19/35/96/1051193596.db2.gz DYRDCNKCRDTBAN-UHFFFAOYSA-N -1 1 327.405 4.419 20 0 EIADMM Cc1nc2ccccc2cc1[N-]S(=O)(=O)c1ccc(C2CC2)cc1 ZINC001190468964 1051194702 /nfs/dbraw/zinc/19/47/02/1051194702.db2.gz CPLPLGOEEGDJSH-UHFFFAOYSA-N -1 1 338.432 4.221 20 0 EIADMM [O-]c1c(Nc2cccc(CO)c2Cl)ccc(F)c1Br ZINC001212766764 1051197574 /nfs/dbraw/zinc/19/75/74/1051197574.db2.gz WSJLPAWEEIUFKZ-UHFFFAOYSA-N -1 1 346.583 4.183 20 0 EIADMM O=S(=O)([N-]c1cccc2cc(O)ccc21)c1ccc(C2CC2)cc1 ZINC001190506940 1051198678 /nfs/dbraw/zinc/19/86/78/1051198678.db2.gz OOBUJCWLTOZADW-UHFFFAOYSA-N -1 1 339.416 4.224 20 0 EIADMM COC(=O)c1ccc([O-])c(NC(=O)Nc2ccc(C(C)(C)C)cc2)c1 ZINC001191152989 1051366594 /nfs/dbraw/zinc/36/65/94/1051366594.db2.gz TWGOGVOJTULZNN-UHFFFAOYSA-N -1 1 342.395 4.120 20 0 EIADMM COc1cc(C(=O)Nc2cc(C)nc3sccc32)cc(Cl)c1[O-] ZINC001191138600 1051378286 /nfs/dbraw/zinc/37/82/86/1051378286.db2.gz IAZPFQAGANHAPH-UHFFFAOYSA-N -1 1 348.811 4.225 20 0 EIADMM [O-]c1ccc(CN2CCc3c(Cl)cc(F)cc3C2)c(F)c1F ZINC001182114990 1051394027 /nfs/dbraw/zinc/39/40/27/1051394027.db2.gz DVDLPZKZGBUCOD-UHFFFAOYSA-N -1 1 327.733 4.021 20 0 EIADMM CCCCc1ccc(S(=O)(=O)[N-]c2cccc(C(=O)CC)c2)cc1 ZINC001191252506 1051396518 /nfs/dbraw/zinc/39/65/18/1051396518.db2.gz CRBYOYMTKOFTLG-UHFFFAOYSA-N -1 1 345.464 4.423 20 0 EIADMM O=c1oc2cc([O-])ccc2cc1Nc1cccc(C(F)(F)F)c1F ZINC001175134706 1051401399 /nfs/dbraw/zinc/40/13/99/1051401399.db2.gz ZLRLVYWQCMONSQ-UHFFFAOYSA-N -1 1 339.244 4.400 20 0 EIADMM CCCCc1ccc(S(=O)(=O)[N-]c2ccc3cnccc3c2)cc1 ZINC001191224506 1051402157 /nfs/dbraw/zinc/40/21/57/1051402157.db2.gz QASAFDDLYHKVGD-UHFFFAOYSA-N -1 1 340.448 4.378 20 0 EIADMM CC[C@@H](C)Sc1ccc([N-]S(=O)(=O)c2cccn2C)c(C)c1 ZINC000414381205 1051449712 /nfs/dbraw/zinc/44/97/12/1051449712.db2.gz MHPLUCDMQFHDJU-CYBMUJFWSA-N -1 1 338.498 4.025 20 0 EIADMM O=S(=O)(CC1CCCC1)[N-]c1ccccc1SC(F)(F)F ZINC001191523708 1051474568 /nfs/dbraw/zinc/47/45/68/1051474568.db2.gz SACMZEDGYKCLIO-UHFFFAOYSA-N -1 1 339.404 4.230 20 0 EIADMM Cc1c(Cl)cc(Nc2ccccc2[S@@](C)=O)c([O-])c1Cl ZINC001175311162 1051521612 /nfs/dbraw/zinc/52/16/12/1051521612.db2.gz KBHFILQFTJAAKP-HXUWFJFHSA-N -1 1 330.236 4.488 20 0 EIADMM Fc1c(F)c(F)c([N-]c2cc(-c3ccncc3)no2)c(F)c1F ZINC001175383156 1051562135 /nfs/dbraw/zinc/56/21/35/1051562135.db2.gz PGKBZJBRRQXSAX-UHFFFAOYSA-N -1 1 327.212 4.176 20 0 EIADMM [O-]C(c1ccc(Nc2cncs2)cc1)(C(F)(F)F)C(F)(F)F ZINC001175497795 1051622312 /nfs/dbraw/zinc/62/23/12/1051622312.db2.gz WWLOKAHLXHBVML-UHFFFAOYSA-N -1 1 342.264 4.199 20 0 EIADMM [O-]C(c1cccc(Nc2cncs2)c1)(C(F)(F)F)C(F)(F)F ZINC001175502569 1051632456 /nfs/dbraw/zinc/63/24/56/1051632456.db2.gz OYOHJFXRSFCIEM-UHFFFAOYSA-N -1 1 342.264 4.199 20 0 EIADMM Cc1ccc(Cl)cc1S(=O)(=O)[N-]c1ccc(-c2ncco2)cc1 ZINC000157750373 1051669126 /nfs/dbraw/zinc/66/91/26/1051669126.db2.gz DZSYUGJZQRVMKI-UHFFFAOYSA-N -1 1 348.811 4.104 20 0 EIADMM CC(C)c1ccc(S(=O)(=O)[N-]c2ccc(-c3ncco3)cc2)cc1 ZINC000157720738 1051670092 /nfs/dbraw/zinc/67/00/92/1051670092.db2.gz BGKOBPHUUOHWCZ-UHFFFAOYSA-N -1 1 342.420 4.266 20 0 EIADMM Cc1ccc(CCC(=O)Nc2cccc(C(F)(F)F)c2[O-])s1 ZINC001175620623 1051678130 /nfs/dbraw/zinc/67/81/30/1051678130.db2.gz AKNFAKQARKPCKH-UHFFFAOYSA-N -1 1 329.343 4.352 20 0 EIADMM CC(C)(C)c1ccc(C(=O)Nc2ccccc2-c2ncc[nH]2)c([O-])c1 ZINC001192335402 1051694417 /nfs/dbraw/zinc/69/44/17/1051694417.db2.gz IKNSPIHOTIWNCF-UHFFFAOYSA-N -1 1 335.407 4.332 20 0 EIADMM COc1cccc2c(NC(=O)c3cc([O-])cc(F)c3F)cccc12 ZINC001192670954 1051786976 /nfs/dbraw/zinc/78/69/76/1051786976.db2.gz RMQQSNBXDNWNFT-UHFFFAOYSA-N -1 1 329.302 4.085 20 0 EIADMM O=C(N[C@H](c1ccccc1)C1CCCC1)c1cc([O-])cc(F)c1F ZINC001192679341 1051789536 /nfs/dbraw/zinc/78/95/36/1051789536.db2.gz RWOAHWXVLMBSAR-GOSISDBHSA-N -1 1 331.362 4.332 20 0 EIADMM Cc1nc2cc(Cl)c(NC(=O)c3cc([O-])cc(F)c3F)cc2o1 ZINC001192664677 1051798155 /nfs/dbraw/zinc/79/81/55/1051798155.db2.gz FJCJGQAPJDMOMO-UHFFFAOYSA-N -1 1 338.697 4.026 20 0 EIADMM CC(C)[C@@H](C(=O)Nc1nc(Cl)ccc1[O-])c1cccc(Cl)c1 ZINC001183209795 1051811076 /nfs/dbraw/zinc/81/10/76/1051811076.db2.gz NHNFJXRNHAADPS-CQSZACIVSA-N -1 1 339.222 4.472 20 0 EIADMM O=C(Nc1nc(Cl)ccc1[O-])c1ccc(OC2CCCC2)cc1 ZINC001183209790 1051811539 /nfs/dbraw/zinc/81/15/39/1051811539.db2.gz NESMOZYCUWRKSQ-UHFFFAOYSA-N -1 1 332.787 4.014 20 0 EIADMM O=C(Nc1cccc(C(F)(F)F)c1[O-])N[C@@H]1CCc2ccccc21 ZINC001192997355 1051845019 /nfs/dbraw/zinc/84/50/19/1051845019.db2.gz RYGLPJZBYLGXOY-CYBMUJFWSA-N -1 1 336.313 4.220 20 0 EIADMM CN(C)C(=O)c1ccc(Nc2ccc(Cl)c(Cl)c2[O-])c(F)c1 ZINC001176205139 1051954616 /nfs/dbraw/zinc/95/46/16/1051954616.db2.gz BUQVXSVKSUATTI-UHFFFAOYSA-N -1 1 343.185 4.284 20 0 EIADMM [O-]c1c(Br)ccc(Cl)c1Nc1ccc2nonc2c1 ZINC001176327870 1051991838 /nfs/dbraw/zinc/99/18/38/1051991838.db2.gz ZVEXAJKDVIEMMS-UHFFFAOYSA-N -1 1 340.564 4.088 20 0 EIADMM [O-]c1ccc(CNc2nc3ccccc3n2CC2CC2)c(F)c1F ZINC001184462270 1052017434 /nfs/dbraw/zinc/01/74/34/1052017434.db2.gz JKXFKSBIAXGGAV-UHFFFAOYSA-N -1 1 329.350 4.042 20 0 EIADMM [O-]c1cc(Nc2cccc3c2cnn3[C@@H]2CCCCO2)cc(F)c1F ZINC001176318858 1052025089 /nfs/dbraw/zinc/02/50/89/1052025089.db2.gz ZXKGJYTYFMQJEK-KRWDZBQOSA-N -1 1 345.349 4.463 20 0 EIADMM O=c1oc2cc([O-])ccc2cc1Nc1ccc(Oc2ccccc2)nc1 ZINC001176377120 1052048756 /nfs/dbraw/zinc/04/87/56/1052048756.db2.gz UGWJVNYQOQZJPU-UHFFFAOYSA-N -1 1 346.342 4.430 20 0 EIADMM O=C([O-])C[C@H](NCc1cc(C(F)(F)F)ccc1F)c1cccs1 ZINC000671161976 1052060907 /nfs/dbraw/zinc/06/09/07/1052060907.db2.gz BBNNZOFEUZYBLQ-LBPRGKRZSA-N -1 1 347.333 4.212 20 0 EIADMM COc1ccc([N-]S(=O)(=O)c2ccc(-c3cccs3)cc2)cc1 ZINC001194131270 1052079356 /nfs/dbraw/zinc/07/93/56/1052079356.db2.gz RSMPVFONARQBJF-UHFFFAOYSA-N -1 1 345.445 4.225 20 0 EIADMM CCS(=O)(=O)c1ccc([O-])c(Nc2cc(C)c(Cl)cc2F)c1 ZINC001176526087 1052110191 /nfs/dbraw/zinc/11/01/91/1052110191.db2.gz KBGMKGJBEPSLLR-UHFFFAOYSA-N -1 1 343.807 4.030 20 0 EIADMM O=C(Nc1cccc(C(F)(F)F)c1[O-])c1ccc(C(F)(F)F)o1 ZINC001194416484 1052144888 /nfs/dbraw/zinc/14/48/88/1052144888.db2.gz BENRARYBYXOISR-UHFFFAOYSA-N -1 1 339.191 4.275 20 0 EIADMM [O-]c1c(F)cc(F)c(Nc2cc(CCc3ccccc3)no2)c1F ZINC001176663975 1052156865 /nfs/dbraw/zinc/15/68/65/1052156865.db2.gz PWOUDYGQLHFCBE-UHFFFAOYSA-N -1 1 334.297 4.326 20 0 EIADMM CCc1cc(Br)ncc1Nc1c(F)cc(F)c([O-])c1F ZINC001176664320 1052157120 /nfs/dbraw/zinc/15/71/20/1052157120.db2.gz UKUUUVOQCCIXHJ-UHFFFAOYSA-N -1 1 347.134 4.273 20 0 EIADMM Cc1nccc(Br)c1Nc1c(F)cc(F)c([O-])c1F ZINC001176663824 1052157148 /nfs/dbraw/zinc/15/71/48/1052157148.db2.gz JFFUSQUMQGPOII-UHFFFAOYSA-N -1 1 333.107 4.019 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2cccc3c(Cl)nccc32)cc1C ZINC001194447301 1052157275 /nfs/dbraw/zinc/15/72/75/1052157275.db2.gz NXLCMVUJNLKFBX-UHFFFAOYSA-N -1 1 346.839 4.306 20 0 EIADMM Cc1nc(C(F)(F)F)c(Nc2c(F)cc(F)c([O-])c2F)s1 ZINC001176664830 1052157447 /nfs/dbraw/zinc/15/74/47/1052157447.db2.gz VHSMDNRWFMMJBS-UHFFFAOYSA-N -1 1 328.237 4.337 20 0 EIADMM [O-]c1c(F)cc(F)c(Nc2ccc(Br)c(F)c2)c1F ZINC001176672481 1052159200 /nfs/dbraw/zinc/15/92/00/1052159200.db2.gz XQZUAVKSIPRSGE-UHFFFAOYSA-N -1 1 336.082 4.455 20 0 EIADMM [O-]c1c(F)cc(F)c(Nc2ccc(Oc3ncccn3)cc2)c1F ZINC001176672042 1052159645 /nfs/dbraw/zinc/15/96/45/1052159645.db2.gz RTISQVUYRULNCT-UHFFFAOYSA-N -1 1 333.269 4.135 20 0 EIADMM [O-]c1c(F)cc(F)c(Nc2ccc(O)c(Br)c2)c1F ZINC001176672532 1052159738 /nfs/dbraw/zinc/15/97/38/1052159738.db2.gz ZSOSXTZSVQIYGZ-UHFFFAOYSA-N -1 1 334.091 4.021 20 0 EIADMM CNc1ccc(Br)cc1Nc1c(F)cc(F)c([O-])c1F ZINC001176674856 1052161710 /nfs/dbraw/zinc/16/17/10/1052161710.db2.gz YQTLHMSMHAQYNJ-UHFFFAOYSA-N -1 1 347.134 4.357 20 0 EIADMM C=Cc1cccc([N-]S(=O)(=O)c2cccc3c(Cl)nccc32)c1 ZINC001194501405 1052162247 /nfs/dbraw/zinc/16/22/47/1052162247.db2.gz KVTNOPXEUYTAIF-UHFFFAOYSA-N -1 1 344.823 4.332 20 0 EIADMM O=C(Nc1cccc([O-])c1Cl)Oc1ccc(Br)cc1 ZINC001194600454 1052177057 /nfs/dbraw/zinc/17/70/57/1052177057.db2.gz UWRIFXPYUBURKZ-UHFFFAOYSA-N -1 1 342.576 4.419 20 0 EIADMM Cc1cccc(C(F)(F)F)c1[N-]S(=O)(=O)c1c(C)cccc1C ZINC001194634003 1052182376 /nfs/dbraw/zinc/18/23/76/1052182376.db2.gz JZHOOQNZXXUWJB-UHFFFAOYSA-N -1 1 343.370 4.431 20 0 EIADMM Cc1ccc(CCC2CCN(C(=O)c3cc(F)ccc3[O-])CC2)cc1 ZINC000622288748 1052183365 /nfs/dbraw/zinc/18/33/65/1052183365.db2.gz PLHLDCNYGPMNJF-UHFFFAOYSA-N -1 1 341.426 4.325 20 0 EIADMM Cc1cccc(C)c1S(=O)(=O)[N-]c1ccc2c(cnn2C(C)C)c1 ZINC001194643050 1052183799 /nfs/dbraw/zinc/18/37/99/1052183799.db2.gz HJKSIVQORQCIEL-UHFFFAOYSA-N -1 1 343.452 4.035 20 0 EIADMM Cc1cc(Cl)ccc1[N-]S(=O)(=O)c1ccc(-c2cnco2)cc1 ZINC001185184385 1052189392 /nfs/dbraw/zinc/18/93/92/1052189392.db2.gz BIXSRCISICGAAW-UHFFFAOYSA-N -1 1 348.811 4.104 20 0 EIADMM CC(C)c1ccc([N-]S(=O)(=O)c2ccc(-c3cnco3)cc2)cc1 ZINC001185187011 1052189724 /nfs/dbraw/zinc/18/97/24/1052189724.db2.gz ZSJCRGDIBVEBLZ-UHFFFAOYSA-N -1 1 342.420 4.266 20 0 EIADMM Cc1cc(C)c([N-]S(=O)(=O)c2ccc(-c3cnco3)cc2)cc1C ZINC001185226705 1052198439 /nfs/dbraw/zinc/19/84/39/1052198439.db2.gz BLNPQRWAVCMTNM-UHFFFAOYSA-N -1 1 342.420 4.068 20 0 EIADMM CC(C)CCC[N-]S(=O)(=O)c1c(Cl)cc(Cl)cc1Cl ZINC001185241745 1052201956 /nfs/dbraw/zinc/20/19/56/1052201956.db2.gz UKUAIZKPBQRIQD-UHFFFAOYSA-N -1 1 344.691 4.361 20 0 EIADMM CC(C)(CC1CCOCC1)C(=O)Nc1cccc(C(F)(F)F)c1[O-] ZINC001185320746 1052210122 /nfs/dbraw/zinc/21/01/22/1052210122.db2.gz PWZALPLVGBPTMN-UHFFFAOYSA-N -1 1 345.361 4.192 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2ccc(-c3ncco3)cc2)ccc1Cl ZINC001185532044 1052259423 /nfs/dbraw/zinc/25/94/23/1052259423.db2.gz JQVYOWXIKJOIEQ-UHFFFAOYSA-N -1 1 348.811 4.104 20 0 EIADMM O=S(=O)([N-]CC1CCCCCCC1)c1cc2cc(F)ccc2o1 ZINC001185675841 1052286235 /nfs/dbraw/zinc/28/62/35/1052286235.db2.gz ZAIGBGOGAJGLBI-UHFFFAOYSA-N -1 1 339.432 4.211 20 0 EIADMM CC(C)C[C@]1(C)CCCN1C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000622637778 1052360597 /nfs/dbraw/zinc/36/05/97/1052360597.db2.gz GFGMIWASWRRJOR-INIZCTEOSA-N -1 1 329.362 4.452 20 0 EIADMM O=c1ccn(-c2ccc(NCc3cnc(C4CCCC4)s3)cc2)[n-]1 ZINC000623776855 1052804954 /nfs/dbraw/zinc/80/49/54/1052804954.db2.gz CIJCTEAHIYPCNX-UHFFFAOYSA-N -1 1 340.452 4.304 20 0 EIADMM CC[C@@H](C(=O)OCCc1cc(C(C)=O)ccc1[O-])c1ccc(F)cc1 ZINC000764646708 1053252907 /nfs/dbraw/zinc/25/29/07/1053252907.db2.gz NZXUJTRNMFYPEB-GOSISDBHSA-N -1 1 344.382 4.013 20 0 EIADMM CC(C)c1cccc(S(=O)(=O)[N-]c2ccc3cnccc3c2)c1 ZINC001195111403 1053277316 /nfs/dbraw/zinc/27/73/16/1053277316.db2.gz KFXYAFBOWPNRBF-UHFFFAOYSA-N -1 1 326.421 4.159 20 0 EIADMM Cc1ccnc2cc([N-]S(=O)(=O)c3cccc(C(C)C)c3)ccc12 ZINC001195159359 1053307421 /nfs/dbraw/zinc/30/74/21/1053307421.db2.gz OKRGWNNQHUGTEW-UHFFFAOYSA-N -1 1 340.448 4.467 20 0 EIADMM CCOC(=O)NC(=S)[N-]c1ccc(-c2ccccc2)c(Cl)c1 ZINC001195492328 1053421590 /nfs/dbraw/zinc/42/15/90/1053421590.db2.gz HQRPKERAFOLGOQ-UHFFFAOYSA-N -1 1 334.828 4.450 20 0 EIADMM CCc1cnccc1C(=O)[N-]c1c(SC)cc(C)nc1SC ZINC001196129932 1053583585 /nfs/dbraw/zinc/58/35/85/1053583585.db2.gz KKTTWNAXZIEQLV-UHFFFAOYSA-N -1 1 333.482 4.044 20 0 EIADMM O=C([N-]c1cc(C2CCCC2)no1)c1snc(Cl)c1Cl ZINC001196334649 1053643131 /nfs/dbraw/zinc/64/31/31/1053643131.db2.gz ZENBBIMGAWRPOE-UHFFFAOYSA-N -1 1 332.212 4.348 20 0 EIADMM CCOc1ccc(CN(C)C(=O)c2ccc3ccccc3c2[O-])cc1 ZINC000018074128 1053704583 /nfs/dbraw/zinc/70/45/83/1053704583.db2.gz GVBOECFXGAOQBK-UHFFFAOYSA-N -1 1 335.403 4.216 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1ccc(Oc2cccnc2)cc1 ZINC000111665964 1053720088 /nfs/dbraw/zinc/72/00/88/1053720088.db2.gz DWDCBRVBDRWMGH-UHFFFAOYSA-N -1 1 340.766 4.485 20 0 EIADMM C[C@H]([N-]C(=O)C(F)(F)c1ccccc1F)c1c(F)cccc1F ZINC000765605017 1053796875 /nfs/dbraw/zinc/79/68/75/1053796875.db2.gz UDFJWAWZVZDYLR-VIFPVBQESA-N -1 1 329.268 4.073 20 0 EIADMM CCOCc1ccc(CNC(=O)c2cc3ccccc3cc2[O-])cc1 ZINC000030124313 1054028814 /nfs/dbraw/zinc/02/88/14/1054028814.db2.gz WHVGDVBCPHPZCJ-UHFFFAOYSA-N -1 1 335.403 4.012 20 0 EIADMM CCCc1ccccc1[N-]S(=O)(=O)c1cccc(C(F)(F)F)c1 ZINC000032098400 1054092435 /nfs/dbraw/zinc/09/24/35/1054092435.db2.gz MBYFCFZDZJAMFQ-UHFFFAOYSA-N -1 1 343.370 4.459 20 0 EIADMM CCCOc1ccc(S(=O)(=O)[N-]c2cccc(OCCC)c2)cc1 ZINC000032599966 1054107859 /nfs/dbraw/zinc/10/78/59/1054107859.db2.gz BRPCKHUDEOWLQN-UHFFFAOYSA-N -1 1 349.452 4.065 20 0 EIADMM CSc1nc(NC(=S)Nc2ccc(C(C)(C)C)cc2)cc(=O)[n-]1 ZINC001198467477 1054154788 /nfs/dbraw/zinc/15/47/88/1054154788.db2.gz JBIBHOXBXFNSAS-UHFFFAOYSA-N -1 1 348.497 4.011 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1CCC[C@H](OC2CCC2)CC1 ZINC000871332899 1054200346 /nfs/dbraw/zinc/20/03/46/1054200346.db2.gz CZHFNGYWEXBGBB-KRWDZBQOSA-N -1 1 339.435 4.109 20 0 EIADMM C[C@H](C(=O)[N-]OCc1ccc(F)cc1)c1ccc(Cl)c(Cl)c1 ZINC000857484610 1054275294 /nfs/dbraw/zinc/27/52/94/1054275294.db2.gz JBCZBZKRUQTMTR-JTQLQIEISA-N -1 1 342.197 4.484 20 0 EIADMM Cc1cc2cc([N-]S(=O)(=O)c3ccc4occc4c3)ccc2o1 ZINC001198859694 1054288029 /nfs/dbraw/zinc/28/80/29/1054288029.db2.gz ZDXOBHGKKSSLJV-UHFFFAOYSA-N -1 1 327.361 4.288 20 0 EIADMM [O-]c1cccc(NC(=S)NC2CCCCCC2)c1Br ZINC001199972354 1054508587 /nfs/dbraw/zinc/50/85/87/1054508587.db2.gz SPWBIJDBXYWKOY-UHFFFAOYSA-N -1 1 343.290 4.164 20 0 EIADMM [O-]c1c(NC(=S)Nc2ccc(F)cc2F)cccc1C(F)(F)F ZINC001200935288 1054583235 /nfs/dbraw/zinc/58/32/35/1054583235.db2.gz ZHNVXSILFLOUGP-UHFFFAOYSA-N -1 1 348.296 4.498 20 0 EIADMM O=c1ccn(-c2ccc(NC(=S)Nc3cccc(Cl)c3)cc2)[n-]1 ZINC001201108265 1054662875 /nfs/dbraw/zinc/66/28/75/1054662875.db2.gz GUHIXYMBIXIKQA-UHFFFAOYSA-N -1 1 344.827 4.040 20 0 EIADMM CSc1ccc(NC(=S)Nc2cc(F)c([O-])c(F)c2)cc1 ZINC001201185691 1054707010 /nfs/dbraw/zinc/70/70/10/1054707010.db2.gz UDWQLBZLEBEMBK-UHFFFAOYSA-N -1 1 326.393 4.201 20 0 EIADMM O=C(NCc1ccc([O-])c(Cl)c1)N[C@H](c1cccs1)C1CC1 ZINC000875038192 1054757927 /nfs/dbraw/zinc/75/79/27/1054757927.db2.gz GMCNDMUPDNNEJF-HNNXBMFYSA-N -1 1 336.844 4.058 20 0 EIADMM COc1cc(OC(F)(F)F)ccc1Nc1cc([O-])c(F)c(F)c1 ZINC001201359904 1054758963 /nfs/dbraw/zinc/75/89/63/1054758963.db2.gz COFNEYQXXKGCDB-UHFFFAOYSA-N -1 1 335.228 4.321 20 0 EIADMM [O-]c1c(Cl)c(Cl)ccc1Nc1cnn(Cc2ccccn2)c1 ZINC001201428229 1054798631 /nfs/dbraw/zinc/79/86/31/1054798631.db2.gz NQPYBZQVDCRMIP-UHFFFAOYSA-N -1 1 335.194 4.082 20 0 EIADMM CC(=O)Nc1cc(NC(=O)c2ccc(C(C)C)cc2[O-])ccc1Cl ZINC000063337905 1054804807 /nfs/dbraw/zinc/80/48/07/1054804807.db2.gz XMVJBUOUBZNILM-UHFFFAOYSA-N -1 1 346.814 4.380 20 0 EIADMM O=c1cc(CSc2nc3ccccc3s2)c2ccc([O-])cc2o1 ZINC000005629222 1054834891 /nfs/dbraw/zinc/83/48/91/1054834891.db2.gz PCSPBKZYYUYLSM-UHFFFAOYSA-N -1 1 341.413 4.401 20 0 EIADMM CSc1ccc(S(=O)(=O)[N-]c2ccc(Cl)c(F)c2)cc1 ZINC000064476230 1054864037 /nfs/dbraw/zinc/86/40/37/1054864037.db2.gz NLUGEXOGZCXCIO-UHFFFAOYSA-N -1 1 331.821 4.002 20 0 EIADMM Cc1c(C)c(C)c(S(=O)(=O)[N-]c2cccc3c2COC3)c(C)c1C ZINC001201799200 1054908394 /nfs/dbraw/zinc/90/83/94/1054908394.db2.gz GGKVLCQTSJGOGN-UHFFFAOYSA-N -1 1 345.464 4.060 20 0 EIADMM CCC[C@H](C)CC(=O)N1CCC(c2n[n-]c(=S)n2C(C)C)CC1 ZINC000068446988 1055082433 /nfs/dbraw/zinc/08/24/33/1055082433.db2.gz LFJOWOGRRIATBH-ZDUSSCGKSA-N -1 1 338.521 4.054 20 0 EIADMM O=C([N-]c1nnc(-c2ccco2)s1)c1occc1-c1ccccc1 ZINC000072989959 1055159172 /nfs/dbraw/zinc/15/91/72/1055159172.db2.gz FKVGTKJTPKAGFU-UHFFFAOYSA-N -1 1 337.360 4.310 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1cc(Br)cs1 ZINC000111667622 1055223836 /nfs/dbraw/zinc/22/38/36/1055223836.db2.gz AGQUQNDYARPFRL-UHFFFAOYSA-N -1 1 332.606 4.122 20 0 EIADMM COc1ccc(N[C@@H](C)c2cc(Br)cc(F)c2[O-])cc1 ZINC000186243638 1055272021 /nfs/dbraw/zinc/27/20/21/1055272021.db2.gz DXXYQUNEORRQEV-VIFPVBQESA-N -1 1 340.192 4.476 20 0 EIADMM O=C(c1ccc(C(F)(F)F)c([O-])c1)N1CCC=C(c2ccccc2)C1 ZINC000671915435 1055674486 /nfs/dbraw/zinc/67/44/86/1055674486.db2.gz LXWCEQJGRMLVDR-UHFFFAOYSA-N -1 1 347.336 4.341 20 0 EIADMM CCCCc1nc(C(=O)OCC)c(NC(=O)[C@H](C)CC2CCCC2)[nH]1 ZINC001128074517 1055716971 /nfs/dbraw/zinc/71/69/71/1055716971.db2.gz ZUDKZIUMYOYORL-CYBMUJFWSA-N -1 1 349.475 4.084 20 0 EIADMM CC(C)(C)c1noc2ncc(C(=O)Nc3ccc([O-])c(Cl)c3)cc21 ZINC000542816650 1056096007 /nfs/dbraw/zinc/09/60/07/1056096007.db2.gz UDHLIYUIHJOPEV-UHFFFAOYSA-N -1 1 345.786 4.132 20 0 EIADMM O=C(Nc1c([O-])cccc1F)c1cc2c(cccc2Br)[nH]1 ZINC000743417354 1058992099 /nfs/dbraw/zinc/99/20/99/1058992099.db2.gz WSKCFSJAURONBR-UHFFFAOYSA-N -1 1 349.159 4.027 20 0 EIADMM CCC(=CC(=O)OCCc1cc(C(C)=O)ccc1[O-])c1ccccc1 ZINC000744957026 1059676173 /nfs/dbraw/zinc/67/61/73/1059676173.db2.gz LBMCVYIVJXQIJL-PEZBUJJGSA-N -1 1 338.403 4.174 20 0 EIADMM CC(=O)c1ccc([O-])c(CCOC(=O)C[C@@H](C)c2ccccc2C)c1 ZINC000745051132 1059708975 /nfs/dbraw/zinc/70/89/75/1059708975.db2.gz WEPHWXAASYWZTA-OAHLLOKOSA-N -1 1 340.419 4.183 20 0 EIADMM CC(=O)c1ccc([O-])c(CCOC(=O)[C@@H](C)c2cccc(Cl)c2)c1 ZINC000745301583 1059807560 /nfs/dbraw/zinc/80/75/60/1059807560.db2.gz FVXSUPNVSQKDBS-LBPRGKRZSA-N -1 1 346.810 4.138 20 0 EIADMM O=C([O-])C[C@H](NCc1c(Cl)oc2ccccc21)c1cccs1 ZINC000388539160 1060280011 /nfs/dbraw/zinc/28/00/11/1060280011.db2.gz DEYDVWCTYPLSQY-LBPRGKRZSA-N -1 1 335.812 4.453 20 0 EIADMM Cc1ccc(F)c(C(=O)[N-]c2nc(-c3ccc(F)cc3)ns2)c1F ZINC000766458942 1060364126 /nfs/dbraw/zinc/36/41/26/1060364126.db2.gz JPYFSEZBPNIPCU-UHFFFAOYSA-N -1 1 349.337 4.183 20 0 EIADMM O=C(Nc1ccc(-n2ccc(=O)[n-]2)cc1)[C@@H]1CCC[C@H]1c1ccccc1 ZINC001168915524 1060518262 /nfs/dbraw/zinc/51/82/62/1060518262.db2.gz XTNBNVZOBLPVOS-RBUKOAKNSA-N -1 1 347.418 4.100 20 0 EIADMM C[C@@H](CCCc1ccccc1)C(=O)Nc1ccc(-n2ccc(=O)[n-]2)cc1 ZINC001168914870 1060518785 /nfs/dbraw/zinc/51/87/85/1060518785.db2.gz PWQBLFFGAHASPX-INIZCTEOSA-N -1 1 349.434 4.175 20 0 EIADMM Cc1csc(Nc2cccc(NC(=O)c3ccc([O-])c(F)c3)c2)n1 ZINC000767317344 1061195651 /nfs/dbraw/zinc/19/56/51/1061195651.db2.gz GODMUFIEHNGWNX-UHFFFAOYSA-N -1 1 343.383 4.292 20 0 EIADMM CCC(CC)C[N@@H+](CC)Cc1ccc(C(=O)[O-])cc1Br ZINC000226722413 1031102131 /nfs/dbraw/zinc/10/21/31/1031102131.db2.gz TZFCYFWZKOUKRN-UHFFFAOYSA-N -1 1 342.277 4.405 20 0 EIADMM O=C(Nc1ccc(F)cc1[O-])c1ccc(Br)c(Cl)c1 ZINC000532267070 1032125762 /nfs/dbraw/zinc/12/57/62/1032125762.db2.gz BRUFVQUOLKEWFJ-UHFFFAOYSA-N -1 1 344.567 4.200 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1CC=C(c2cncc(F)c2)CC1 ZINC000378542039 1032139764 /nfs/dbraw/zinc/13/97/64/1032139764.db2.gz XHMRSTQBEHDGFW-UHFFFAOYSA-N -1 1 348.377 4.009 20 0 EIADMM COC(=O)c1c[n-]c(S[C@H](C)c2ccc3cc(OC)ccc3c2)n1 ZINC000193543686 1032158704 /nfs/dbraw/zinc/15/87/04/1032158704.db2.gz YNUDBJYTDVGMNZ-LLVKDONJSA-N -1 1 342.420 4.211 20 0 EIADMM C[C@H]1C[C@@H](C(=O)Nc2cc(Cl)c([O-])c3ccccc23)CCC1=O ZINC000529540232 1032429293 /nfs/dbraw/zinc/42/92/93/1032429293.db2.gz VSUFXDQPYKNVNL-QWRGUYRKSA-N -1 1 331.799 4.143 20 0 EIADMM Cc1nsc([N-]C(=O)c2sc3cccc(F)c3c2Cl)n1 ZINC001126646537 1032494759 /nfs/dbraw/zinc/49/47/59/1032494759.db2.gz SEKOJUNHVPXHJB-UHFFFAOYSA-N -1 1 327.793 4.106 20 0 EIADMM COCCCC[C@@H](N=c1[n-]c(C(C)=O)c(C)s1)c1ccccc1 ZINC000450493236 1032530149 /nfs/dbraw/zinc/53/01/49/1032530149.db2.gz AQCIFQDZROKMIL-MRXNPFEDSA-N -1 1 332.469 4.046 20 0 EIADMM Cc1c(NCc2cccc([O-])c2Cl)cccc1NC(=O)N(C)C ZINC000339381129 1018826873 /nfs/dbraw/zinc/82/68/73/1018826873.db2.gz ZLKOBQHDVWFIGN-UHFFFAOYSA-N -1 1 333.819 4.060 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2cc(C)c(F)cc2Cl)c(C)c1 ZINC000471117951 1018964203 /nfs/dbraw/zinc/96/42/03/1018964203.db2.gz ZGMPQEPYZNPYDA-UHFFFAOYSA-N -1 1 327.808 4.205 20 0 EIADMM O=C([O-])c1cccc(CNCc2ccc(-c3ccccc3F)o2)c1 ZINC000683176653 1019108431 /nfs/dbraw/zinc/10/84/31/1019108431.db2.gz MXIHNKZECSRTDT-UHFFFAOYSA-N -1 1 325.339 4.074 20 0 EIADMM CCSCc1cccc([N-]S(=O)(=O)c2ccc(CC)cc2)c1 ZINC000610194172 1019206222 /nfs/dbraw/zinc/20/62/22/1019206222.db2.gz QDKYKRJEGCMSLW-UHFFFAOYSA-N -1 1 335.494 4.303 20 0 EIADMM CCOc1cc(-c2noc([C@@H](C)CC)n2)cc(Br)c1[O-] ZINC000109507922 1020235469 /nfs/dbraw/zinc/23/54/69/1020235469.db2.gz VMSOBGNJNFNBTI-QMMMGPOBSA-N -1 1 341.205 4.117 20 0 EIADMM O=C(Nc1ncc(-c2ccc(F)cc2)s1)c1ccc([O-])c(F)c1 ZINC000683342571 1020330254 /nfs/dbraw/zinc/33/02/54/1020330254.db2.gz TUPLIHAWKINLHE-UHFFFAOYSA-N -1 1 332.331 4.046 20 0 EIADMM Cc1ccccc1Oc1cc(F)cc(F)c1[N-]C(=O)c1cnco1 ZINC001167318141 1021070597 /nfs/dbraw/zinc/07/05/97/1021070597.db2.gz RAFQYHCXNVWSFZ-UHFFFAOYSA-N -1 1 330.290 4.306 20 0 EIADMM O=c1nc(COc2ccc(Cl)cc2)[n-]c2sc3ccccc3c21 ZINC000063580096 1021390598 /nfs/dbraw/zinc/39/05/98/1021390598.db2.gz SQOHSFPHBKFZBV-UHFFFAOYSA-N -1 1 342.807 4.370 20 0 EIADMM Cc1ccc(-c2cc(=NC(=O)c3oc4ccccc4c3C)[nH][n-]2)s1 ZINC000500836301 1032977073 /nfs/dbraw/zinc/97/70/73/1032977073.db2.gz NKGGGEGZEQYUEZ-UHFFFAOYSA-N -1 1 337.404 4.175 20 0 EIADMM CCc1nc2c(s1)[C@H](N(C)Cc1ccc(C(=O)[O-])c(F)c1)CCC2 ZINC000580214326 1021770622 /nfs/dbraw/zinc/77/06/22/1021770622.db2.gz RPOBVVSKJYEGNG-OAHLLOKOSA-N -1 1 348.443 4.052 20 0 EIADMM COc1cc(C(=O)N(Cc2ccccc2)C(C)C)cc(Cl)c1[O-] ZINC000345059595 1033018591 /nfs/dbraw/zinc/01/85/91/1033018591.db2.gz JGEYQDBRIYJDPC-UHFFFAOYSA-N -1 1 333.815 4.105 20 0 EIADMM O=C(Cc1ccc(Cl)c(Cl)c1)Nc1cc([O-])c(F)cc1F ZINC001625892952 1022080937 /nfs/dbraw/zinc/08/09/37/1022080937.db2.gz BWSPRJXVHXGDHP-UHFFFAOYSA-N -1 1 332.133 4.158 20 0 EIADMM CCCCCN(C(=O)c1cc(Br)ccc1[O-])C(C)C ZINC000221286932 1022341166 /nfs/dbraw/zinc/34/11/66/1022341166.db2.gz FURXOHNVGRNOES-UHFFFAOYSA-N -1 1 328.250 4.196 20 0 EIADMM O=c1cc(C2CC2)nc(SCc2csc(-c3ccoc3)n2)[n-]1 ZINC000188134610 1022459039 /nfs/dbraw/zinc/45/90/39/1022459039.db2.gz CBIVLFHOHMUGGB-UHFFFAOYSA-N -1 1 331.422 4.068 20 0 EIADMM O=C(Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)c1occc1-c1ccccc1 ZINC000339125561 1022627895 /nfs/dbraw/zinc/62/78/95/1022627895.db2.gz DJRVRXUAQQBBBS-UHFFFAOYSA-N -1 1 345.358 4.295 20 0 EIADMM C[C@H](NCc1cc(=O)oc2cc([O-])ccc12)c1c(F)cccc1Cl ZINC000181744891 1022709325 /nfs/dbraw/zinc/70/93/25/1022709325.db2.gz OCIRDQBTQKWJAG-JTQLQIEISA-N -1 1 347.773 4.142 20 0 EIADMM CCOc1cc(C(=O)N[C@@H]2CCc3cc(F)ccc32)cc(Cl)c1[O-] ZINC000186688624 1022718757 /nfs/dbraw/zinc/71/87/57/1022718757.db2.gz FTHCUQDLDJBUIF-OAHLLOKOSA-N -1 1 349.789 4.001 20 0 EIADMM CS[C@@H]1CCCC[N@H+]([C@H](C(=O)[O-])c2ccc(Cl)cc2Cl)C1 ZINC000584637768 1023138832 /nfs/dbraw/zinc/13/88/32/1023138832.db2.gz BUZFEGLIFGBYFW-RISCZKNCSA-N -1 1 348.295 4.337 20 0 EIADMM O=c1cc(C(F)(F)F)nc(SCc2ccc(Cl)s2)[n-]1 ZINC000545484049 1023191136 /nfs/dbraw/zinc/19/11/36/1023191136.db2.gz AGMDCFMIBALKKI-UHFFFAOYSA-N -1 1 326.752 4.208 20 0 EIADMM O=c1cc(C2CC2)nc(SCc2coc(-c3cccs3)n2)[n-]1 ZINC000188138654 1023293764 /nfs/dbraw/zinc/29/37/64/1023293764.db2.gz DMYYYGOOVTVALH-UHFFFAOYSA-N -1 1 331.422 4.068 20 0 EIADMM C[C@H]1CC[N@@H+](CCSc2cc(Cl)ccc2Cl)C[C@@H]1C(=O)[O-] ZINC000584779977 1023310813 /nfs/dbraw/zinc/31/08/13/1023310813.db2.gz ZISHGQYQBOTYBS-JQWIXIFHSA-N -1 1 348.295 4.128 20 0 EIADMM O=C([O-])C[C@@H](NCc1ccc(Cl)o1)c1cccc(C(F)(F)F)c1 ZINC000417575387 1023366342 /nfs/dbraw/zinc/36/63/42/1023366342.db2.gz FTVGJAYOMGBPSP-GFCCVEGCSA-N -1 1 347.720 4.257 20 0 EIADMM CCOc1c(Cl)cccc1CN[C@@H]1C[C@@H](C(=O)[O-])c2ccccc21 ZINC000417624516 1023386234 /nfs/dbraw/zinc/38/62/34/1023386234.db2.gz KWVCHFGFNBQDHH-NVXWUHKLSA-N -1 1 345.826 4.142 20 0 EIADMM CCCCOc1ccccc1CNCc1cc(F)c(C(=O)[O-])c(F)c1 ZINC000417649230 1023391532 /nfs/dbraw/zinc/39/15/32/1023391532.db2.gz RGPWTBMYCIZLTQ-UHFFFAOYSA-N -1 1 349.377 4.132 20 0 EIADMM O=C(Cc1cccc2ccccc21)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC000613664157 1023469947 /nfs/dbraw/zinc/46/99/47/1023469947.db2.gz JQAPLFJLGMSSNE-UHFFFAOYSA-N -1 1 343.386 4.117 20 0 EIADMM CC(C)(C)c1ccc(C(=O)Nc2ccc(-c3cc(=O)[nH][n-]3)cc2)cc1 ZINC000613665442 1023472228 /nfs/dbraw/zinc/47/22/28/1023472228.db2.gz VBIAKKAPKZIOCF-UHFFFAOYSA-N -1 1 335.407 4.332 20 0 EIADMM CC(C)c1ccc(S(=O)(=O)[N-]c2cc(F)c(F)c(F)c2)cc1 ZINC000107279051 1023932522 /nfs/dbraw/zinc/93/25/22/1023932522.db2.gz VMXLOJHNGNUFPH-UHFFFAOYSA-N -1 1 329.343 4.028 20 0 EIADMM Cc1c2ccccc2oc1[C@H]([N-]C(=O)C(F)(F)C(F)F)C(C)C ZINC001126050809 1024006261 /nfs/dbraw/zinc/00/62/61/1024006261.db2.gz FSMSKBUYYGCVRN-GFCCVEGCSA-N -1 1 331.309 4.455 20 0 EIADMM Cc1ccc(C)c(S(=O)(=O)[N-]c2ccc3nc(C4CC4)oc3c2)c1 ZINC000432210572 1024065783 /nfs/dbraw/zinc/06/57/83/1024065783.db2.gz OKVKTIWPQWJPFK-UHFFFAOYSA-N -1 1 342.420 4.123 20 0 EIADMM CSc1ccc([N-]S(=O)(=O)c2cccc(Cl)c2C)cc1 ZINC000048653723 1024674382 /nfs/dbraw/zinc/67/43/82/1024674382.db2.gz DWFHFDITRTWHDK-UHFFFAOYSA-N -1 1 327.858 4.171 20 0 EIADMM CCC(CC)[N-]S(=O)(=O)c1c(Cl)cc(Cl)cc1Cl ZINC000048664404 1024683693 /nfs/dbraw/zinc/68/36/93/1024683693.db2.gz ZRKMRJDRMMGOPH-UHFFFAOYSA-N -1 1 330.664 4.114 20 0 EIADMM C[C@H](C(=O)Nc1c([O-])cccc1F)c1cccc(Br)c1 ZINC000643209709 1024820273 /nfs/dbraw/zinc/82/02/73/1024820273.db2.gz UTTAWPRQPIKPHS-VIFPVBQESA-N -1 1 338.176 4.036 20 0 EIADMM CC(C)N(CCC(=O)[O-])Cc1nc(-c2ccccc2Cl)cs1 ZINC000652478481 1024847766 /nfs/dbraw/zinc/84/77/66/1024847766.db2.gz GJECUACKNWNBQK-UHFFFAOYSA-N -1 1 338.860 4.149 20 0 EIADMM O=C([O-])[C@@H](NCc1ccc(-c2ccccc2)cc1)c1ccccc1F ZINC000426784694 1024878247 /nfs/dbraw/zinc/87/82/47/1024878247.db2.gz NIXMALOOKYJNOR-FQEVSTJZSA-N -1 1 335.378 4.408 20 0 EIADMM CCN(Cc1ccc(C)cc1)C(=O)c1ccc(Br)c([O-])c1 ZINC000535717598 1024897903 /nfs/dbraw/zinc/89/79/03/1024897903.db2.gz JAYYZHOBMILMGK-UHFFFAOYSA-N -1 1 348.240 4.125 20 0 EIADMM [O-]c1ccc(F)cc1-c1nc(-c2cccnc2Oc2ccccc2)no1 ZINC000184852394 1024982544 /nfs/dbraw/zinc/98/25/44/1024982544.db2.gz DTUSOYNTYZTDLV-UHFFFAOYSA-N -1 1 349.321 4.436 20 0 EIADMM CSc1ccc([N-]S(=O)(=O)c2ccc3ccccc3c2)cc1 ZINC000007745667 1025452328 /nfs/dbraw/zinc/45/23/28/1025452328.db2.gz CYMIRLOTMSKXDS-UHFFFAOYSA-N -1 1 329.446 4.363 20 0 EIADMM Cc1nc(-c2ccco2)ccc1C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000111666130 1025740730 /nfs/dbraw/zinc/74/07/30/1025740730.db2.gz DSUSDYFUQJBQCR-UHFFFAOYSA-N -1 1 328.755 4.261 20 0 EIADMM CC(C)c1ccc([C@H](CC(=O)[O-])NCc2cccnc2Cl)cc1 ZINC000277380559 1025838498 /nfs/dbraw/zinc/83/84/98/1025838498.db2.gz QUYJVEIHBYRXSF-INIZCTEOSA-N -1 1 332.831 4.164 20 0 EIADMM O=S(=O)([N-]c1cccc(Cl)c1Cl)c1ccc(F)cc1F ZINC000007405316 1025844605 /nfs/dbraw/zinc/84/46/05/1025844605.db2.gz VWECXBLCEGSTJT-UHFFFAOYSA-N -1 1 338.162 4.072 20 0 EIADMM O=C([O-])CCC1CCN(Cc2coc(-c3ccc(Cl)cc3)n2)CC1 ZINC000324245291 1026032466 /nfs/dbraw/zinc/03/24/66/1026032466.db2.gz CDHBSJQVTLPCLM-UHFFFAOYSA-N -1 1 348.830 4.072 20 0 EIADMM O=C([O-])C1CCN([C@H](c2ccc(F)cc2)c2ccc(Cl)cc2)CC1 ZINC000006528030 1026120038 /nfs/dbraw/zinc/12/00/38/1026120038.db2.gz FNTCLIBXEWCZBJ-SFHVURJKSA-N -1 1 347.817 4.365 20 0 EIADMM Cc1cnc(SCc2ccc(Cl)c(C(F)(F)F)c2)[n-]c1=O ZINC001307347925 1026166764 /nfs/dbraw/zinc/16/67/64/1026166764.db2.gz ZRTHIOTWNCLEDL-UHFFFAOYSA-N -1 1 334.750 4.455 20 0 EIADMM O=C([N-]C1(c2ccccc2F)CC1)C(F)(F)c1cc(F)cc(F)c1 ZINC001126324315 1026266101 /nfs/dbraw/zinc/26/61/01/1026266101.db2.gz XACDZCLAULKAIY-UHFFFAOYSA-N -1 1 341.279 4.001 20 0 EIADMM COc1cc(C(=O)N2CCCCc3sccc32)cc(Cl)c1[O-] ZINC000684784225 1026288647 /nfs/dbraw/zinc/28/86/47/1026288647.db2.gz ACFRNWYXAJHHEN-UHFFFAOYSA-N -1 1 337.828 4.099 20 0 EIADMM O=C([O-])c1ccc(CNCc2cc(C(F)(F)F)ccc2Cl)cc1 ZINC000426697415 1026484381 /nfs/dbraw/zinc/48/43/81/1026484381.db2.gz WZOMMXGXDKXSSX-UHFFFAOYSA-N -1 1 343.732 4.347 20 0 EIADMM COc1ccc2c(c1)N(C(=O)c1ccc3ccccc3c1[O-])CCC2 ZINC001167877085 1026511505 /nfs/dbraw/zinc/51/15/05/1026511505.db2.gz OXQPIKDIHWBXMO-UHFFFAOYSA-N -1 1 333.387 4.147 20 0 EIADMM Cc1ccc(-c2ccc(CN[C@H](CC3CCCC3)C(=O)[O-])o2)cc1 ZINC000426728042 1026527372 /nfs/dbraw/zinc/52/73/72/1026527372.db2.gz SKRRSPIKQGLPSP-GOSISDBHSA-N -1 1 327.424 4.378 20 0 EIADMM O=C([O-])[C@H](NCc1ccc(Cl)s1)c1ccc(Cl)c(F)c1 ZINC000426755900 1026540024 /nfs/dbraw/zinc/54/00/24/1026540024.db2.gz GRDKLLARCAUONV-GFCCVEGCSA-N -1 1 334.199 4.110 20 0 EIADMM CCOc1cccc2[nH]cc(CC(=O)Nc3ccc([O-])c(Cl)c3)c21 ZINC000187410450 1026562373 /nfs/dbraw/zinc/56/23/73/1026562373.db2.gz ITHWFCLGUJXPNF-UHFFFAOYSA-N -1 1 344.798 4.107 20 0 EIADMM O=C([O-])[C@H](CCc1ccccc1)NCc1ccc(-c2ccccc2)o1 ZINC000426794266 1026565922 /nfs/dbraw/zinc/56/59/22/1026565922.db2.gz QYFNMDUDIGKBBD-IBGZPJMESA-N -1 1 335.403 4.122 20 0 EIADMM Cc1cc([C@@H](NCc2ccsc2Cl)C(=O)[O-])ccc1Cl ZINC000426799164 1026568626 /nfs/dbraw/zinc/56/86/26/1026568626.db2.gz KIGWTKLVCWZOKT-GFCCVEGCSA-N -1 1 330.236 4.279 20 0 EIADMM C[C@@H]1CCCN(Cc2csc(-c3cccc(C(=O)[O-])c3)n2)[C@H]1C ZINC000582425794 1026622461 /nfs/dbraw/zinc/62/24/61/1026622461.db2.gz NXCYXBWQKUGMCF-OLZOCXBDSA-N -1 1 330.453 4.129 20 0 EIADMM CSc1ccc(NC(=O)c2ccc(C(F)(F)F)c([O-])c2)cc1 ZINC000684871201 1026635332 /nfs/dbraw/zinc/63/53/32/1026635332.db2.gz XZODCFCCMOIDSA-UHFFFAOYSA-N -1 1 327.327 4.385 20 0 EIADMM C[C@@H](c1ccco1)N(C(=O)c1ccc(C(F)(F)F)c([O-])c1)C1CC1 ZINC000684873792 1026645167 /nfs/dbraw/zinc/64/51/67/1026645167.db2.gz FTJLOGXNXFBZSY-JTQLQIEISA-N -1 1 339.313 4.370 20 0 EIADMM Cc1ccc(C[C@H](C)NC(=O)c2ccc(C(F)(F)F)c([O-])c2)s1 ZINC000684876266 1026653204 /nfs/dbraw/zinc/65/32/04/1026653204.db2.gz SGMPAKMDQKLZKR-VIFPVBQESA-N -1 1 343.370 4.142 20 0 EIADMM CCCOc1ccc(CCC(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000440782716 1027055614 /nfs/dbraw/zinc/05/56/14/1027055614.db2.gz WBDZGFHZWBBTNM-UHFFFAOYSA-N -1 1 333.815 4.406 20 0 EIADMM Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)c1cncc([O-])c1 ZINC000520396248 1027488808 /nfs/dbraw/zinc/48/88/08/1027488808.db2.gz GESICKZTXKMQAA-HNNXBMFYSA-N -1 1 348.402 4.488 20 0 EIADMM CC(C)CC1CCN(Cc2cc(=O)oc3cc([O-])c(Cl)cc23)CC1 ZINC001167636446 1027626254 /nfs/dbraw/zinc/62/62/54/1027626254.db2.gz SUJKMCRGLCALKE-UHFFFAOYSA-N -1 1 349.858 4.410 20 0 EIADMM Cc1c(NC(=O)c2ccc3ccccc3c2[O-])cnn1C1CCCC1 ZINC000444444786 1027756032 /nfs/dbraw/zinc/75/60/32/1027756032.db2.gz QEJYOVJJOAZFRF-UHFFFAOYSA-N -1 1 335.407 4.418 20 0 EIADMM C[C@H](NC(=O)c1ccc([O-])cc1F)c1ccc(-c2ccncc2)cc1 ZINC000154955326 1028327328 /nfs/dbraw/zinc/32/73/28/1028327328.db2.gz DWJWHMROVZYSFF-ZDUSSCGKSA-N -1 1 336.366 4.084 20 0 EIADMM CCCSCc1nc(-c2cc(Cl)c([O-])c(OCC)c2)no1 ZINC000445413615 1028509412 /nfs/dbraw/zinc/50/94/12/1028509412.db2.gz ZIGXDILMCLWZDR-UHFFFAOYSA-N -1 1 328.821 4.138 20 0 EIADMM Cc1oc(C[N@@H+](C)CCn2ccc3cc(Cl)ccc32)cc1C(=O)[O-] ZINC000583327678 1028509918 /nfs/dbraw/zinc/50/99/18/1028509918.db2.gz YNBXFNBGCRLLFW-UHFFFAOYSA-N -1 1 346.814 4.026 20 0 EIADMM C[C@@H](N(C)Cc1csc(-c2ccc(C(=O)[O-])cc2)n1)C(C)(C)C ZINC000583327433 1028513053 /nfs/dbraw/zinc/51/30/53/1028513053.db2.gz NWAHFFVKHOSXOP-GFCCVEGCSA-N -1 1 332.469 4.375 20 0 EIADMM CCOc1cc(-c2noc(/C=C/c3ccco3)n2)cc(Cl)c1[O-] ZINC000445429667 1028526666 /nfs/dbraw/zinc/52/66/66/1028526666.db2.gz BFKLHJMHVFRVQM-AATRIKPKSA-N -1 1 332.743 4.258 20 0 EIADMM CCOc1cc(-c2noc([C@@H]3Cc4ccccc43)n2)cc(Cl)c1[O-] ZINC000445432514 1028528755 /nfs/dbraw/zinc/52/87/55/1028528755.db2.gz TVVFOXBCXZNTGF-CYBMUJFWSA-N -1 1 342.782 4.182 20 0 EIADMM CCOc1cc(-c2noc(-c3ccc(F)cc3)n2)cc(Cl)c1[O-] ZINC000445429072 1028530156 /nfs/dbraw/zinc/53/01/56/1028530156.db2.gz YBXMLILBYURNHP-UHFFFAOYSA-N -1 1 334.734 4.300 20 0 EIADMM Cc1cc2ccccc2n1Cc1nc(-c2ccc([O-])cc2Cl)no1 ZINC000445451577 1028543016 /nfs/dbraw/zinc/54/30/16/1028543016.db2.gz HNFDYDNBVVGZSZ-UHFFFAOYSA-N -1 1 339.782 4.407 20 0 EIADMM CCc1c(-c2nc(-c3ccc([O-])cc3Cl)no2)cnn1CC(C)C ZINC000445443268 1028568601 /nfs/dbraw/zinc/56/86/01/1028568601.db2.gz BQOLIFNSZHLOFB-UHFFFAOYSA-N -1 1 346.818 4.178 20 0 EIADMM COc1ccc([C@@H](C)c2nc(-c3ccc([O-])cc3Cl)no2)cc1 ZINC000445445247 1028578650 /nfs/dbraw/zinc/57/86/50/1028578650.db2.gz LOCSILCKRFIDAV-SNVBAGLBSA-N -1 1 330.771 4.256 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cnc(-c4ccsc4)s3)n2)c(F)c1 ZINC000445457865 1028613671 /nfs/dbraw/zinc/61/36/71/1028613671.db2.gz UKNKREZUOKHPRI-UHFFFAOYSA-N -1 1 345.380 4.433 20 0 EIADMM [O-]c1ccc(-c2noc(CCSc3ccccc3F)n2)c(F)c1 ZINC000445457124 1028613943 /nfs/dbraw/zinc/61/39/43/1028613943.db2.gz RPAYKOUQBXYMTR-UHFFFAOYSA-N -1 1 334.347 4.055 20 0 EIADMM [O-]c1ccc(-c2noc([C@@H]3CCC[C@@H](C(F)(F)F)C3)n2)c(F)c1 ZINC000445457944 1028613967 /nfs/dbraw/zinc/61/39/67/1028613967.db2.gz VEVWQYZFZLKXJQ-RKDXNWHRSA-N -1 1 330.281 4.417 20 0 EIADMM [O-]c1ccc(-c2noc(Cc3c[nH]c4cc(Cl)ccc34)n2)c(F)c1 ZINC000445459391 1028615871 /nfs/dbraw/zinc/61/58/71/1028615871.db2.gz AHRLSZVNZAFSQG-UHFFFAOYSA-N -1 1 343.745 4.307 20 0 EIADMM COc1cc(CCc2nc(-c3ccc([O-])c(F)c3)no2)ccc1Cl ZINC000445478475 1028622991 /nfs/dbraw/zinc/62/29/91/1028622991.db2.gz RAGQQUJAMALJQE-UHFFFAOYSA-N -1 1 348.761 4.029 20 0 EIADMM O=C(CCCCc1nc(-c2ccc([O-])c(F)c2)no1)c1ccccc1 ZINC000445478036 1028624656 /nfs/dbraw/zinc/62/46/56/1028624656.db2.gz PIPZCBANUNLARY-UHFFFAOYSA-N -1 1 340.354 4.177 20 0 EIADMM [O-]c1ccc(-c2noc(-c3ccc(F)c(C(F)(F)F)c3)n2)cc1F ZINC000445478699 1028624830 /nfs/dbraw/zinc/62/48/30/1028624830.db2.gz HXLYSPDTOSFSHZ-UHFFFAOYSA-N -1 1 342.223 4.406 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cc(C4CCCCC4)[nH]n3)n2)cc1F ZINC000445484612 1028633766 /nfs/dbraw/zinc/63/37/66/1028633766.db2.gz XPFIMWWHZGOKNR-UHFFFAOYSA-N -1 1 328.347 4.019 20 0 EIADMM Cc1ccc(OCCCc2nc(-c3ccc([O-])c(F)c3)no2)c(C)c1 ZINC000445476675 1028647596 /nfs/dbraw/zinc/64/75/96/1028647596.db2.gz GUNXVTDOEQPAJP-UHFFFAOYSA-N -1 1 342.370 4.210 20 0 EIADMM O=S(=O)([N-]c1ccc(F)c(F)c1)c1cc(Cl)cc(Cl)c1 ZINC000016129675 1028789623 /nfs/dbraw/zinc/78/96/23/1028789623.db2.gz WNHCYBRAZZYDAP-UHFFFAOYSA-N -1 1 338.162 4.072 20 0 EIADMM O=C(Nc1c([O-])cc(Br)cc1Cl)c1cc(Cl)c[nH]1 ZINC000583709119 1029065323 /nfs/dbraw/zinc/06/53/23/1029065323.db2.gz IZTVKGUZQOLJSJ-UHFFFAOYSA-N -1 1 349.999 4.042 20 0 EIADMM O=C(Nc1ccc(Cl)c(C(F)(F)F)c1)c1ccc([O-])cc1F ZINC000318009406 1029526604 /nfs/dbraw/zinc/52/66/04/1029526604.db2.gz WHESMYKSXNONIZ-UHFFFAOYSA-N -1 1 333.668 4.456 20 0 EIADMM Cc1nc(-c2ccc(N[C@H]3CCCCC3(C)C)nc2)[n-]c(=O)c1C ZINC000301621317 1029773588 /nfs/dbraw/zinc/77/35/88/1029773588.db2.gz NCLMMCYEPVJNRO-HNNXBMFYSA-N -1 1 326.444 4.242 20 0 EIADMM CC(=O)Nc1ccc(C)cc1NC(=O)c1cc2ccccc2cc1[O-] ZINC000170805258 1029881002 /nfs/dbraw/zinc/88/10/02/1029881002.db2.gz UQMIOZWAOAZALK-UHFFFAOYSA-N -1 1 334.375 4.065 20 0 EIADMM Cc1ccc(-c2nnco2)cc1NC(=O)c1ccc2ccccc2c1[O-] ZINC000094013606 1029999293 /nfs/dbraw/zinc/99/92/93/1029999293.db2.gz PFSYBKOTYNPLCJ-UHFFFAOYSA-N -1 1 345.358 4.156 20 0 EIADMM COc1cc(C(=O)Nc2cccc(F)c2[O-])ccc1OC1CCCC1 ZINC000530007232 1030030256 /nfs/dbraw/zinc/03/02/56/1030030256.db2.gz RTYVWPRSBUOKSD-UHFFFAOYSA-N -1 1 345.370 4.114 20 0 EIADMM C[C@H]1CN(C(=O)c2cc3ccccc3cc2[O-])C[C@@H](c2ccccc2)O1 ZINC000143491486 1030072294 /nfs/dbraw/zinc/07/22/94/1030072294.db2.gz ICWOPYVAMVCCRW-BTYIYWSLSA-N -1 1 347.414 4.148 20 0 EIADMM COc1cc(C(=O)NCCc2ccc(C(C)C)cc2)cc(Cl)c1[O-] ZINC000525953203 1030123489 /nfs/dbraw/zinc/12/34/89/1030123489.db2.gz QLYOZYZBLOFVCM-UHFFFAOYSA-N -1 1 347.842 4.150 20 0 EIADMM CC(C)Oc1cccc([N-]S(=O)(=O)c2ccc(C(F)F)cc2)c1 ZINC000451087172 1030230386 /nfs/dbraw/zinc/23/03/86/1030230386.db2.gz OPVFOBCJRVWVKM-UHFFFAOYSA-N -1 1 341.379 4.212 20 0 EIADMM CCOc1cc(C(=O)N(C)[C@@H]2CCC[C@H](C)C2)cc(Cl)c1[O-] ZINC000186579349 1030289253 /nfs/dbraw/zinc/28/92/53/1030289253.db2.gz SPRIWVODJVIHNO-WCQYABFASA-N -1 1 325.836 4.095 20 0 EIADMM CCOc1cc(C(=O)N(C)[C@H]2CCC[C@@H](C)C2)cc(Cl)c1[O-] ZINC000186579407 1030289293 /nfs/dbraw/zinc/28/92/93/1030289293.db2.gz SPRIWVODJVIHNO-YPMHNXCESA-N -1 1 325.836 4.095 20 0 EIADMM O=C([N-]c1nnc([C@@H]2CCCO2)s1)c1cc2cc(Cl)ccc2o1 ZINC000054644647 1030397792 /nfs/dbraw/zinc/39/77/92/1030397792.db2.gz XVULZWLLOPEKED-NSHDSACASA-N -1 1 349.799 4.042 20 0 EIADMM CCSCc1cc(C(=O)[N-]c2c(F)cc(Cl)c(C)c2F)no1 ZINC000472362579 1030937449 /nfs/dbraw/zinc/93/74/49/1030937449.db2.gz QTSYWBNFDQVWLZ-UHFFFAOYSA-N -1 1 346.786 4.420 20 0 EIADMM C[N@H+](Cc1ccc(C(=O)[O-])cc1Br)CC1CCCCC1 ZINC000226722749 1031105018 /nfs/dbraw/zinc/10/50/18/1031105018.db2.gz NPGPYLBTAHHMSR-UHFFFAOYSA-N -1 1 340.261 4.159 20 0 EIADMM CC/C(C)=C/c1nc(-c2cc(Br)c([O-])c(OC)c2)no1 ZINC000453176421 1031649381 /nfs/dbraw/zinc/64/93/81/1031649381.db2.gz MRYMBJWVVFCTIR-VMPITWQZSA-N -1 1 339.189 4.027 20 0 EIADMM CC[C@@H](NC(=O)c1c[nH]c2ccccc2c1=O)c1cccc(Cl)c1 ZINC000053799213 1032038665 /nfs/dbraw/zinc/03/86/65/1032038665.db2.gz IBJCIEIABVOOFK-MRXNPFEDSA-N -1 1 340.810 4.063 20 0 EIADMM COc1ccc(Nc2cc(Cl)c(C)c(Cl)c2[O-])c(CO)c1 ZINC001211749233 1033612711 /nfs/dbraw/zinc/61/27/11/1033612711.db2.gz FHHXKRKFJVPGAR-UHFFFAOYSA-N -1 1 328.195 4.252 20 0 EIADMM CCOC(=O)[C@H](NCc1cccc([O-])c1Cl)c1cccc(C)c1C ZINC000512706163 1033758510 /nfs/dbraw/zinc/75/85/10/1033758510.db2.gz WCIHUCXUPXBBLR-GOSISDBHSA-N -1 1 347.842 4.056 20 0 EIADMM CCOc1cc2c(cc1CNCc1cccc([O-])c1Cl)O[C@H](C)C2 ZINC000645143138 1033834736 /nfs/dbraw/zinc/83/47/36/1033834736.db2.gz RDEVLDYCWUKNKS-GFCCVEGCSA-N -1 1 347.842 4.058 20 0 EIADMM CCOc1ccc(S(=O)(=O)[N-]c2cccc(F)c2)c2ccccc12 ZINC000512964102 1034252130 /nfs/dbraw/zinc/25/21/30/1034252130.db2.gz MBGIDSCHUALMKS-UHFFFAOYSA-N -1 1 345.395 4.178 20 0 EIADMM CC[C@@H](C)NC(=O)c1ccc(NCc2cccc([O-])c2Cl)cc1 ZINC000513429510 1034937127 /nfs/dbraw/zinc/93/71/27/1034937127.db2.gz GTSKMUXJPIQRDK-GFCCVEGCSA-N -1 1 332.831 4.186 20 0 EIADMM Cc1cccc(C2(CNC(=O)c3ccc(F)c([O-])c3)CCCCC2)c1 ZINC001625924202 1035455154 /nfs/dbraw/zinc/45/51/54/1035455154.db2.gz ARBBYALWAUZKMI-UHFFFAOYSA-N -1 1 341.426 4.472 20 0 EIADMM COc1ccc([C@H](NCc2ccc(/C=C\C(=O)[O-])o2)C2CCC2)cc1 ZINC000905747483 1035874390 /nfs/dbraw/zinc/87/43/90/1035874390.db2.gz AYAMCXYQKALISW-ZCPJJFRWSA-N -1 1 341.407 4.017 20 0 EIADMM Cc1nnc(-c2ccc(NC(=O)c3cc4ccccc4cc3[O-])cc2)o1 ZINC000156421056 1035964133 /nfs/dbraw/zinc/96/41/33/1035964133.db2.gz GQHZNACSSVUVMK-UHFFFAOYSA-N -1 1 345.358 4.156 20 0 EIADMM Cc1oc([C@H](C)N2CC=C(c3ccc(F)cc3)CC2)cc1C(=O)[O-] ZINC000571217526 1036006957 /nfs/dbraw/zinc/00/69/57/1036006957.db2.gz JMYZKVCOLGWUEG-LBPRGKRZSA-N -1 1 329.371 4.276 20 0 EIADMM C[C@H](CN(C)C(=O)c1ccc(Br)c([O-])c1)c1ccccc1 ZINC000485843500 1036312254 /nfs/dbraw/zinc/31/22/54/1036312254.db2.gz HUKPHNMXTMRIQY-GFCCVEGCSA-N -1 1 348.240 4.030 20 0 EIADMM O=C(Nc1c([O-])cc(Br)cc1Cl)[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000572246277 1036473539 /nfs/dbraw/zinc/47/35/39/1036473539.db2.gz WJPVLSLTRLLTPB-IWSPIJDZSA-N -1 1 344.636 4.183 20 0 EIADMM CCc1cccc(S(=O)(=O)[N-]c2ccc(C(=O)C3CCC3)cc2)c1 ZINC000486108843 1036487426 /nfs/dbraw/zinc/48/74/26/1036487426.db2.gz IVCOIIIEZGZCBI-UHFFFAOYSA-N -1 1 343.448 4.033 20 0 EIADMM CO[C@H](C)c1cccc([N-]S(=O)(=O)c2ccc(CC(C)C)cc2)c1 ZINC000588833546 1036542827 /nfs/dbraw/zinc/54/28/27/1036542827.db2.gz PHOQYVGEEBFUBZ-OAHLLOKOSA-N -1 1 347.480 4.393 20 0 EIADMM O=C(Nc1ccc(N2CCCCC2)nc1)Nc1ccc([O-])c(Cl)c1 ZINC000486252200 1036588506 /nfs/dbraw/zinc/58/85/06/1036588506.db2.gz FTVNNMAHKPSGTQ-UHFFFAOYSA-N -1 1 346.818 4.075 20 0 EIADMM O=S(=O)([N-]c1ccccc1N1CCCCCC1)c1ccc(F)cc1 ZINC000598380502 1036619030 /nfs/dbraw/zinc/61/90/30/1036619030.db2.gz HDOGSWZEYHNMHD-UHFFFAOYSA-N -1 1 348.443 4.007 20 0 EIADMM O=C(Nc1cccc([O-])c1Br)[C@@H]1CCCC[C@@H]1C1CC1 ZINC000908706387 1036922035 /nfs/dbraw/zinc/92/20/35/1036922035.db2.gz AJWKQGXHYHBTGO-VXGBXAGGSA-N -1 1 338.245 4.310 20 0 EIADMM CCc1ccc([C@@H](C)C(=O)Nc2ccc(-c3cc(=O)[nH][n-]3)cc2)cc1 ZINC000590101345 1036975528 /nfs/dbraw/zinc/97/55/28/1036975528.db2.gz VOLDBZBRNYOUMQ-CYBMUJFWSA-N -1 1 335.407 4.087 20 0 EIADMM CCc1ccccc1S(=O)(=O)[N-]c1ccc(-c2nccs2)cc1 ZINC000488223132 1037433904 /nfs/dbraw/zinc/43/39/04/1037433904.db2.gz SENNBRRSRWIDQC-UHFFFAOYSA-N -1 1 344.461 4.173 20 0 EIADMM CCOc1ccc([C@H]2CCCN2Cc2cc(C)c(C(=O)[O-])o2)cc1 ZINC000573259344 1037458141 /nfs/dbraw/zinc/45/81/41/1037458141.db2.gz SSWHVJLDQQTJGH-QGZVFWFLSA-N -1 1 329.396 4.022 20 0 EIADMM Cc1ccc(Br)cc1C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000087743286 1037640020 /nfs/dbraw/zinc/64/00/20/1037640020.db2.gz KTGMEMPCRVTSDH-UHFFFAOYSA-N -1 1 340.604 4.369 20 0 EIADMM CC[C@H](C)N(CC(=O)[O-])Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC000414688346 1037827633 /nfs/dbraw/zinc/82/76/33/1037827633.db2.gz YOKIHUKZNGXHCO-NSHDSACASA-N -1 1 338.860 4.149 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1CC2(CCC2)[C@@H]1c1cccnc1 ZINC000912038725 1037871480 /nfs/dbraw/zinc/87/14/80/1037871480.db2.gz ACANXEUJVFHPMC-FQEVSTJZSA-N -1 1 344.414 4.308 20 0 EIADMM CC(=C([O-])Nc1nc(-c2cccc(Cl)c2)ns1)c1ccsc1 ZINC000606184553 1037903655 /nfs/dbraw/zinc/90/36/55/1037903655.db2.gz FULFNMDDLMTBKA-SECBINFHSA-N -1 1 349.868 4.084 20 0 EIADMM CCC(CC)(CC)NC(=O)Cn1c(-c2cccc(C)c2)n[n-]c1=S ZINC000150816834 1038111483 /nfs/dbraw/zinc/11/14/83/1038111483.db2.gz ZOFQNEOVNUFWBX-UHFFFAOYSA-N -1 1 346.500 4.001 20 0 EIADMM O=S(=O)([N-]c1cccc2ccccc21)c1ccc2ncccc2c1 ZINC000607030407 1038352112 /nfs/dbraw/zinc/35/21/12/1038352112.db2.gz GYDCMOFKWPFPDI-UHFFFAOYSA-N -1 1 334.400 4.189 20 0 EIADMM Cc1ccc(C)c([N-]S(=O)(=O)c2ccc3c(cnn3C(C)C)c2)c1 ZINC000476496599 1038824563 /nfs/dbraw/zinc/82/45/63/1038824563.db2.gz SSNKFOJABIGKOF-UHFFFAOYSA-N -1 1 343.452 4.035 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2cccc(-c3cnco3)c2)cc1Cl ZINC000057119339 1038870045 /nfs/dbraw/zinc/87/00/45/1038870045.db2.gz HRUQRUZOHAVJQM-UHFFFAOYSA-N -1 1 348.811 4.104 20 0 EIADMM CSc1cccc([N-]S(=O)(=O)c2cc(C)sc2C)c1C ZINC000539194877 1038882076 /nfs/dbraw/zinc/88/20/76/1038882076.db2.gz VJHJONRHTQKSMS-UHFFFAOYSA-N -1 1 327.496 4.196 20 0 EIADMM Cc1cccc([N-]S(=O)(=O)c2cccc(Cl)c2Cl)c1F ZINC000539400188 1039052761 /nfs/dbraw/zinc/05/27/61/1039052761.db2.gz CXTXMGVTNAWKLV-UHFFFAOYSA-N -1 1 334.199 4.242 20 0 EIADMM Cc1nc(C(C)(C)C)[n-]c(=O)c1C(=O)N[C@@H](C)[C@H](C)C1CCCCC1 ZINC000481208314 1039123484 /nfs/dbraw/zinc/12/34/84/1039123484.db2.gz YCRMRYKYXUNDQL-STQMWFEESA-N -1 1 347.503 4.123 20 0 EIADMM CCOc1cc(C(=O)Nc2cc(C)ccc2OC)cc(Cl)c1[O-] ZINC000192601726 1039640743 /nfs/dbraw/zinc/64/07/43/1039640743.db2.gz SNFAXSHQYIYFBK-UHFFFAOYSA-N -1 1 335.787 4.014 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1C[C@@H]2CCCN2c2ccccc21 ZINC000537642491 1039724140 /nfs/dbraw/zinc/72/41/40/1039724140.db2.gz CQHZYCGLDPWKNF-KRWDZBQOSA-N -1 1 344.414 4.175 20 0 EIADMM C[C@]1(c2ccccc2)CCCN(C(=O)c2c(F)ccc([O-])c2F)CC1 ZINC000552833124 1039827710 /nfs/dbraw/zinc/82/77/10/1039827710.db2.gz DEXREGXSBLZFAY-FQEVSTJZSA-N -1 1 345.389 4.254 20 0 EIADMM O=C(Nc1ccccc1-c1ccccc1)c1csc(=NC2CC2)[n-]1 ZINC000476744331 1039855730 /nfs/dbraw/zinc/85/57/30/1039855730.db2.gz WSAGFOBHJBXOTO-UHFFFAOYSA-N -1 1 335.432 4.059 20 0 EIADMM O=S(=O)([N-]c1ccsc1Cl)c1c(Cl)ccc(F)c1F ZINC000551108265 1039984108 /nfs/dbraw/zinc/98/41/08/1039984108.db2.gz OJFGVHOZWODIDI-UHFFFAOYSA-N -1 1 344.191 4.134 20 0 EIADMM O=C(Nc1ccc2c(Cl)cccc2n1)c1c(F)ccc([O-])c1F ZINC000553128695 1040009252 /nfs/dbraw/zinc/00/92/52/1040009252.db2.gz VQEXWWAJDRIRHY-UHFFFAOYSA-N -1 1 334.709 4.124 20 0 EIADMM O=c1[nH]cc(-c2nc(-c3ccc([O-])cc3Cl)no2)c2ccccc12 ZINC000567962421 1040244696 /nfs/dbraw/zinc/24/46/96/1040244696.db2.gz IRGHHCPWGBWVHF-UHFFFAOYSA-N -1 1 339.738 4.016 20 0 EIADMM O=S(=O)([N-]c1ccnc(-c2ccccc2)c1)c1cccc(Cl)c1 ZINC000479317696 1040266002 /nfs/dbraw/zinc/26/60/02/1040266002.db2.gz RZJNTTPODPZPHZ-UHFFFAOYSA-N -1 1 344.823 4.203 20 0 EIADMM C[C@@H](NC(=O)c1ccc(Br)c([O-])c1)[C@H](C)c1ccccc1 ZINC000491243124 1040330914 /nfs/dbraw/zinc/33/09/14/1040330914.db2.gz KQSDGQILAJWCCX-NWDGAFQWSA-N -1 1 348.240 4.077 20 0 EIADMM Cc1ccc(Cl)cc1[N-]S(=O)(=O)c1ccc2ncsc2c1 ZINC000479493401 1040405527 /nfs/dbraw/zinc/40/55/27/1040405527.db2.gz ZLXWZMCZEIXALL-UHFFFAOYSA-N -1 1 338.841 4.059 20 0 EIADMM Cc1cc(Br)c([O-])c(NC(=O)CCCC(F)(F)F)c1 ZINC000482673119 1040423734 /nfs/dbraw/zinc/42/37/34/1040423734.db2.gz MPDZCHMYWKDMME-UHFFFAOYSA-N -1 1 340.139 4.134 20 0 EIADMM CCc1ccsc1C(=O)Nc1cc(C)cc(Br)c1[O-] ZINC000482673028 1040424189 /nfs/dbraw/zinc/42/41/89/1040424189.db2.gz LPCQQUMWQLRAHV-UHFFFAOYSA-N -1 1 340.242 4.339 20 0 EIADMM CCc1ccc(S(=O)(=O)[N-]c2ccccc2CC(F)(F)F)cc1 ZINC000460818279 1040949135 /nfs/dbraw/zinc/94/91/35/1040949135.db2.gz DNTOJTBUZYVHFT-UHFFFAOYSA-N -1 1 343.370 4.155 20 0 EIADMM Cc1nc(SCc2nc(-c3ccccc3)cs2)[n-]c(=O)c1C ZINC000436200838 1040953302 /nfs/dbraw/zinc/95/33/02/1040953302.db2.gz GVOQHQKMYACVJF-UHFFFAOYSA-N -1 1 329.450 4.215 20 0 EIADMM CCCn1ccc2ccc([N-]S(=O)(=O)c3ccc(C)cc3)cc21 ZINC000460823574 1040960351 /nfs/dbraw/zinc/96/03/51/1040960351.db2.gz JWTQSOZGXIPLHF-UHFFFAOYSA-N -1 1 328.437 4.161 20 0 EIADMM CCOc1ccc([N-]S(=O)(=O)c2ccc(C)cc2Cl)c(C)c1 ZINC000515697301 1040998788 /nfs/dbraw/zinc/99/87/88/1040998788.db2.gz JNUJKYLEFMUKQM-UHFFFAOYSA-N -1 1 339.844 4.156 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2ccc(Cl)cc2Cl)sc1C ZINC000540212218 1041275133 /nfs/dbraw/zinc/27/51/33/1041275133.db2.gz DOEQMIYVKSILMI-UHFFFAOYSA-N -1 1 336.265 4.473 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1CC[C@H](c2ccccc2F)C1 ZINC000436486044 1041285519 /nfs/dbraw/zinc/28/55/19/1041285519.db2.gz IVRIVFLDINPAQN-INIZCTEOSA-N -1 1 335.378 4.314 20 0 EIADMM Cc1ccc2snc(-c3nc(-c4ccc([O-])c(F)c4)no3)c2c1 ZINC000436520937 1041302597 /nfs/dbraw/zinc/30/25/97/1041302597.db2.gz JUSUKBJHUXCZJL-UHFFFAOYSA-N -1 1 327.340 4.166 20 0 EIADMM O=C(c1cc(Cl)ccc1[O-])N1C[C@H](c2ccccc2)[C@H]2CCC[C@@H]21 ZINC000436552233 1041327620 /nfs/dbraw/zinc/32/76/20/1041327620.db2.gz BLOLUPPHNZXVHU-NXHRZFHOSA-N -1 1 341.838 4.454 20 0 EIADMM COc1ccc2c(c1)CCC[C@@H]2N(C)C(=O)c1ccc(Cl)cc1[O-] ZINC000436538070 1041334407 /nfs/dbraw/zinc/33/44/07/1041334407.db2.gz IUQYHHHHFDWCEV-KRWDZBQOSA-N -1 1 345.826 4.204 20 0 EIADMM O=C(c1cc(F)ccc1[O-])N1CC2(CCCC2)c2c1cccc2F ZINC000436544788 1041338608 /nfs/dbraw/zinc/33/86/08/1041338608.db2.gz QAKHMLBUZCMPBJ-UHFFFAOYSA-N -1 1 329.346 4.143 20 0 EIADMM O=C(Nc1cccc(NC(=O)C2CCCCC2)c1)c1ccccc1[O-] ZINC000436591934 1041351542 /nfs/dbraw/zinc/35/15/42/1041351542.db2.gz YQLRMCOGQUJGLZ-UHFFFAOYSA-N -1 1 338.407 4.163 20 0 EIADMM CCc1c(NC(=O)c2ccccc2[O-])cnn1-c1cccc(Cl)c1 ZINC000436596207 1041354890 /nfs/dbraw/zinc/35/48/90/1041354890.db2.gz PLCUSCLJIQSIPW-UHFFFAOYSA-N -1 1 341.798 4.046 20 0 EIADMM Cc1coc(-c2ccc(C)c(NC(=O)c3cc(F)ccc3[O-])c2)n1 ZINC000436586421 1041363607 /nfs/dbraw/zinc/36/36/07/1041363607.db2.gz TUIPTKMJKNBIES-UHFFFAOYSA-N -1 1 326.327 4.055 20 0 EIADMM COc1ccc(C[C@H](C)CN(C)C(=O)c2ccc(Cl)cc2[O-])cc1 ZINC000436664709 1041406172 /nfs/dbraw/zinc/40/61/72/1041406172.db2.gz MGLMTFDWRFLTMT-ZDUSSCGKSA-N -1 1 347.842 4.005 20 0 EIADMM Cc1ccc(-c2cncc(F)c2)cc1NC(=O)c1cc(F)ccc1[O-] ZINC000436672258 1041410357 /nfs/dbraw/zinc/41/03/57/1041410357.db2.gz BMVPYXSTSJRDPI-UHFFFAOYSA-N -1 1 340.329 4.293 20 0 EIADMM O=C(NCc1ccc2ccccc2n1)c1cc2ccccc2cc1[O-] ZINC000436703798 1041433881 /nfs/dbraw/zinc/43/38/81/1041433881.db2.gz IBPQGMAEVACWSW-UHFFFAOYSA-N -1 1 328.371 4.024 20 0 EIADMM CCOc1ccccc1CN(C)C(=O)c1cc2ccccc2cc1[O-] ZINC000436729801 1041453697 /nfs/dbraw/zinc/45/36/97/1041453697.db2.gz SYZHAFKNSBFVAN-UHFFFAOYSA-N -1 1 335.403 4.216 20 0 EIADMM C[C@@H](c1ccc(C(F)(F)F)cc1)N(C)C(=O)c1cc(F)ccc1[O-] ZINC000436757215 1041466927 /nfs/dbraw/zinc/46/69/27/1041466927.db2.gz HNCPTGZJKKSCAM-JTQLQIEISA-N -1 1 341.304 4.383 20 0 EIADMM C[C@@H](NC(=O)c1c(F)ccc([O-])c1F)c1ccccc1C(F)(F)F ZINC000554861936 1041468306 /nfs/dbraw/zinc/46/83/06/1041468306.db2.gz UVRPQAYLIKNWDX-MRVPVSSYSA-N -1 1 345.267 4.180 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cnc4c(F)cccc4c3)n2)c(Cl)c1 ZINC000436781085 1041472374 /nfs/dbraw/zinc/47/23/74/1041472374.db2.gz BJRRFAIEQNEFFR-UHFFFAOYSA-N -1 1 341.729 4.450 20 0 EIADMM O=C(Nc1ccccc1OC(F)F)c1ccc(C(F)(F)F)cc1[O-] ZINC000436794486 1041485734 /nfs/dbraw/zinc/48/57/34/1041485734.db2.gz OIPQKBNBVMCLIP-UHFFFAOYSA-N -1 1 347.239 4.265 20 0 EIADMM CC[C@H]1CN(C(=O)c2cc(F)ccc2[O-])c2cccc(Cl)c2O1 ZINC000436829507 1041495186 /nfs/dbraw/zinc/49/51/86/1041495186.db2.gz BGXKSOZJCDWADM-NSHDSACASA-N -1 1 335.762 4.003 20 0 EIADMM O=C(c1ccc(C(F)(F)F)cc1[O-])N1CCC[C@@H](c2ccccc2)C1 ZINC000436852201 1041518628 /nfs/dbraw/zinc/51/86/28/1041518628.db2.gz OGDPIADPGPINFQ-CQSZACIVSA-N -1 1 349.352 4.431 20 0 EIADMM C[C@@H]1C[C@H]1c1ccc(CN(C(=O)c2ccc([O-])cc2F)C2CC2)o1 ZINC000436864058 1041524116 /nfs/dbraw/zinc/52/41/16/1041524116.db2.gz XDVUGNMKZUZPOG-BDJLRTHQSA-N -1 1 329.371 4.053 20 0 EIADMM Cc1cc(C(=O)Nc2ccc(Cl)cc2[O-])nn1-c1ccc(C)cc1 ZINC000436872818 1041531465 /nfs/dbraw/zinc/53/14/65/1041531465.db2.gz NSLLYMXAHVHCMI-UHFFFAOYSA-N -1 1 341.798 4.100 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cncc(C(F)(F)F)c3)n2)c(Cl)c1 ZINC000436872444 1041531785 /nfs/dbraw/zinc/53/17/85/1041531785.db2.gz MWOMOZUQJOGTSY-UHFFFAOYSA-N -1 1 341.676 4.176 20 0 EIADMM [O-]c1ccc(-c2noc(-c3ccc(Cl)c4ncccc34)n2)c(F)c1 ZINC000436875574 1041532746 /nfs/dbraw/zinc/53/27/46/1041532746.db2.gz UTFITLMOPRGVRM-UHFFFAOYSA-N -1 1 341.729 4.450 20 0 EIADMM COc1ccc2[nH]c(-c3nc(-c4ccc([O-])cc4Cl)no3)cc2c1 ZINC000436874675 1041533410 /nfs/dbraw/zinc/53/34/10/1041533410.db2.gz USVLXZXZRYMSAK-UHFFFAOYSA-N -1 1 341.754 4.253 20 0 EIADMM C[C@H](c1cn(C)c2ccccc12)c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000436877111 1041534008 /nfs/dbraw/zinc/53/40/08/1041534008.db2.gz DTCMKXTYTPGEAB-LLVKDONJSA-N -1 1 337.354 4.225 20 0 EIADMM O=C(c1ccc([O-])cc1F)N(CCc1cccc(F)c1)C1CCCC1 ZINC000436876785 1041536400 /nfs/dbraw/zinc/53/64/00/1041536400.db2.gz KQXLEXWXGIBEJZ-UHFFFAOYSA-N -1 1 345.389 4.298 20 0 EIADMM O=C(NC1c2ccccc2Oc2ccccc21)c1ccc([O-])cc1F ZINC000436880092 1041537746 /nfs/dbraw/zinc/53/77/46/1041537746.db2.gz INLCWWJOVZVBDN-UHFFFAOYSA-N -1 1 335.334 4.156 20 0 EIADMM Cc1onc(-c2ccccc2)c1-c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000436881544 1041538606 /nfs/dbraw/zinc/53/86/06/1041538606.db2.gz XCVLYCXHYHLDHD-UHFFFAOYSA-N -1 1 337.310 4.212 20 0 EIADMM C[C@@H](Cn1ccc2ccccc21)c1nc(-c2ccc([O-])cc2F)no1 ZINC000436881664 1041539720 /nfs/dbraw/zinc/53/97/20/1041539720.db2.gz XUIREQRIYCOWCN-LBPRGKRZSA-N -1 1 337.354 4.340 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1CCC(CC(F)(F)F)CC1 ZINC000436888323 1041541692 /nfs/dbraw/zinc/54/16/92/1041541692.db2.gz SWDKNRRQMKMRSY-UHFFFAOYSA-N -1 1 337.341 4.350 20 0 EIADMM CC(C)(C)C[C@@H](NC(=O)C(=O)c1ccc([O-])cc1)c1ccc(F)cc1 ZINC000436899124 1041552053 /nfs/dbraw/zinc/55/20/53/1041552053.db2.gz BJXRNTAPFUWVBC-QGZVFWFLSA-N -1 1 343.398 4.008 20 0 EIADMM [O-]c1ccc(-c2nc(-c3ccc(N4CCCCC4)cc3)no2)c(F)c1 ZINC000904614839 1041554976 /nfs/dbraw/zinc/55/49/76/1041554976.db2.gz MRHKPCDDGUHMPV-UHFFFAOYSA-N -1 1 339.370 4.239 20 0 EIADMM O=C(Nc1ccc2c(c1)Cc1ccccc1-2)c1c(F)ccc([O-])c1F ZINC000538832853 1041555678 /nfs/dbraw/zinc/55/56/78/1041555678.db2.gz QHPXOJJUDCQTGZ-UHFFFAOYSA-N -1 1 337.325 4.494 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1CC[C@H](COc2ccccc2)C1 ZINC000436918975 1041557220 /nfs/dbraw/zinc/55/72/20/1041557220.db2.gz LLWWGXWANKXRIK-INIZCTEOSA-N -1 1 347.414 4.087 20 0 EIADMM C[C@@H](NC(=O)c1c([O-])cccc1F)c1nc(-c2ccccc2)cs1 ZINC000436958109 1041574647 /nfs/dbraw/zinc/57/46/47/1041574647.db2.gz ZIGQUEBKAKCYMW-LLVKDONJSA-N -1 1 342.395 4.146 20 0 EIADMM [O-]c1ccc(Oc2ccccc2)cc1-c1nc(-c2cscn2)no1 ZINC000436955053 1041574917 /nfs/dbraw/zinc/57/49/17/1041574917.db2.gz CSLGUBYBTPMKEU-UHFFFAOYSA-N -1 1 337.360 4.358 20 0 EIADMM CC(=O)Nc1ccc([O-])c(-c2nc(-c3ccc(C(C)C)cc3)no2)c1 ZINC000436994422 1041585328 /nfs/dbraw/zinc/58/53/28/1041585328.db2.gz MUVPHGHJHGIPDW-UHFFFAOYSA-N -1 1 337.379 4.191 20 0 EIADMM CCc1ccc(S(=O)(=O)[N-]c2cc(C)c(C)c3ncccc23)cc1 ZINC000437324286 1041755226 /nfs/dbraw/zinc/75/52/26/1041755226.db2.gz DKKRMHLMQLAFKJ-UHFFFAOYSA-N -1 1 340.448 4.215 20 0 EIADMM Cc1ccc2cccnc2c1S(=O)(=O)[N-]c1ccsc1Cl ZINC000437671052 1041875081 /nfs/dbraw/zinc/87/50/81/1041875081.db2.gz HHQXPMXOKKSIMW-UHFFFAOYSA-N -1 1 338.841 4.059 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc(C(=O)C(C)(C)C)cc2)cc1F ZINC000425963799 1042097238 /nfs/dbraw/zinc/09/72/38/1042097238.db2.gz DKJPYSXXHZEWRZ-UHFFFAOYSA-N -1 1 349.427 4.164 20 0 EIADMM O=C(Nc1ccc2cccc(Cl)c2n1)c1c(F)ccc([O-])c1F ZINC000438877434 1042400177 /nfs/dbraw/zinc/40/01/77/1042400177.db2.gz AFNAYULGSROGSA-UHFFFAOYSA-N -1 1 334.709 4.124 20 0 EIADMM O=C(N[C@@H](c1cccs1)c1ccc(Cl)cc1)c1cncc([O-])c1 ZINC000518346675 1042477863 /nfs/dbraw/zinc/47/78/63/1042477863.db2.gz SRQUCRVOFNNTMD-MRXNPFEDSA-N -1 1 344.823 4.022 20 0 EIADMM C[C@@H](C(=O)[N-]OCc1ccc(C(F)(F)F)cc1)c1ccsc1 ZINC000152227887 1042721945 /nfs/dbraw/zinc/72/19/45/1042721945.db2.gz FTSIRBJGMWRFDS-SNVBAGLBSA-N -1 1 329.343 4.118 20 0 EIADMM O=C(Nc1ccccc1-c1cn[nH]c1)c1ccc2ccccc2c1[O-] ZINC000439740888 1042756766 /nfs/dbraw/zinc/75/67/66/1042756766.db2.gz DHBOJJVSDMJSKJ-UHFFFAOYSA-N -1 1 329.359 4.188 20 0 EIADMM O=S(=O)([N-]c1ccccc1Cc1ccccc1)c1cccc(F)c1 ZINC000007057538 1042918964 /nfs/dbraw/zinc/91/89/64/1042918964.db2.gz CAZXHCUMJUNBGX-UHFFFAOYSA-N -1 1 341.407 4.217 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1cccn1Cc1cccs1 ZINC000182878734 1043035801 /nfs/dbraw/zinc/03/58/01/1043035801.db2.gz GPHUVZVNZBUOTJ-UHFFFAOYSA-N -1 1 332.812 4.209 20 0 EIADMM Cc1ccc(F)cc1S(=O)(=O)[N-]c1cccc(SC(F)F)c1 ZINC000727363445 1043209196 /nfs/dbraw/zinc/20/91/96/1043209196.db2.gz PIBWQSLTFQUVBL-UHFFFAOYSA-N -1 1 347.383 4.250 20 0 EIADMM CC(C)COc1cccc(OCC(=O)Nc2ccc([O-])c(Cl)c2)c1 ZINC000509178413 1043212822 /nfs/dbraw/zinc/21/28/22/1043212822.db2.gz MQQJCSFWKHRFCN-UHFFFAOYSA-N -1 1 349.814 4.098 20 0 EIADMM C[C@@H](CC(=O)c1ccccc1F)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000509180856 1043216127 /nfs/dbraw/zinc/21/61/27/1043216127.db2.gz FXFPODYXACLXBY-JTQLQIEISA-N -1 1 335.762 4.032 20 0 EIADMM CC(C)c1ccc([N-]S(=O)(=O)c2cccc3ncccc32)cc1 ZINC000508033090 1043234590 /nfs/dbraw/zinc/23/45/90/1043234590.db2.gz PRKAJQVHGNXQER-UHFFFAOYSA-N -1 1 326.421 4.159 20 0 EIADMM O=C([N-]c1cc(Cl)ccc1SCC(F)(F)F)c1cocn1 ZINC000133381530 1043259699 /nfs/dbraw/zinc/25/96/99/1043259699.db2.gz BAMPLCQSCSBRQO-UHFFFAOYSA-N -1 1 336.722 4.235 20 0 EIADMM CC(C)[C@H](NCc1ccc(-c2cccc(C(F)(F)F)c2)o1)C(=O)[O-] ZINC000113404709 1043279807 /nfs/dbraw/zinc/27/98/07/1043279807.db2.gz AOJZIRGOQLSCON-HNNXBMFYSA-N -1 1 341.329 4.164 20 0 EIADMM CCc1ccccc1S(=O)(=O)[N-]c1ccc(C)c(-c2ncco2)c1 ZINC000187570704 1043359876 /nfs/dbraw/zinc/35/98/76/1043359876.db2.gz XDHWNLOVFUHPIZ-UHFFFAOYSA-N -1 1 342.420 4.013 20 0 EIADMM Cc1ccc(-c2ccccc2-c2noc(-c3ncccc3[O-])n2)cc1 ZINC001212481002 1043436647 /nfs/dbraw/zinc/43/66/47/1043436647.db2.gz UTAOEQRMJSZAIA-UHFFFAOYSA-N -1 1 329.359 4.480 20 0 EIADMM [O-]c1cccnc1-c1nc(-c2cccc(OCc3ccccc3)c2)no1 ZINC001212480797 1043437938 /nfs/dbraw/zinc/43/79/38/1043437938.db2.gz JGKRWXIFQVKVQK-UHFFFAOYSA-N -1 1 345.358 4.083 20 0 EIADMM CC(C)c1noc([C@H](C)OC(=O)c2ccc(Cl)c(Cl)c2[O-])n1 ZINC000730360387 1043503697 /nfs/dbraw/zinc/50/36/97/1043503697.db2.gz UEOBTKHLKIBFFD-ZETCQYMHSA-N -1 1 345.182 4.123 20 0 EIADMM CSc1ccncc1[N-]C(=O)c1cc(-c2cccc(Cl)c2)on1 ZINC000674257430 1043506131 /nfs/dbraw/zinc/50/61/31/1043506131.db2.gz NKOUTPWTOCIYQR-UHFFFAOYSA-N -1 1 345.811 4.364 20 0 EIADMM CC[C@@H](Sc1ccccc1)C(=O)N=c1cc(-c2cccs2)[n-][nH]1 ZINC000521181813 1043624543 /nfs/dbraw/zinc/62/45/43/1043624543.db2.gz ZMKMQEDUKNLPDU-CQSZACIVSA-N -1 1 343.477 4.070 20 0 EIADMM Cc1cc(C)c([N-]S(=O)(=O)c2cc(F)ccc2F)c(Cl)c1 ZINC000244016980 1043659632 /nfs/dbraw/zinc/65/96/32/1043659632.db2.gz SOEUHHGFXKDWLN-UHFFFAOYSA-N -1 1 331.771 4.036 20 0 EIADMM Cc1ccc(OCc2ccccc2)c(NC(=O)c2ccc(O)cc2[O-])c1 ZINC000442419195 1043679916 /nfs/dbraw/zinc/67/99/16/1043679916.db2.gz MKPGDPLNKBGOPU-UHFFFAOYSA-N -1 1 349.386 4.238 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)Nc1ccc2c(c1)C(=O)CCC2 ZINC000190973873 1043756798 /nfs/dbraw/zinc/75/67/98/1043756798.db2.gz URHTVMHOXBWCRN-UHFFFAOYSA-N -1 1 330.771 4.209 20 0 EIADMM O=C(CCc1cccc(OC2CCCC2)c1)Nc1c([O-])cccc1F ZINC000078806968 1043779434 /nfs/dbraw/zinc/77/94/34/1043779434.db2.gz DPXXWIZUJPMEJN-UHFFFAOYSA-N -1 1 343.398 4.424 20 0 EIADMM CC(C)C(=O)c1ccc(S(=O)(=O)[N-]c2ccc3ccoc3c2)cc1 ZINC000442846815 1043856979 /nfs/dbraw/zinc/85/69/79/1043856979.db2.gz KCZMDVVXPZPOCL-UHFFFAOYSA-N -1 1 343.404 4.072 20 0 EIADMM CCN(Cc1ccccc1C)C(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC000442854586 1043874716 /nfs/dbraw/zinc/87/47/16/1043874716.db2.gz KUHSYMILOMCLOA-UHFFFAOYSA-N -1 1 333.815 4.025 20 0 EIADMM COc1ccc(NC(=O)Nc2ccc([O-])c(Cl)c2)c2cccnc12 ZINC000192209275 1043892896 /nfs/dbraw/zinc/89/28/96/1043892896.db2.gz VLFWQESQNISKKU-UHFFFAOYSA-N -1 1 343.770 4.246 20 0 EIADMM COc1cc(C(=O)N[C@]2(C)CCCc3ccccc32)cc(Cl)c1[O-] ZINC000442954019 1043900626 /nfs/dbraw/zinc/90/06/26/1043900626.db2.gz CODTUBFLVNPRIH-LJQANCHMSA-N -1 1 345.826 4.036 20 0 EIADMM CCC[C@@H](C)[C@@H]1CCCN1C(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC000443042931 1043979240 /nfs/dbraw/zinc/97/92/40/1043979240.db2.gz CSLXPQVOBNNCJN-RISCZKNCSA-N -1 1 325.836 4.095 20 0 EIADMM COc1cc(C(=O)N2CCC(CCC(C)C)CC2)cc(Cl)c1[O-] ZINC000443061191 1043981898 /nfs/dbraw/zinc/98/18/98/1043981898.db2.gz RCRNFOJYLHJFJU-UHFFFAOYSA-N -1 1 339.863 4.343 20 0 EIADMM COc1cc(-c2nc([C@H]3CCc4ccccc43)no2)cc(Cl)c1[O-] ZINC000443218054 1044104850 /nfs/dbraw/zinc/10/48/50/1044104850.db2.gz WWNDUQDBXYLPNT-ZDUSSCGKSA-N -1 1 342.782 4.182 20 0 EIADMM C[C@H]1C[C@@H](c2ccccc2)C[C@@H](NC(=O)c2c([O-])cccc2F)C1 ZINC001299309841 1044347928 /nfs/dbraw/zinc/34/79/28/1044347928.db2.gz QITFSYWIJZSYDJ-IMJJTQAJSA-N -1 1 327.399 4.234 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N(Cc1ccco1)CC(F)(F)F ZINC000113362820 1044535314 /nfs/dbraw/zinc/53/53/14/1044535314.db2.gz OFHBMOQOVJRNLI-UHFFFAOYSA-N -1 1 349.308 4.343 20 0 EIADMM Cc1cc(C)cc(-c2nnc([N-]C(=O)c3ncoc3C(C)C)s2)c1 ZINC000734355041 1044553248 /nfs/dbraw/zinc/55/32/48/1044553248.db2.gz GNKUZPBOVGPQOR-UHFFFAOYSA-N -1 1 342.424 4.186 20 0 EIADMM C[C@@H]1CCCC[C@@H]1OCc1nc(=O)c2c3ccccc3sc2[n-]1 ZINC000070694453 1044701518 /nfs/dbraw/zinc/70/15/18/1044701518.db2.gz BBRHKMDRCNTJNF-YPMHNXCESA-N -1 1 328.437 4.233 20 0 EIADMM CCC1=NO[C@@H](c2nc(=O)c3c(-c4ccc(C)cc4)csc3[n-]2)C1 ZINC000172996154 1044727770 /nfs/dbraw/zinc/72/77/70/1044727770.db2.gz HHYAWVUMZPDFEU-CQSZACIVSA-N -1 1 339.420 4.187 20 0 EIADMM Cc1cc(OC(F)F)c(C(=O)Nc2ccc([O-])c(Cl)c2)s1 ZINC000114559748 1044826108 /nfs/dbraw/zinc/82/61/08/1044826108.db2.gz AQERVKLUKBEVFA-UHFFFAOYSA-N -1 1 333.743 4.269 20 0 EIADMM O=S(=O)([N-]c1cccc(O)c1)c1ccc2oc3ccccc3c2c1 ZINC000536499061 1044864588 /nfs/dbraw/zinc/86/45/88/1044864588.db2.gz VMZNINOWEBBCMR-UHFFFAOYSA-N -1 1 339.372 4.092 20 0 EIADMM O=C(CSc1cccc(C(F)(F)F)c1)c1ccc([O-])cc1O ZINC000018263798 1045036185 /nfs/dbraw/zinc/03/61/85/1045036185.db2.gz HQYTZNSCDWMFJR-UHFFFAOYSA-N -1 1 328.311 4.092 20 0 EIADMM O=C(Nc1c([O-])cccc1F)c1cc(F)c(C(F)(F)F)c(F)c1 ZINC000683248275 1045270151 /nfs/dbraw/zinc/27/01/51/1045270151.db2.gz AQDKEBOWAVRGFQ-UHFFFAOYSA-N -1 1 335.203 4.081 20 0 EIADMM CC(C)c1ccc(S(=O)(=O)[N-]c2ccc(-c3ncc[nH]3)cc2)cc1 ZINC000170033831 1045531972 /nfs/dbraw/zinc/53/19/72/1045531972.db2.gz NBVALIJEZGYOIV-UHFFFAOYSA-N -1 1 341.436 4.001 20 0 EIADMM O=C(N[C@@H](c1ccccc1)C(F)(F)F)c1c([O-])cccc1Cl ZINC000769716744 1046053867 /nfs/dbraw/zinc/05/38/67/1046053867.db2.gz MRCWDOSVCIZDAN-ZDUSSCGKSA-N -1 1 329.705 4.079 20 0 EIADMM C[C@@H]1C[N@@H+](Cc2nc(=O)c3sccc3[n-]2)CC[C@H]1c1ccccc1 ZINC000253544670 1046058277 /nfs/dbraw/zinc/05/82/77/1046058277.db2.gz SUDCNRPJQAVMRN-UKRRQHHQSA-N -1 1 339.464 4.023 20 0 EIADMM C[C@@H]1CN(Cc2nc(=O)c3sccc3[n-]2)CC[C@H]1c1ccccc1 ZINC000253544670 1046058301 /nfs/dbraw/zinc/05/83/01/1046058301.db2.gz SUDCNRPJQAVMRN-UKRRQHHQSA-N -1 1 339.464 4.023 20 0 EIADMM O=C(N[C@@H](c1ccco1)c1ccccc1)c1c([O-])cccc1Cl ZINC000792804651 1046068500 /nfs/dbraw/zinc/06/85/00/1046068500.db2.gz UWEIKSXPMOLMII-QGZVFWFLSA-N -1 1 327.767 4.158 20 0 EIADMM O=C(Nc1ccc(CC[C@@H](O)c2ccccc2)cc1)c1ccccc1[O-] ZINC000769969933 1046112445 /nfs/dbraw/zinc/11/24/45/1046112445.db2.gz FDMNXCPKPMDGTK-HXUWFJFHSA-N -1 1 347.414 4.311 20 0 EIADMM O=C([O-])CC[C@@H]1CCCN(Cc2csc(-c3ccc(F)cc3)n2)C1 ZINC000263127373 1046254334 /nfs/dbraw/zinc/25/43/34/1046254334.db2.gz MPNRALSGJWJFHJ-ZDUSSCGKSA-N -1 1 348.443 4.026 20 0 EIADMM CCOc1cc(-c2noc(C(C)(Cl)Cl)n2)cc(Cl)c1[O-] ZINC000771110124 1046332755 /nfs/dbraw/zinc/33/27/55/1046332755.db2.gz UBQNDTWWKXESBM-UHFFFAOYSA-N -1 1 337.590 4.145 20 0 EIADMM C[C@@H](CC1CC1)[N-]S(=O)(=O)c1c(Cl)cc(Cl)cc1Cl ZINC000497243908 1046485582 /nfs/dbraw/zinc/48/55/82/1046485582.db2.gz AEUFBOPLVOHLDJ-ZETCQYMHSA-N -1 1 342.675 4.114 20 0 EIADMM Cc1nc(-c2ccco2)ccc1-c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445477120 1046761309 /nfs/dbraw/zinc/76/13/09/1046761309.db2.gz BBQORHLHCJZTAB-UHFFFAOYSA-N -1 1 337.310 4.212 20 0 EIADMM Cc1cc(C(=O)Nc2ccc([O-])c(Cl)c2)c2nccc(C)c2c1 ZINC000786427390 1046836912 /nfs/dbraw/zinc/83/69/12/1046836912.db2.gz QRCRXZPXLXYYRL-UHFFFAOYSA-N -1 1 326.783 4.463 20 0 EIADMM CCCCC1CCC(NC(=O)c2c(C)nc(C(C)C)[n-]c2=O)CC1 ZINC000747365355 1047398620 /nfs/dbraw/zinc/39/86/20/1047398620.db2.gz KSSXVXKTHBWKQL-UHFFFAOYSA-N -1 1 333.476 4.093 20 0 EIADMM Cc1nc(-c2ccccc2)sc1C(=O)Nc1nc(Cl)ccc1[O-] ZINC000789930618 1047485805 /nfs/dbraw/zinc/48/58/05/1047485805.db2.gz WHBSAPUWUPSACA-UHFFFAOYSA-N -1 1 345.811 4.125 20 0 EIADMM Cc1cc(F)cc(S(=O)(=O)[N-]c2ccc(CC(F)(F)F)cc2)c1 ZINC000476431982 1047808842 /nfs/dbraw/zinc/80/88/42/1047808842.db2.gz SRLYZIBQLKGSPO-UHFFFAOYSA-N -1 1 347.333 4.040 20 0 EIADMM CC(=O)Nc1ccc(C)c(NC(=O)c2ccc3ccccc3c2[O-])c1 ZINC000132204725 1048224170 /nfs/dbraw/zinc/22/41/70/1048224170.db2.gz GBWWEHDBNBJHGA-UHFFFAOYSA-N -1 1 334.375 4.065 20 0 EIADMM O=C(c1ncc2ccccc2c1[O-])N1CCC[C@H](Cc2ccccc2)C1 ZINC001144010927 1048365738 /nfs/dbraw/zinc/36/57/38/1048365738.db2.gz OFIGNOFBYCYMRI-QGZVFWFLSA-N -1 1 346.430 4.035 20 0 EIADMM C[C@H](NC(=O)c1c(F)ccc([O-])c1F)c1csc2ccccc21 ZINC000809668006 1048468432 /nfs/dbraw/zinc/46/84/32/1048468432.db2.gz PIYRBJJFMZAMIO-VIFPVBQESA-N -1 1 333.359 4.376 20 0 EIADMM CCc1noc(C)c1[N-]C(=O)c1cc(-c2cccc(Cl)c2)on1 ZINC000133045988 1048568310 /nfs/dbraw/zinc/56/83/10/1048568310.db2.gz QPRYICKJDLFDEQ-UHFFFAOYSA-N -1 1 331.759 4.106 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1ccc(OC(F)F)c(F)c1 ZINC000815851986 1048622184 /nfs/dbraw/zinc/62/21/84/1048622184.db2.gz BXMPAFRIBMXOOO-UHFFFAOYSA-N -1 1 331.677 4.038 20 0 EIADMM CN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1c([O-])cccc1Cl ZINC000920427220 1048665622 /nfs/dbraw/zinc/66/56/22/1048665622.db2.gz SOEAAKCCAIXYQT-UHFFFAOYSA-N -1 1 343.732 4.337 20 0 EIADMM CN(Cc1cccc2ccccc21)C(=O)c1c([O-])cccc1Cl ZINC000920444856 1048675237 /nfs/dbraw/zinc/67/52/37/1048675237.db2.gz NHPXTYBEYHJXRK-UHFFFAOYSA-N -1 1 325.795 4.471 20 0 EIADMM O=C(NCc1ccc(F)cc1C(F)(F)F)c1c([O-])cccc1Cl ZINC000920452393 1048677346 /nfs/dbraw/zinc/67/73/46/1048677346.db2.gz WFKRQVZVCCOESE-UHFFFAOYSA-N -1 1 347.695 4.134 20 0 EIADMM [O-]c1cc(F)c(CN2CC[C@H](c3ccccc3)C(F)(F)C2)c(F)c1 ZINC001144567631 1048732479 /nfs/dbraw/zinc/73/24/79/1048732479.db2.gz WBQUGSPQIICMJC-OAHLLOKOSA-N -1 1 339.332 4.295 20 0 EIADMM Cc1ccc(-c2csc3[n-]c(-c4ncc(C)cn4)nc(=O)c23)c(C)c1 ZINC000133650200 1048755176 /nfs/dbraw/zinc/75/51/76/1048755176.db2.gz COSHSNNBXZMGBJ-UHFFFAOYSA-N -1 1 348.431 4.034 20 0 EIADMM Cc1ccccc1O[C@H]1CCCN(Cc2cc(F)c([O-])cc2F)C1 ZINC001144666490 1048784240 /nfs/dbraw/zinc/78/42/40/1048784240.db2.gz KTICEOVWRSVHEE-HNNXBMFYSA-N -1 1 333.378 4.022 20 0 EIADMM CC(=O)OCCCc1cccc(NCc2cccc([O-])c2Cl)c1 ZINC000816570830 1048839404 /nfs/dbraw/zinc/83/94/04/1048839404.db2.gz IOFAQNURKFDHPM-UHFFFAOYSA-N -1 1 333.815 4.153 20 0 EIADMM C[C@@H]1CCc2ccccc2N1C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC001135679586 1048853893 /nfs/dbraw/zinc/85/38/93/1048853893.db2.gz WDMUSCODHPTVIM-LLVKDONJSA-N -1 1 335.325 4.393 20 0 EIADMM O=C(N[C@H](c1ccc(Cl)cc1)C1CCCC1)c1ccc([O-])cn1 ZINC001144844053 1048868303 /nfs/dbraw/zinc/86/83/03/1048868303.db2.gz ZDTLYJFGQODPDN-KRWDZBQOSA-N -1 1 330.815 4.102 20 0 EIADMM O=C(c1ncc2ccccc2c1[O-])N1CC=C(c2ccc(F)cc2)CC1 ZINC001135773718 1048884002 /nfs/dbraw/zinc/88/40/02/1048884002.db2.gz SXGVATCXKGSEIH-UHFFFAOYSA-N -1 1 348.377 4.009 20 0 EIADMM CCOc1ccc([C@@H]2CCCN2C(=O)c2ccc(Cl)cc2[O-])cc1 ZINC001135791513 1048886209 /nfs/dbraw/zinc/88/62/09/1048886209.db2.gz POALSXBQHWWGPY-KRWDZBQOSA-N -1 1 345.826 4.422 20 0 EIADMM CSCc1cccc([N-]S(=O)(=O)c2ccc(F)c(Cl)c2)c1 ZINC000609459515 1049073339 /nfs/dbraw/zinc/07/33/39/1049073339.db2.gz XIGXCRHIYXOPLS-UHFFFAOYSA-N -1 1 345.848 4.143 20 0 EIADMM CC(C)(C)O[C@H](C(=O)Nc1cc([O-])c(F)cc1F)c1ccccc1 ZINC000818033558 1049084382 /nfs/dbraw/zinc/08/43/82/1049084382.db2.gz LZQGSBADUJCBAE-INIZCTEOSA-N -1 1 335.350 4.165 20 0 EIADMM Cc1ccccc1C[C@H]1CCCN1C(=O)Cc1ccc([O-])c(Cl)c1 ZINC001147074722 1049086017 /nfs/dbraw/zinc/08/60/17/1049086017.db2.gz XQSFGGDNNMZYNM-QGZVFWFLSA-N -1 1 343.854 4.130 20 0 EIADMM CCOc1cc(C(=O)NC(CC)(C2CC2)C2CC2)cc(Cl)c1[O-] ZINC001147385809 1049141396 /nfs/dbraw/zinc/14/13/96/1049141396.db2.gz YKFZDURWAZNIFA-UHFFFAOYSA-N -1 1 337.847 4.143 20 0 EIADMM Cc1ccc(NC(=O)c2cncc([O-])c2)cc1OCC1CCCCC1 ZINC001147472430 1049156268 /nfs/dbraw/zinc/15/62/68/1049156268.db2.gz YMKRBTUAQGEFCD-UHFFFAOYSA-N -1 1 340.423 4.307 20 0 EIADMM O=C(N[C@@H]1CCC[C@@H]1Cc1ccccc1)c1cc(Cl)ccc1[O-] ZINC001147496501 1049165728 /nfs/dbraw/zinc/16/57/28/1049165728.db2.gz ZFXONCNBJULPNB-RHSMWYFYSA-N -1 1 329.827 4.187 20 0 EIADMM O=C(N[C@@H](c1ccccc1)C1CC1)c1cc(Br)ccc1[O-] ZINC001136149687 1049179809 /nfs/dbraw/zinc/17/98/09/1049179809.db2.gz VDSLOHQCERCOJJ-INIZCTEOSA-N -1 1 346.224 4.036 20 0 EIADMM O=C(c1ccc2ccc(O)cc2c1[O-])N(Cc1cccs1)C1CC1 ZINC001136163141 1049204087 /nfs/dbraw/zinc/20/40/87/1049204087.db2.gz WGNTXGPUEFGGMX-UHFFFAOYSA-N -1 1 339.416 4.117 20 0 EIADMM COc1cc(C(=O)N(C)[C@H](C)c2ccc(C)cc2)cc(Cl)c1[O-] ZINC000135772605 1049267406 /nfs/dbraw/zinc/26/74/06/1049267406.db2.gz CROWLJNVUMUUMC-GFCCVEGCSA-N -1 1 333.815 4.196 20 0 EIADMM Cc1c(Cl)nccc1[N-]S(=O)(=O)c1ccccc1C(C)(C)C ZINC000811835763 1049285410 /nfs/dbraw/zinc/28/54/10/1049285410.db2.gz NOPQOCWAMBPRLP-UHFFFAOYSA-N -1 1 338.860 4.142 20 0 EIADMM O=S(=O)(/C=C\c1ccc(Cl)cc1)[N-]c1cc(C2CC2)ccn1 ZINC000811838084 1049289868 /nfs/dbraw/zinc/28/98/68/1049289868.db2.gz SEXPFNFEDBFLMU-NTMALXAHSA-N -1 1 334.828 4.025 20 0 EIADMM O=S(=O)(/C=C/c1ccc(Cl)cc1)[N-]c1cc(C2CC2)ccn1 ZINC000811838083 1049290274 /nfs/dbraw/zinc/29/02/74/1049290274.db2.gz SEXPFNFEDBFLMU-CSKARUKUSA-N -1 1 334.828 4.025 20 0 EIADMM O=C(Nc1cccc(C(F)(F)F)c1[O-])c1ccc(-n2cccc2)cc1 ZINC001148696494 1049355653 /nfs/dbraw/zinc/35/56/53/1049355653.db2.gz PLWTYGDCHHVJJX-UHFFFAOYSA-N -1 1 346.308 4.454 20 0 EIADMM C[C@H]1CN(C(=O)c2ccc(C(F)(F)F)cc2[O-])Cc2ccccc21 ZINC001148795114 1049379644 /nfs/dbraw/zinc/37/96/44/1049379644.db2.gz UWSNPOSUAXZYMG-NSHDSACASA-N -1 1 335.325 4.171 20 0 EIADMM O=C(Nc1ccccc1-c1cc[nH]n1)c1ccc(C(F)(F)F)cc1[O-] ZINC001148801356 1049382220 /nfs/dbraw/zinc/38/22/20/1049382220.db2.gz ZSNSHDYRLKCZQQ-UHFFFAOYSA-N -1 1 347.296 4.053 20 0 EIADMM Cc1[nH]nc2cc(NC(=O)c3cc(Cl)cc(Cl)c3[O-])ccc12 ZINC001148815027 1049385301 /nfs/dbraw/zinc/38/53/01/1049385301.db2.gz GLINYBVDMAXJCX-UHFFFAOYSA-N -1 1 336.178 4.136 20 0 EIADMM C[C@@]1(F)CCCCN(C(=O)c2cccc(-c3ccccc3)c2[O-])C1 ZINC001148867461 1049390339 /nfs/dbraw/zinc/39/03/39/1049390339.db2.gz VQQSOJIXUYRTRS-HXUWFJFHSA-N -1 1 327.399 4.414 20 0 EIADMM O=C(N[C@H]1CCCc2cnccc21)c1cccc(-c2ccccc2)c1[O-] ZINC001148872981 1049393020 /nfs/dbraw/zinc/39/30/20/1049393020.db2.gz OKIJCCWKSHIVGE-FQEVSTJZSA-N -1 1 344.414 4.262 20 0 EIADMM O=C(NCC1(c2cccc(Cl)c2)CCCC1)c1cc(F)ccc1[O-] ZINC001136399480 1049583751 /nfs/dbraw/zinc/58/37/51/1049583751.db2.gz AJEGDNQEIDJLOI-UHFFFAOYSA-N -1 1 347.817 4.427 20 0 EIADMM O=C(N[C@H](c1ccccc1)[C@@H]1CCCO1)c1ccc2ccccc2c1[O-] ZINC001136524624 1049715090 /nfs/dbraw/zinc/71/50/90/1049715090.db2.gz IREJJLYPLXWCIE-VQTJNVASSA-N -1 1 347.414 4.196 20 0 EIADMM CC[C@H](NC(=O)c1cc(Br)ccc1[O-])c1ccc(C)cc1 ZINC001136536176 1049729306 /nfs/dbraw/zinc/72/93/06/1049729306.db2.gz SLLFUYKMNMXCMI-HNNXBMFYSA-N -1 1 348.240 4.344 20 0 EIADMM COc1ccccc1C1(CNC(=O)c2ccc3ccccc3c2[O-])CC1 ZINC001136544877 1049735642 /nfs/dbraw/zinc/73/56/42/1049735642.db2.gz IMINOQTXMLVART-UHFFFAOYSA-N -1 1 347.414 4.016 20 0 EIADMM O=C(NCC1(c2ccc(Cl)cc2)CCC1)c1ccc(F)c([O-])c1 ZINC001136572182 1049753933 /nfs/dbraw/zinc/75/39/33/1049753933.db2.gz QLQBPQKWIQNCHT-UHFFFAOYSA-N -1 1 333.790 4.036 20 0 EIADMM CC1(C)[C@H](c2ccccc2F)CCN1C(=O)c1ccc([O-])c(F)c1 ZINC001171854710 1049813469 /nfs/dbraw/zinc/81/34/69/1049813469.db2.gz KMVABIMSKNLEAN-AWEZNQCLSA-N -1 1 331.362 4.079 20 0 EIADMM CCCN(CCc1cccc(F)c1)C(=O)c1c([O-])cccc1Cl ZINC001136737799 1049856876 /nfs/dbraw/zinc/85/68/76/1049856876.db2.gz QQIIELDMPKFCMB-UHFFFAOYSA-N -1 1 335.806 4.280 20 0 EIADMM Cc1ccc([C@@H]2CSCCN2C(=O)c2ccc(Cl)cc2[O-])cc1 ZINC001136744598 1049859365 /nfs/dbraw/zinc/85/93/65/1049859365.db2.gz WMKCGJOMKHPBLO-INIZCTEOSA-N -1 1 347.867 4.284 20 0 EIADMM O=C(Nc1ccc2c(c1)CCC2)Nc1cccc([O-])c1Br ZINC001185766294 1050154033 /nfs/dbraw/zinc/15/40/33/1050154033.db2.gz TVGICRLMKWJGNV-UHFFFAOYSA-N -1 1 347.212 4.287 20 0 EIADMM COc1cccc2c([N-]S(=O)(=O)c3cccc(F)c3C)cccc12 ZINC001185837379 1050168035 /nfs/dbraw/zinc/16/80/35/1050168035.db2.gz ZFWAPLZKDZNOPZ-UHFFFAOYSA-N -1 1 345.395 4.097 20 0 EIADMM Cc1c(F)cccc1S(=O)(=O)[N-]c1ccc2cc(F)ccc2c1 ZINC001185836716 1050168378 /nfs/dbraw/zinc/16/83/78/1050168378.db2.gz VCPZGCYSISZKCS-UHFFFAOYSA-N -1 1 333.359 4.227 20 0 EIADMM FC(F)(F)c1cnc(-c2nc(-c3cc(Cl)cc(Cl)c3)no2)[n-]1 ZINC001212690154 1050228253 /nfs/dbraw/zinc/22/82/53/1050228253.db2.gz ZZEWNEACEZFOSQ-UHFFFAOYSA-N -1 1 349.099 4.452 20 0 EIADMM FC(F)(F)c1c[n-]c(-c2nc(-c3cc(Cl)cc(Cl)c3)no2)n1 ZINC001212690154 1050228263 /nfs/dbraw/zinc/22/82/63/1050228263.db2.gz ZZEWNEACEZFOSQ-UHFFFAOYSA-N -1 1 349.099 4.452 20 0 EIADMM FC(F)(F)c1cnc(-c2nc(-c3ccc(Cl)cc3Cl)no2)[n-]1 ZINC001212689866 1050230056 /nfs/dbraw/zinc/23/00/56/1050230056.db2.gz QKCQANUFLRXCGU-UHFFFAOYSA-N -1 1 349.099 4.452 20 0 EIADMM FC(F)(F)c1c[n-]c(-c2nc(-c3ccc(Cl)cc3Cl)no2)n1 ZINC001212689866 1050230071 /nfs/dbraw/zinc/23/00/71/1050230071.db2.gz QKCQANUFLRXCGU-UHFFFAOYSA-N -1 1 349.099 4.452 20 0 EIADMM Cc1nc(Br)ccc1Nc1c(F)ccc([O-])c1Cl ZINC001250228986 1050236568 /nfs/dbraw/zinc/23/65/68/1050236568.db2.gz RLSREAFIKNLXLS-UHFFFAOYSA-N -1 1 331.572 4.394 20 0 EIADMM Cc1cc(F)c([N-]S(=O)(=O)c2csc3ccccc32)cc1F ZINC001186497840 1050338261 /nfs/dbraw/zinc/33/82/61/1050338261.db2.gz IFMSLHVMEBXSFB-UHFFFAOYSA-N -1 1 339.388 4.289 20 0 EIADMM O=C(Nc1cc([O-])c(Cl)cc1F)N[C@H]1CCCc2ccccc21 ZINC001186458325 1050341313 /nfs/dbraw/zinc/34/13/13/1050341313.db2.gz SWRITRUAZGDNOY-AWEZNQCLSA-N -1 1 334.778 4.384 20 0 EIADMM CC(C)(CCc1ccccc1)[N-]S(=O)(=O)c1sccc1Cl ZINC001186461923 1050345584 /nfs/dbraw/zinc/34/55/84/1050345584.db2.gz UVJZZKUJQMWXMD-UHFFFAOYSA-N -1 1 343.901 4.091 20 0 EIADMM O=C(Nc1ccccc1SC(F)(F)F)c1ccc([O-])cc1F ZINC000181933922 1050391851 /nfs/dbraw/zinc/39/18/51/1050391851.db2.gz PXHAQHTZJBJUNC-UHFFFAOYSA-N -1 1 331.290 4.396 20 0 EIADMM O=C(Nc1cc([O-])c(Cl)cc1F)NC12CC3CC(CC(C3)C1)C2 ZINC001186677349 1050396439 /nfs/dbraw/zinc/39/64/39/1050396439.db2.gz HCRLGUNFHVKPJX-UHFFFAOYSA-N -1 1 338.810 4.275 20 0 EIADMM CC(C)(Cc1ccccn1)C(=O)Nc1cccc(C(F)(F)F)c1[O-] ZINC001178186651 1050397632 /nfs/dbraw/zinc/39/76/32/1050397632.db2.gz BMNMSEQDBYDLRI-UHFFFAOYSA-N -1 1 338.329 4.013 20 0 EIADMM O=C(NCc1ccc(C(F)(F)F)cc1)Nc1cc(F)c([O-])cc1F ZINC001186815809 1050424647 /nfs/dbraw/zinc/42/46/47/1050424647.db2.gz FWSKTAPBHKLLFX-UHFFFAOYSA-N -1 1 346.255 4.011 20 0 EIADMM C[C@H](NC(=O)c1ccc2ccccc2c1[O-])c1c(F)cccc1F ZINC001178389191 1050451989 /nfs/dbraw/zinc/45/19/89/1050451989.db2.gz WPZXPDWQFLDWOJ-NSHDSACASA-N -1 1 327.330 4.315 20 0 EIADMM O=S(=O)([N-]c1ccc(F)cc1Cl)c1cc2c(s1)CCCC2 ZINC001187206807 1050508710 /nfs/dbraw/zinc/50/87/10/1050508710.db2.gz KYUHLEIWBVEGOF-UHFFFAOYSA-N -1 1 345.848 4.220 20 0 EIADMM Cc1cc(F)c([N-]S(=O)(=O)c2cc3c(s2)CCCC3)cc1F ZINC001187215251 1050511614 /nfs/dbraw/zinc/51/16/14/1050511614.db2.gz NAXJSNUGPXJPHO-UHFFFAOYSA-N -1 1 343.420 4.014 20 0 EIADMM Cc1nc(C(C)C)[n-]c(=O)c1C(=O)N1C[C@@H](C(C)C)c2ccccc21 ZINC000773774940 1050564802 /nfs/dbraw/zinc/56/48/02/1050564802.db2.gz CTRPRDCORPHUND-HNNXBMFYSA-N -1 1 339.439 4.014 20 0 EIADMM O=C(Nc1cc(F)cc(F)c1)Nc1cccc(C(F)(F)F)c1[O-] ZINC001187580299 1050577128 /nfs/dbraw/zinc/57/71/28/1050577128.db2.gz UTWSYYORRFDXMN-UHFFFAOYSA-N -1 1 332.228 4.333 20 0 EIADMM COc1ccc(Nc2ccc(F)c(Br)c2[O-])cc1F ZINC001173864981 1050592348 /nfs/dbraw/zinc/59/23/48/1050592348.db2.gz NHZYGVYNPMCABL-UHFFFAOYSA-N -1 1 330.128 4.185 20 0 EIADMM O=C(CCCOc1cccc(F)c1)Nc1cc(F)c([O-])cc1Cl ZINC001179655455 1050737548 /nfs/dbraw/zinc/73/75/48/1050737548.db2.gz GEYKIELDURLLOY-UHFFFAOYSA-N -1 1 341.741 4.122 20 0 EIADMM O=C(CSc1ccc(F)c(F)c1)Nc1cc(F)c([O-])cc1Cl ZINC001179656584 1050737787 /nfs/dbraw/zinc/73/77/87/1050737787.db2.gz UCPFRKNKMPKWSD-UHFFFAOYSA-N -1 1 347.745 4.194 20 0 EIADMM O=C(CSCc1cccs1)Nc1cc(F)c([O-])cc1Cl ZINC001179656880 1050739206 /nfs/dbraw/zinc/73/92/06/1050739206.db2.gz XTYPFAKTKJCUAE-UHFFFAOYSA-N -1 1 331.821 4.118 20 0 EIADMM C[C@H](CCOc1ccccc1)C(=O)Nc1cc(F)c([O-])cc1Cl ZINC001179660477 1050739589 /nfs/dbraw/zinc/73/95/89/1050739589.db2.gz TVCHTGYNWDICBF-LLVKDONJSA-N -1 1 337.778 4.228 20 0 EIADMM O=C(Nc1cc(F)c([O-])cc1Cl)[C@@H]1C[C@H]1c1c(F)cccc1F ZINC001179657048 1050739691 /nfs/dbraw/zinc/73/96/91/1050739691.db2.gz ZWURZPSWTPDKLW-HTQZYQBOSA-N -1 1 341.716 4.205 20 0 EIADMM O=S(=O)([N-]c1ccc(F)cc1)c1ccc(-c2ccc(F)cc2)cc1 ZINC001188419206 1050762722 /nfs/dbraw/zinc/76/27/22/1050762722.db2.gz AJSMEEVXPJCSEA-UHFFFAOYSA-N -1 1 345.370 4.433 20 0 EIADMM O=C(Nc1cccc(C(F)(F)F)c1[O-])c1ccc(C(F)(F)F)[nH]1 ZINC001188508068 1050789124 /nfs/dbraw/zinc/78/91/24/1050789124.db2.gz BQQZLZBTRGKYFK-UHFFFAOYSA-N -1 1 338.207 4.010 20 0 EIADMM O=C(/C=C/c1ccc([O-])c(Br)c1)c1cccc(F)c1F ZINC000182723751 1050803758 /nfs/dbraw/zinc/80/37/58/1050803758.db2.gz LGDRCMOVABKKBT-GQCTYLIASA-N -1 1 339.135 4.329 20 0 EIADMM Cc1ccc(CC(=O)Nc2cccc(C(F)(F)F)c2[O-])cc1F ZINC001179938624 1050822963 /nfs/dbraw/zinc/82/29/63/1050822963.db2.gz IFMITXDTAGYJNU-UHFFFAOYSA-N -1 1 327.277 4.040 20 0 EIADMM CCS[C@H]1CCCCN(C(=O)c2ccc(C(F)(F)F)c([O-])c2)C1 ZINC000619582534 1050825318 /nfs/dbraw/zinc/82/53/18/1050825318.db2.gz QZRCXNZKGTZDCF-LBPRGKRZSA-N -1 1 347.402 4.159 20 0 EIADMM O=C(NC1CCCC1)c1cccc(Nc2c([O-])cc(F)cc2F)c1 ZINC001174197832 1050832816 /nfs/dbraw/zinc/83/28/16/1050832816.db2.gz SPHSHNNALHGUTR-UHFFFAOYSA-N -1 1 332.350 4.086 20 0 EIADMM O=C(Nc1cc(=O)n(-c2ccccc2)[n-]1)Nc1cccc2ccccc21 ZINC001188913429 1050861181 /nfs/dbraw/zinc/86/11/81/1050861181.db2.gz VZLGPCVXJXYWJI-UHFFFAOYSA-N -1 1 344.374 4.375 20 0 EIADMM CC(C)C[C@@H](NCc1ccc(-c2nc3ccccc3s2)o1)C(=O)[O-] ZINC000261928831 1050874609 /nfs/dbraw/zinc/87/46/09/1050874609.db2.gz SPCTUXFDVNIATK-CQSZACIVSA-N -1 1 344.436 4.145 20 0 EIADMM CCCCCCN(Cc1ccco1)C(=O)c1c(F)ccc([O-])c1F ZINC001180200675 1050914350 /nfs/dbraw/zinc/91/43/50/1050914350.db2.gz MLSBYWPWBLXGOL-UHFFFAOYSA-N -1 1 337.366 4.486 20 0 EIADMM CCc1cc(=O)[n-]c(SCc2cc(Cl)cc(Cl)c2F)n1 ZINC001189173313 1050929183 /nfs/dbraw/zinc/92/91/83/1050929183.db2.gz AMZZJXRZQQRFEL-UHFFFAOYSA-N -1 1 333.215 4.483 20 0 EIADMM CC(=O)c1cccc(S(=O)(=O)[N-]c2cccc3cccc(C)c32)c1 ZINC001189241647 1050935281 /nfs/dbraw/zinc/93/52/81/1050935281.db2.gz UHVHXTWZMUPETI-UHFFFAOYSA-N -1 1 339.416 4.152 20 0 EIADMM CC(C)(C)[C@@H]1CCC[C@H]([N-]S(=O)(=O)c2ccc(C(F)F)o2)CC1 ZINC001189288989 1050948871 /nfs/dbraw/zinc/94/88/71/1050948871.db2.gz LETGUWCEEJPVRO-NEPJUHHUSA-N -1 1 349.443 4.491 20 0 EIADMM [O-]c1c(Cl)cc(Br)cc1Nc1ccnc2[nH]ccc21 ZINC001174412486 1050987488 /nfs/dbraw/zinc/98/74/88/1050987488.db2.gz NEJYAYCEPUBJCN-UHFFFAOYSA-N -1 1 338.592 4.380 20 0 EIADMM O=C(Nc1cccc(C(F)(F)F)c1[O-])c1c[nH]nc1-c1ccccc1 ZINC001189697089 1051040535 /nfs/dbraw/zinc/04/05/35/1051040535.db2.gz OMCAXMZKWJGUDB-UHFFFAOYSA-N -1 1 347.296 4.053 20 0 EIADMM CNC(=O)c1ccc(Nc2cc(Cl)c(C)c(Cl)c2[O-])cc1 ZINC001174514855 1051047803 /nfs/dbraw/zinc/04/78/03/1051047803.db2.gz JOCCLQVXZGVDFO-UHFFFAOYSA-N -1 1 325.195 4.111 20 0 EIADMM CN(Cc1ncc(Br)cc1[O-])c1ccc(C(C)(C)C)cc1 ZINC001180723558 1051074093 /nfs/dbraw/zinc/07/40/93/1051074093.db2.gz JPVWOWLKEYCSSE-UHFFFAOYSA-N -1 1 349.272 4.484 20 0 EIADMM Cc1c(Cl)cc(Nc2cncc(C(C)(C)O)c2)c([O-])c1Cl ZINC001174593554 1051075076 /nfs/dbraw/zinc/07/50/76/1051075076.db2.gz DVMNPBNOMKIGTK-UHFFFAOYSA-N -1 1 327.211 4.373 20 0 EIADMM CCc1cccc(C)c1NC(=O)Nc1cc(=O)n(-c2ccccc2)[n-]1 ZINC001189948224 1051086371 /nfs/dbraw/zinc/08/63/71/1051086371.db2.gz VHVAPPXOGLZMON-UHFFFAOYSA-N -1 1 336.395 4.093 20 0 EIADMM CO[C@@H](CSc1nc(-c2ccccc2)cc(=O)[n-]1)c1ccccc1 ZINC001190201184 1051136882 /nfs/dbraw/zinc/13/68/82/1051136882.db2.gz LZWULZVUQBRQHC-KRWDZBQOSA-N -1 1 338.432 4.329 20 0 EIADMM CCC(CC)(C(=O)Nc1ccc(-n2ccc(=O)[n-]2)cc1)c1ccccc1 ZINC001181155153 1051168307 /nfs/dbraw/zinc/16/83/07/1051168307.db2.gz BNZOODAQKDMKSA-UHFFFAOYSA-N -1 1 349.434 4.274 20 0 EIADMM O=S(=O)([N-]c1ccc(-c2ncco2)cc1)c1ccc(C2CC2)cc1 ZINC001190507768 1051198219 /nfs/dbraw/zinc/19/82/19/1051198219.db2.gz XGQJUUQQJPFSAK-UHFFFAOYSA-N -1 1 340.404 4.020 20 0 EIADMM CN(C)c1ccc(Nc2ccc(F)c(Br)c2[O-])cc1 ZINC001174879145 1051229796 /nfs/dbraw/zinc/22/97/96/1051229796.db2.gz QVSCSMNEPHVIQN-UHFFFAOYSA-N -1 1 325.181 4.103 20 0 EIADMM O=C(Nc1cc(F)c(F)cc1[O-])Nc1ccccc1OC(F)(F)F ZINC001190683521 1051256578 /nfs/dbraw/zinc/25/65/78/1051256578.db2.gz GXYDZXUCTOGTTI-UHFFFAOYSA-N -1 1 348.227 4.213 20 0 EIADMM O=C(Nc1ccc(OC(F)(F)F)cc1)Nc1cc(F)c([O-])cc1F ZINC001190744950 1051268437 /nfs/dbraw/zinc/26/84/37/1051268437.db2.gz BBYGYACQGNLTQL-UHFFFAOYSA-N -1 1 348.227 4.213 20 0 EIADMM CCOC(=O)c1nc(Cl)sc1[N-]c1c(F)ccc(F)c1F ZINC001175028773 1051322804 /nfs/dbraw/zinc/32/28/04/1051322804.db2.gz XKWNKHRVTUVWGV-UHFFFAOYSA-N -1 1 336.722 4.134 20 0 EIADMM Cc1cccc(CNC(=O)Nc2cc(Cl)c(Cl)cc2[O-])c1 ZINC001190998976 1051333207 /nfs/dbraw/zinc/33/32/07/1051333207.db2.gz VXOFEFKZKJHQFP-UHFFFAOYSA-N -1 1 325.195 4.329 20 0 EIADMM O=C(N[C@@H](c1ccccc1)c1cccc(F)c1)c1ccc([O-])cc1F ZINC000154981364 1051358077 /nfs/dbraw/zinc/35/80/77/1051358077.db2.gz PYAKHPXDSYAVED-IBGZPJMESA-N -1 1 339.341 4.190 20 0 EIADMM CCc1cccc(CC)c1NC(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC001191146708 1051362287 /nfs/dbraw/zinc/36/22/87/1051362287.db2.gz GIRPRJFRWCPDQV-UHFFFAOYSA-N -1 1 333.815 4.431 20 0 EIADMM O=c1oc2cc([O-])ccc2cc1Nc1ccc(F)c(C(F)(F)F)c1 ZINC001175074784 1051364505 /nfs/dbraw/zinc/36/45/05/1051364505.db2.gz CQGLXVJRZQYWJS-UHFFFAOYSA-N -1 1 339.244 4.400 20 0 EIADMM COc1cc(C(=O)N[C@H]2CC[C@@H](C(C)(C)C)CC2)cc(Cl)c1[O-] ZINC001191157715 1051369205 /nfs/dbraw/zinc/36/92/05/1051369205.db2.gz ASHPLJOIAHLRRS-BETUJISGSA-N -1 1 339.863 4.389 20 0 EIADMM [O-]c1c(Br)c(F)ccc1Nc1cc(F)c(F)cc1F ZINC001175091003 1051375661 /nfs/dbraw/zinc/37/56/61/1051375661.db2.gz HZORROUMRPXDRI-UHFFFAOYSA-N -1 1 336.082 4.455 20 0 EIADMM CCc1ccc(NC(=O)c2c([O-])cnc3ccc(Cl)cc32)cc1 ZINC001182136518 1051399747 /nfs/dbraw/zinc/39/97/47/1051399747.db2.gz XWMYAZPGHKBAEB-UHFFFAOYSA-N -1 1 326.783 4.409 20 0 EIADMM CCCCc1ccc(S(=O)(=O)[N-]c2ncc(Cl)cc2F)cc1 ZINC001191224327 1051402906 /nfs/dbraw/zinc/40/29/06/1051402906.db2.gz FCIRZXLSKLIWHE-UHFFFAOYSA-N -1 1 342.823 4.018 20 0 EIADMM Cc1cc(OCc2ccccc2)ccc1-n1[n-]c(=O)c2ccc(N)cc21 ZINC001175231379 1051459202 /nfs/dbraw/zinc/45/92/02/1051459202.db2.gz VYMQGKJLZWMCDJ-UHFFFAOYSA-N -1 1 345.402 4.201 20 0 EIADMM Cc1ccc(F)cc1NC(=O)c1ccccc1C(=O)c1ccc([O-])cc1 ZINC001191484040 1051464176 /nfs/dbraw/zinc/46/41/76/1051464176.db2.gz GHTBJZPMEGLTMH-UHFFFAOYSA-N -1 1 349.361 4.323 20 0 EIADMM CC(=O)c1cc(Cl)nc(Cl)c1Nc1c(F)ccc([O-])c1F ZINC001175262473 1051501740 /nfs/dbraw/zinc/50/17/40/1051501740.db2.gz FYTIKOWOMPOLTF-UHFFFAOYSA-N -1 1 333.121 4.318 20 0 EIADMM CC(=O)c1ccc(Br)cc1Nc1c(F)ccc([O-])c1F ZINC001175268525 1051504342 /nfs/dbraw/zinc/50/43/42/1051504342.db2.gz SCNDMFZGCFJVMB-UHFFFAOYSA-N -1 1 342.139 4.379 20 0 EIADMM COc1ccc(C(C)C)cc1S(=O)(=O)[N-]c1ccc(C)cc1F ZINC001191651928 1051507313 /nfs/dbraw/zinc/50/73/13/1051507313.db2.gz HDXNZKUHCORUTE-UHFFFAOYSA-N -1 1 337.416 4.067 20 0 EIADMM CC(C)(C)c1ccc(C(=O)Nc2ccc(C3(C)COC3)cc2)c([O-])c1 ZINC001192336198 1051694796 /nfs/dbraw/zinc/69/47/96/1051694796.db2.gz UKYIIDALECVLNE-UHFFFAOYSA-N -1 1 339.435 4.230 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1CC2(CCC2)[C@H]1c1ccncc1 ZINC000621165476 1051708001 /nfs/dbraw/zinc/70/80/01/1051708001.db2.gz YLMYUOKYHDQICU-HXUWFJFHSA-N -1 1 344.414 4.308 20 0 EIADMM Cc1cc(NC(=O)Nc2cccc([O-])c2Br)ccc1F ZINC001192392761 1051721115 /nfs/dbraw/zinc/72/11/15/1051721115.db2.gz BSWQNDSHSIALSD-UHFFFAOYSA-N -1 1 339.164 4.246 20 0 EIADMM CC(C)CC1CCN(C(=O)c2c([O-])cnc3ccc(Cl)cc32)CC1 ZINC001182911622 1051744353 /nfs/dbraw/zinc/74/43/53/1051744353.db2.gz NJINWKYTBFCNSG-UHFFFAOYSA-N -1 1 346.858 4.492 20 0 EIADMM CC(C)Cc1ccc(C(=O)Nc2cc(=O)n(-c3ccccc3)[n-]2)cc1 ZINC001192463925 1051746020 /nfs/dbraw/zinc/74/60/20/1051746020.db2.gz YPEDTZRUPIBXKN-UHFFFAOYSA-N -1 1 335.407 4.029 20 0 EIADMM CSc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2[O-])s1 ZINC001192647777 1051778720 /nfs/dbraw/zinc/77/87/20/1051778720.db2.gz WVYFNFIVQAGHQO-UHFFFAOYSA-N -1 1 333.356 4.447 20 0 EIADMM CCCC[C@H](C(=O)N1CCC(C(=O)c2ccc([O-])cc2)CC1)C(C)C ZINC000621375150 1051841900 /nfs/dbraw/zinc/84/19/00/1051841900.db2.gz PVMXOACLLRHCMF-IBGZPJMESA-N -1 1 345.483 4.276 20 0 EIADMM CCCCc1nnc([N-]C(=O)c2c(F)ccc(F)c2Cl)s1 ZINC000621403870 1051856268 /nfs/dbraw/zinc/85/62/68/1051856268.db2.gz BARIBLAYSONHTC-UHFFFAOYSA-N -1 1 331.775 4.065 20 0 EIADMM C[C@@H](NC(=O)Nc1cc([O-])c(Cl)cc1F)c1ccc(F)cc1 ZINC001193143051 1051879455 /nfs/dbraw/zinc/87/94/55/1051879455.db2.gz OSXPZXWLQSZMAB-MRVPVSSYSA-N -1 1 326.730 4.207 20 0 EIADMM CCN(CC)C(=O)c1ccc(F)c(Nc2ccc(F)c(F)c2[O-])c1 ZINC001176073281 1051886368 /nfs/dbraw/zinc/88/63/68/1051886368.db2.gz RXECJLDCSFZERP-UHFFFAOYSA-N -1 1 338.329 4.035 20 0 EIADMM CN(C)C(=O)c1ccc(Nc2c(Cl)ccc([O-])c2Cl)c(F)c1 ZINC001176204393 1051951941 /nfs/dbraw/zinc/95/19/41/1051951941.db2.gz KZCMGMWAXWDMMQ-UHFFFAOYSA-N -1 1 343.185 4.284 20 0 EIADMM O=C(N[C@@H]1CCCC2(CC2)C1)c1c([O-])cnc2ccc(Cl)cc21 ZINC001184367654 1052006365 /nfs/dbraw/zinc/00/63/65/1052006365.db2.gz DZFBEVVAGODMIJ-GFCCVEGCSA-N -1 1 330.815 4.046 20 0 EIADMM c1coc(-c2nnc([N-]c3ccc(OCc4ccccc4)nc3)o2)c1 ZINC001176301490 1052007077 /nfs/dbraw/zinc/00/70/77/1052007077.db2.gz TZNJBWIHOPYQOO-UHFFFAOYSA-N -1 1 334.335 4.047 20 0 EIADMM Cc1c(=O)[n-]c(SCc2ccc(F)cc2)nc1-c1ccccc1 ZINC000163880491 1052010364 /nfs/dbraw/zinc/01/03/64/1052010364.db2.gz SAVFQVFBZDDNNZ-UHFFFAOYSA-N -1 1 326.396 4.177 20 0 EIADMM Cc1cccc(C(C)(C)C)c1NC(=O)NCC(=O)c1ccc([O-])cc1 ZINC001184641499 1052066058 /nfs/dbraw/zinc/06/60/58/1052066058.db2.gz UBKZBHREVRCYHS-UHFFFAOYSA-N -1 1 340.423 4.003 20 0 EIADMM O=C([O-])C[C@@H](NCc1ccc(Oc2ccccc2)o1)c1cccs1 ZINC000671162316 1052072174 /nfs/dbraw/zinc/07/21/74/1052072174.db2.gz UVZFFCRQNWQIMX-OAHLLOKOSA-N -1 1 343.404 4.439 20 0 EIADMM Cc1cc(Br)ccc1NC(=O)Nc1c([O-])cccc1F ZINC001184817428 1052111372 /nfs/dbraw/zinc/11/13/72/1052111372.db2.gz QIWAXABWHIDRGA-UHFFFAOYSA-N -1 1 339.164 4.246 20 0 EIADMM [O-]c1c(F)cc(F)c(Nc2cnnc3ccc(Cl)cc32)c1F ZINC001176664652 1052157084 /nfs/dbraw/zinc/15/70/84/1052157084.db2.gz WOTJEHLAHHZHLI-UHFFFAOYSA-N -1 1 325.677 4.150 20 0 EIADMM [O-]c1c(F)cc(F)c(Nc2ccccc2OC2CCOCC2)c1F ZINC001176670243 1052157208 /nfs/dbraw/zinc/15/72/08/1052157208.db2.gz BVRZYMCSBRIXHM-UHFFFAOYSA-N -1 1 339.313 4.111 20 0 EIADMM [O-]c1c(F)cc(F)c(Nc2c(F)c(F)nc(F)c2Cl)c1F ZINC001176664406 1052157667 /nfs/dbraw/zinc/15/76/67/1052157667.db2.gz XYSWCGQUMDUVOB-UHFFFAOYSA-N -1 1 328.599 4.019 20 0 EIADMM CC(C)OC(=O)c1ccccc1Nc1c(F)cc(F)c([O-])c1F ZINC001176672190 1052159382 /nfs/dbraw/zinc/15/93/82/1052159382.db2.gz VMJFYYWECPWXDM-UHFFFAOYSA-N -1 1 325.286 4.118 20 0 EIADMM CO[C@@H]1CCOc2c(Nc3c(F)cc(F)c([O-])c3F)cccc21 ZINC001176673072 1052159826 /nfs/dbraw/zinc/15/98/26/1052159826.db2.gz DJLMIRMTTMESCW-GFCCVEGCSA-N -1 1 325.286 4.023 20 0 EIADMM [O-]c1c(F)cc(F)c(Nc2ccc(OC3CCOCC3)cc2)c1F ZINC001176671044 1052160236 /nfs/dbraw/zinc/16/02/36/1052160236.db2.gz RIONQCFPNCJEAL-UHFFFAOYSA-N -1 1 339.313 4.111 20 0 EIADMM COC(=O)c1c(F)ccc(Nc2c(F)cc(F)c([O-])c2F)c1Cl ZINC001176674119 1052162070 /nfs/dbraw/zinc/16/20/70/1052162070.db2.gz QPDJTCPOAYUKCR-UHFFFAOYSA-N -1 1 349.667 4.132 20 0 EIADMM COc1ccc(OC(=O)Nc2cccc(C(F)(F)F)c2[O-])cc1 ZINC001194540562 1052165334 /nfs/dbraw/zinc/16/53/34/1052165334.db2.gz LOTYLNLUBSXQQC-UHFFFAOYSA-N -1 1 327.258 4.031 20 0 EIADMM Cc1cccc(C)c1S(=O)(=O)[N-]c1ccnc2c(Cl)cccc12 ZINC001194610020 1052169849 /nfs/dbraw/zinc/16/98/49/1052169849.db2.gz VPPYEKZGWFPNMH-UHFFFAOYSA-N -1 1 346.839 4.306 20 0 EIADMM Cc1cccc(C)c1S(=O)(=O)[N-]c1ccccc1-c1nccs1 ZINC001194642693 1052183697 /nfs/dbraw/zinc/18/36/97/1052183697.db2.gz LQGPUSQALLDHMX-UHFFFAOYSA-N -1 1 344.461 4.228 20 0 EIADMM Cc1ccnc(Cl)c1[N-]S(=O)(=O)c1cc2ccccc2s1 ZINC001185427165 1052235832 /nfs/dbraw/zinc/23/58/32/1052235832.db2.gz ZPJQYFRLMILKTL-UHFFFAOYSA-N -1 1 338.841 4.059 20 0 EIADMM O=C(c1cc(F)ccc1[O-])N1CCc2cc(Cl)cc(Cl)c2C1 ZINC000622420592 1052259132 /nfs/dbraw/zinc/25/91/32/1052259132.db2.gz XKKHIPFYEOPZKI-UHFFFAOYSA-N -1 1 340.181 4.037 20 0 EIADMM CC(C)C[C@H]1CCCN(C(=O)c2ccc(C(F)(F)F)cc2[O-])C1 ZINC000622433648 1052268358 /nfs/dbraw/zinc/26/83/58/1052268358.db2.gz MTDHVJYGKMZTKZ-GFCCVEGCSA-N -1 1 329.362 4.309 20 0 EIADMM Cc1nc(C(=O)Nc2ccc([O-])c(Cl)c2)c(-c2ccccc2)o1 ZINC000184015660 1052989529 /nfs/dbraw/zinc/98/95/29/1052989529.db2.gz RFKPGWGHIUQDIH-UHFFFAOYSA-N -1 1 328.755 4.261 20 0 EIADMM COc1ccccc1C[C@H](C)[N@@H+](C)Cc1cccc(C(=O)[O-])c1Cl ZINC000381474695 1053077594 /nfs/dbraw/zinc/07/75/94/1053077594.db2.gz CZEHDMWMPASDFM-ZDUSSCGKSA-N -1 1 347.842 4.110 20 0 EIADMM CC(C)CC1CCN(C(=O)c2ccc(Br)c([O-])c2)CC1 ZINC000764610663 1053230079 /nfs/dbraw/zinc/23/00/79/1053230079.db2.gz ZHHDKOWUELAFHP-UHFFFAOYSA-N -1 1 340.261 4.053 20 0 EIADMM CC[C@H](C(=O)OCCc1cc(C(C)=O)ccc1[O-])c1ccc(F)cc1 ZINC000764646761 1053252255 /nfs/dbraw/zinc/25/22/55/1053252255.db2.gz NZXUJTRNMFYPEB-SFHVURJKSA-N -1 1 344.382 4.013 20 0 EIADMM CC(C)c1cccc(S(=O)(=O)[N-]c2ccc(F)c3cnccc23)c1 ZINC001195158975 1053307799 /nfs/dbraw/zinc/30/77/99/1053307799.db2.gz JBLAIMOGRKIRAV-UHFFFAOYSA-N -1 1 344.411 4.298 20 0 EIADMM CC(C)c1cccc(S(=O)(=O)[N-]c2cccc3ncc(F)cc23)c1 ZINC001195159609 1053308678 /nfs/dbraw/zinc/30/86/78/1053308678.db2.gz RFBGDKXCYHATBG-UHFFFAOYSA-N -1 1 344.411 4.298 20 0 EIADMM Cc1nc(-c2cccc(NC(=O)c3cc([O-])cnc3Cl)c2)cs1 ZINC001195297214 1053367438 /nfs/dbraw/zinc/36/74/38/1053367438.db2.gz HCQLDEOMAYLRCI-UHFFFAOYSA-N -1 1 345.811 4.125 20 0 EIADMM O=C(Nc1cccc(-c2cccs2)c1)c1cc([O-])cnc1Cl ZINC001195305894 1053370849 /nfs/dbraw/zinc/37/08/49/1053370849.db2.gz KCASXJZFNYWWOW-UHFFFAOYSA-N -1 1 330.796 4.421 20 0 EIADMM CCC(CC)c1nnc([N-]C(=O)c2conc2C2CCCC2)s1 ZINC000864969537 1053396354 /nfs/dbraw/zinc/39/63/54/1053396354.db2.gz QWDYWLLIKRFKND-UHFFFAOYSA-N -1 1 334.445 4.340 20 0 EIADMM CSc1cc(C)nc(SC)c1[N-]C(=O)c1cccnc1C1CC1 ZINC001195552881 1053426298 /nfs/dbraw/zinc/42/62/98/1053426298.db2.gz BRBQMPITLSJKIT-UHFFFAOYSA-N -1 1 345.493 4.359 20 0 EIADMM CN(CCCOCc1ccccc1)C(=O)c1ccc2ccccc2c1[O-] ZINC000384310126 1053442863 /nfs/dbraw/zinc/44/28/63/1053442863.db2.gz KFPOCBFPTCOVFP-UHFFFAOYSA-N -1 1 349.430 4.224 20 0 EIADMM [O-]c1cccc(NC(=S)Nc2ccccc2F)c1Br ZINC001195784515 1053485734 /nfs/dbraw/zinc/48/57/34/1053485734.db2.gz OJJYXGNGQSWZNL-UHFFFAOYSA-N -1 1 341.205 4.103 20 0 EIADMM Cc1nc(SCc2cc(Cl)nc(Cl)c2)[n-]c(=O)c1C1CC1 ZINC000865373515 1053486684 /nfs/dbraw/zinc/48/66/84/1053486684.db2.gz XSUWLLXQNKHEOV-UHFFFAOYSA-N -1 1 342.251 4.362 20 0 EIADMM CSc1ccc(C)c([N-]S(=O)(=O)c2cccc3ncccc32)c1 ZINC000775679249 1053555290 /nfs/dbraw/zinc/55/52/90/1053555290.db2.gz SBQOGMFBLLLISI-UHFFFAOYSA-N -1 1 344.461 4.066 20 0 EIADMM Cc1cc(F)ccc1NC(=S)Nc1cc([O-])c(Cl)cc1F ZINC001196117258 1053595109 /nfs/dbraw/zinc/59/51/09/1053595109.db2.gz PISGBSOBIWBSAD-UHFFFAOYSA-N -1 1 328.771 4.441 20 0 EIADMM O=C(CSc1ncc(-c2ccc(F)cc2)o1)c1ccc([O-])cc1 ZINC000010846179 1053601986 /nfs/dbraw/zinc/60/19/86/1053601986.db2.gz DRWGFUMAOBTUEU-UHFFFAOYSA-N -1 1 329.352 4.161 20 0 EIADMM CC(C)C(=O)Nc1ccc(NC(=O)c2ccc3ccccc3c2[O-])cc1 ZINC000011717641 1053625533 /nfs/dbraw/zinc/62/55/33/1053625533.db2.gz CGKPDPFKPZAAGZ-UHFFFAOYSA-N -1 1 348.402 4.392 20 0 EIADMM [O-]c1ccc(-c2noc([C@@H]3CC[C@H](Cc4ccccc4)O3)n2)c(F)c1 ZINC000866973179 1053671133 /nfs/dbraw/zinc/67/11/33/1053671133.db2.gz BDRZWEIJTVLYET-PBHICJAKSA-N -1 1 340.354 4.044 20 0 EIADMM O=C(Nc1cc(F)c([O-])cc1Cl)[C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC000885674347 1053788837 /nfs/dbraw/zinc/78/88/37/1053788837.db2.gz LZIAEALDUDBVIX-SFYZADRCSA-N -1 1 339.716 4.492 20 0 EIADMM O=c1oc2cc([O-])ccc2cc1NC1=CC[C@H](C(F)(F)F)CC1 ZINC001196889385 1053791655 /nfs/dbraw/zinc/79/16/55/1053791655.db2.gz MKIFIMBDAYPGHW-JTQLQIEISA-N -1 1 325.286 4.157 20 0 EIADMM CC(C)(C)c1ccc([C@@H](O)CCC(=O)Nc2c([O-])cccc2F)cc1 ZINC000855555895 1053945226 /nfs/dbraw/zinc/94/52/26/1053945226.db2.gz IPRPDYRRYLQMOD-INIZCTEOSA-N -1 1 345.414 4.281 20 0 EIADMM Cc1cc(F)c([N-]S(=O)(=O)Cc2c(F)cccc2F)cc1Cl ZINC001197607753 1053957331 /nfs/dbraw/zinc/95/73/31/1053957331.db2.gz DFSQDAVDZMFWIB-UHFFFAOYSA-N -1 1 349.761 4.008 20 0 EIADMM Cc1nc2cccc(C(=O)Nc3cc(Cl)cc(Cl)c3[O-])c2[nH]1 ZINC000338553367 1054011638 /nfs/dbraw/zinc/01/16/38/1054011638.db2.gz ZAHJBHYPXJNSIJ-UHFFFAOYSA-N -1 1 336.178 4.136 20 0 EIADMM O=C(NCCc1c(F)cc([O-])cc1F)Nc1cccc2ccccc21 ZINC001197894423 1054016280 /nfs/dbraw/zinc/01/62/80/1054016280.db2.gz NQOAMADTHGGIBL-UHFFFAOYSA-N -1 1 342.345 4.188 20 0 EIADMM CCC(CC)(CNC(=O)Cc1ccc([O-])c(Cl)c1)C(F)(F)F ZINC000871265551 1054180147 /nfs/dbraw/zinc/18/01/47/1054180147.db2.gz BRFUCLKMGYCWGO-UHFFFAOYSA-N -1 1 337.769 4.073 20 0 EIADMM O=C([N-]Cc1ccc(Cl)cc1F)C(F)(F)c1ccc(F)cc1 ZINC000857489646 1054276352 /nfs/dbraw/zinc/27/63/52/1054276352.db2.gz FMHXCEOYHUNXJP-UHFFFAOYSA-N -1 1 331.696 4.026 20 0 EIADMM O=S(=O)([N-]c1cccc2c1CCCC2)c1ccc2occc2c1 ZINC001198860804 1054286884 /nfs/dbraw/zinc/28/68/84/1054286884.db2.gz DAWDVMNAGDUFJK-UHFFFAOYSA-N -1 1 327.405 4.112 20 0 EIADMM CCCc1ccc(S(=O)(=O)[N-]c2cccc(-c3cnco3)c2)cc1 ZINC000057119324 1054500758 /nfs/dbraw/zinc/50/07/58/1054500758.db2.gz IXKCRHZGZPDZFF-UHFFFAOYSA-N -1 1 342.420 4.095 20 0 EIADMM [O-]c1cccc(NC(=S)Nc2ccc(-n3cccn3)cc2)c1Cl ZINC001200882722 1054566606 /nfs/dbraw/zinc/56/66/06/1054566606.db2.gz LRRWDYKEMDEGPT-UHFFFAOYSA-N -1 1 344.827 4.040 20 0 EIADMM CCCCCCNC(=S)Nc1cccc([O-])c1Br ZINC001200956843 1054606770 /nfs/dbraw/zinc/60/67/70/1054606770.db2.gz IGUHYHWSUQTERP-UHFFFAOYSA-N -1 1 331.279 4.021 20 0 EIADMM [O-]c1c(Cl)nccc1Nc1cncc(OCc2ccccc2)c1 ZINC001201622464 1054867117 /nfs/dbraw/zinc/86/71/17/1054867117.db2.gz FVISAFCZQFDJGD-UHFFFAOYSA-N -1 1 327.771 4.158 20 0 EIADMM [O-]c1c(F)c(F)ccc1Nc1cncc(OCc2ccccc2)c1 ZINC001201628767 1054869090 /nfs/dbraw/zinc/86/90/90/1054869090.db2.gz GZCYVNKJSLJROO-UHFFFAOYSA-N -1 1 328.318 4.388 20 0 EIADMM Cc1nc(-c2cccc(NC(=O)c3ccc([O-])cc3F)c2)cs1 ZINC000161727513 1054907910 /nfs/dbraw/zinc/90/79/10/1054907910.db2.gz WYWIEMYZPIQUBQ-UHFFFAOYSA-N -1 1 328.368 4.216 20 0 EIADMM C[C@@H](CN(C)C(=O)c1ccc(Br)cc1[O-])c1ccccc1 ZINC000067177939 1055031430 /nfs/dbraw/zinc/03/14/30/1055031430.db2.gz XKGXPKWEPFDNRC-LBPRGKRZSA-N -1 1 348.240 4.030 20 0 EIADMM C[C@H](CN(C)C(=O)c1ccc(Br)cc1[O-])c1ccccc1 ZINC000067177940 1055032241 /nfs/dbraw/zinc/03/22/41/1055032241.db2.gz XKGXPKWEPFDNRC-GFCCVEGCSA-N -1 1 348.240 4.030 20 0 EIADMM CC(=O)OCC(C)(C)CC(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000862294269 1055046604 /nfs/dbraw/zinc/04/66/04/1055046604.db2.gz FBXZHLYKVIAMQA-UHFFFAOYSA-N -1 1 349.814 4.117 20 0 EIADMM O=C(Nc1ccc([O-])c(F)c1F)Nc1ccccc1C(F)(F)F ZINC001202163694 1055064533 /nfs/dbraw/zinc/06/45/33/1055064533.db2.gz ITPOFIZBPCEDSR-UHFFFAOYSA-N -1 1 332.228 4.333 20 0 EIADMM Cc1c(NC(=O)OC(C)(C)C)cccc1NC(=O)c1ccccc1[O-] ZINC000862722417 1055103325 /nfs/dbraw/zinc/10/33/25/1055103325.db2.gz WPDQCXQBJZCPTG-UHFFFAOYSA-N -1 1 342.395 4.300 20 0 EIADMM O=C(Nc1ccc(Cl)cc1)Nc1cccc([O-])c1Br ZINC001202376813 1055156331 /nfs/dbraw/zinc/15/63/31/1055156331.db2.gz QSFJDWGWFHYBFZ-UHFFFAOYSA-N -1 1 341.592 4.452 20 0 EIADMM CC(=O)c1cc(-c2nc(-c3ccc(-c4ccc(C)cc4)cc3)no2)n[n-]1 ZINC001212430098 1055937894 /nfs/dbraw/zinc/93/78/94/1055937894.db2.gz ZZOKGFGOUYUTGT-UHFFFAOYSA-N -1 1 344.374 4.305 20 0 EIADMM CC(=O)c1cc(-c2nc(-c3ccc(-c4ccc(C)cc4)cc3)no2)[n-]n1 ZINC001212430098 1055937900 /nfs/dbraw/zinc/93/79/00/1055937900.db2.gz ZZOKGFGOUYUTGT-UHFFFAOYSA-N -1 1 344.374 4.305 20 0 EIADMM O=C(c1ccc([O-])c(F)c1)N(Cc1ccccc1Cl)CC1CC1 ZINC000672142453 1056672299 /nfs/dbraw/zinc/67/22/99/1056672299.db2.gz RSOZCZQBACCWNX-UHFFFAOYSA-N -1 1 333.790 4.237 20 0 EIADMM Cc1cc(Nc2cc(F)c([O-])c(Cl)c2)cc(Br)n1 ZINC001214482718 1056736096 /nfs/dbraw/zinc/73/60/96/1056736096.db2.gz KGZYYVGAARYTEB-UHFFFAOYSA-N -1 1 331.572 4.394 20 0 EIADMM CC[C@H](C)c1ccc(S(=O)(=O)[N-]c2cc(OC)cc(OC)c2)cc1 ZINC000007056337 1056762193 /nfs/dbraw/zinc/76/21/93/1056762193.db2.gz JWGBIVAAKNZTLL-ZDUSSCGKSA-N -1 1 349.452 4.018 20 0 EIADMM Cc1ccc(C(C)(C)CN(C)C(=O)c2c([O-])cccc2Cl)cc1 ZINC000743717698 1059096537 /nfs/dbraw/zinc/09/65/37/1059096537.db2.gz WMEIDWZQWMASIH-UHFFFAOYSA-N -1 1 331.843 4.404 20 0 EIADMM CC(=O)c1ccc([O-])c(CCOC(=O)c2sccc2C(C)C)c1 ZINC000744844533 1059644824 /nfs/dbraw/zinc/64/48/24/1059644824.db2.gz DOFPTEBWJJAJJJ-UHFFFAOYSA-N -1 1 332.421 4.179 20 0 EIADMM O=C(Nc1ccc(-n2ccc(=O)[n-]2)cc1)[C@H]1CCC[C@@H]1c1ccccc1 ZINC001168915515 1060519089 /nfs/dbraw/zinc/51/90/89/1060519089.db2.gz XTNBNVZOBLPVOS-MOPGFXCFSA-N -1 1 347.418 4.100 20 0 EIADMM O=C(Nc1cc(Cl)ccc1N1CCCCC1)c1ccc([O-])c(F)c1 ZINC000767297661 1061185064 /nfs/dbraw/zinc/18/50/64/1061185064.db2.gz AEOVVVIZBVFKJD-UHFFFAOYSA-N -1 1 348.805 4.427 20 0 EIADMM O=C(Nc1ncc(-c2ccc(Cl)cc2)s1)c1ccccc1[O-] ZINC000072112023 216010861 /nfs/dbraw/zinc/01/08/61/216010861.db2.gz DNJHONNJKDETND-UHFFFAOYSA-N -1 1 330.796 4.421 20 0 EIADMM Cc1c(Cl)cccc1[N-]S(=O)(=O)c1ccc(F)c(Cl)c1 ZINC000007402819 210794582 /nfs/dbraw/zinc/79/45/82/210794582.db2.gz LALQFMFQQQOCCB-UHFFFAOYSA-N -1 1 334.199 4.242 20 0 EIADMM O=C(Nc1cccc([O-])c1Br)c1cc(Cl)ccc1F ZINC001158825710 1049443535 /nfs/dbraw/zinc/44/35/35/1049443535.db2.gz RZYMDMWAFIAHOE-UHFFFAOYSA-N -1 1 344.567 4.200 20 0 EIADMM CC(C)Cn1cc(C(=O)Nc2ccc([O-])c(Cl)c2)c(C(F)F)n1 ZINC000450294907 1032407949 /nfs/dbraw/zinc/40/79/49/1032407949.db2.gz SQJHRSPKQMAECG-UHFFFAOYSA-N -1 1 343.761 4.088 20 0 EIADMM O=C(Nc1ccc(Oc2ccncc2)cc1)c1c(F)ccc([O-])c1F ZINC000339391866 1018833733 /nfs/dbraw/zinc/83/37/33/1018833733.db2.gz JOJYCWPBRYINGF-UHFFFAOYSA-N -1 1 342.301 4.110 20 0 EIADMM O=C(Nc1ccc(F)cc1[O-])c1cc(Cl)cc(Br)c1 ZINC000533475935 1032792975 /nfs/dbraw/zinc/79/29/75/1032792975.db2.gz FBOSDANJCWWZGH-UHFFFAOYSA-N -1 1 344.567 4.200 20 0 EIADMM CC(C)CCn1ncc(NC(=O)c2ccc([O-])c(F)c2)c1C(C)C ZINC000683139110 1018898917 /nfs/dbraw/zinc/89/89/17/1018898917.db2.gz WEBHFXZQAWTYBO-UHFFFAOYSA-N -1 1 333.407 4.150 20 0 EIADMM O=S(=O)([N-]c1ncccc1Cl)c1ccc(-c2ccccc2)cc1 ZINC000180202304 1020079681 /nfs/dbraw/zinc/07/96/81/1020079681.db2.gz JHNZJVDNVPLRSK-UHFFFAOYSA-N -1 1 344.823 4.203 20 0 EIADMM CCOc1cc(-c2noc([C@H](C)CC)n2)cc(Br)c1[O-] ZINC000109507918 1020235362 /nfs/dbraw/zinc/23/53/62/1020235362.db2.gz VMSOBGNJNFNBTI-MRVPVSSYSA-N -1 1 341.205 4.117 20 0 EIADMM C[S@](=O)(=NC(=O)c1cc2cc(Cl)sc2[n-]1)C1CCCCC1 ZINC000926030235 1020837320 /nfs/dbraw/zinc/83/73/20/1020837320.db2.gz DOQSCPSPSMWFGF-OAQYLSRUSA-N -1 1 344.889 4.454 20 0 EIADMM C[C@H](Oc1cccc2ccccc21)C(=O)Nc1c([O-])cccc1F ZINC000683494693 1020858038 /nfs/dbraw/zinc/85/80/38/1020858038.db2.gz FFSQJLRANLDVRL-LBPRGKRZSA-N -1 1 325.339 4.091 20 0 EIADMM O=C(CCSc1ccc(Cl)cc1)Nc1c([O-])cccc1F ZINC000089493352 1021847756 /nfs/dbraw/zinc/84/77/56/1021847756.db2.gz CGVPLFFTECRNAW-UHFFFAOYSA-N -1 1 325.792 4.306 20 0 EIADMM COc1cc(C(=O)NCCCc2ccc(C)cc2C)cc(Cl)c1[O-] ZINC000683893092 1021883888 /nfs/dbraw/zinc/88/38/88/1021883888.db2.gz UXHKVXNNTQZUMN-UHFFFAOYSA-N -1 1 347.842 4.034 20 0 EIADMM Cc1nnc(-c2cccc(NC(=O)c3ccc4ccccc4c3[O-])c2)o1 ZINC000174384738 1022071558 /nfs/dbraw/zinc/07/15/58/1022071558.db2.gz LYHGIASCLUAONE-UHFFFAOYSA-N -1 1 345.358 4.156 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N(C[C@@H]1CCCO1)C1CCCC1 ZINC000174543250 1022095088 /nfs/dbraw/zinc/09/50/88/1022095088.db2.gz BABFDIUPTYDHPV-KRWDZBQOSA-N -1 1 339.435 4.109 20 0 EIADMM O=C(CCCOc1ccccc1Cl)Nc1cc([O-])c(F)cc1F ZINC001625894007 1022173562 /nfs/dbraw/zinc/17/35/62/1022173562.db2.gz NZFMSSBLIHHAST-UHFFFAOYSA-N -1 1 341.741 4.122 20 0 EIADMM CSc1ccc([N-]S(=O)(=O)c2cccc3ccccc32)cc1 ZINC000318494887 1022320153 /nfs/dbraw/zinc/32/01/53/1022320153.db2.gz SKDGJGFZMRZZOO-UHFFFAOYSA-N -1 1 329.446 4.363 20 0 EIADMM O=c1cc(C2CC2)nc(SCc2ncc(-c3ccccc3)o2)[n-]1 ZINC000188149220 1022466213 /nfs/dbraw/zinc/46/62/13/1022466213.db2.gz NACJUTAAWAFIGA-UHFFFAOYSA-N -1 1 325.393 4.007 20 0 EIADMM COc1cccc([C@H](C)CCCC(=O)Nc2c([O-])cccc2F)c1 ZINC000684058090 1022516676 /nfs/dbraw/zinc/51/66/76/1022516676.db2.gz UEIXENOKPYOPQS-CYBMUJFWSA-N -1 1 331.387 4.452 20 0 EIADMM CCOc1cc(C(=O)Nc2cccc([C@@H](C)OC)c2)cc(Cl)c1[O-] ZINC000186771580 1022745964 /nfs/dbraw/zinc/74/59/64/1022745964.db2.gz HDSWXHKGXFUHJF-LLVKDONJSA-N -1 1 349.814 4.404 20 0 EIADMM CCOc1cc(C(=O)Nc2ccc(Cl)cc2O)cc(Cl)c1[O-] ZINC000186960558 1022808500 /nfs/dbraw/zinc/80/85/00/1022808500.db2.gz GPOZZBVYRJJZAF-UHFFFAOYSA-N -1 1 342.178 4.056 20 0 EIADMM CC(C)(C)n1cc(-c2nc3sc(C(F)(F)F)cc3c(=O)[n-]2)cn1 ZINC000416409491 1022828944 /nfs/dbraw/zinc/82/89/44/1022828944.db2.gz BJFAHLCXNSSCQU-UHFFFAOYSA-N -1 1 342.346 4.034 20 0 EIADMM Cc1cnc(F)c(Nc2c([O-])c(Br)ccc2Cl)c1 ZINC001211510643 1022899748 /nfs/dbraw/zinc/89/97/48/1022899748.db2.gz VJYGTIAMOFZHLF-UHFFFAOYSA-N -1 1 331.572 4.394 20 0 EIADMM O=C([N-][C@@H]1CCC(F)(F)C1)C(F)(F)c1cccc(Cl)c1Cl ZINC000843565550 1023049379 /nfs/dbraw/zinc/04/93/79/1023049379.db2.gz OQYZINSCBUBVFE-SSDOTTSWSA-N -1 1 344.135 4.389 20 0 EIADMM COc1cncc(Nc2c(Cl)ccc(Br)c2[O-])c1C ZINC001215735889 1023088417 /nfs/dbraw/zinc/08/84/17/1023088417.db2.gz AKGTWTSZJFJMCH-UHFFFAOYSA-N -1 1 343.608 4.264 20 0 EIADMM CCc1cccc2cc(CN[C@H](CCc3ccccc3)C(=O)[O-])oc21 ZINC000656565755 1023226300 /nfs/dbraw/zinc/22/63/00/1023226300.db2.gz SQXFTDLWTVRXJA-LJQANCHMSA-N -1 1 337.419 4.171 20 0 EIADMM C[C@@H](NC(=O)c1ccc([O-])cc1F)c1ccc(C(F)(F)F)cc1 ZINC000181116067 1023230630 /nfs/dbraw/zinc/23/06/30/1023230630.db2.gz ZHMZDRPVCGAZJX-SECBINFHSA-N -1 1 327.277 4.041 20 0 EIADMM O=C(c1ccc(C(F)(F)F)cc1[O-])N1CC2(CC2)c2ccccc21 ZINC000180579339 1023231514 /nfs/dbraw/zinc/23/15/14/1023231514.db2.gz FGWORRVIYZXHNS-UHFFFAOYSA-N -1 1 333.309 4.103 20 0 EIADMM CCOc1ccccc1C1=CC[N@@H+](Cc2ccc(C(=O)[O-])cc2)CC1 ZINC000414640131 1023308812 /nfs/dbraw/zinc/30/88/12/1023308812.db2.gz RHBQKYOCSKTYAP-UHFFFAOYSA-N -1 1 337.419 4.073 20 0 EIADMM Cc1ncsc1CN[C@@H](CC(=O)[O-])c1cc(Cl)cc(Cl)c1 ZINC000417556953 1023353910 /nfs/dbraw/zinc/35/39/10/1023353910.db2.gz AHJGDYSEJFHQNC-LBPRGKRZSA-N -1 1 345.251 4.064 20 0 EIADMM CC(C)c1ncc(CN[C@H](CC(=O)[O-])c2cccc(Cl)c2)s1 ZINC000417559456 1023355590 /nfs/dbraw/zinc/35/55/90/1023355590.db2.gz XUPOGCGLLJMZOC-CQSZACIVSA-N -1 1 338.860 4.226 20 0 EIADMM O=C([O-])[C@H]1C[C@@H](NCc2cc(Cl)sc2Cl)c2ccccc21 ZINC000417633917 1023382928 /nfs/dbraw/zinc/38/29/28/1023382928.db2.gz VAWWUSXCSOHMGX-NWDGAFQWSA-N -1 1 342.247 4.458 20 0 EIADMM COC[C@H]([N-]c1nnc(-c2cccc(Cl)c2)o1)c1ccc(C)o1 ZINC000892782082 1023393928 /nfs/dbraw/zinc/39/39/28/1023393928.db2.gz JUONAMVFPURBCM-ZDUSSCGKSA-N -1 1 333.775 4.091 20 0 EIADMM CCc1ccc(-c2ccc(CN[C@H](CC3CCC3)C(=O)[O-])o2)cc1 ZINC000417711430 1023412698 /nfs/dbraw/zinc/41/26/98/1023412698.db2.gz VOGQSEFOGQVWJJ-GOSISDBHSA-N -1 1 327.424 4.242 20 0 EIADMM CCCCc1ccc(CC(=O)Nc2ccc(-c3cc(=O)[nH][n-]3)cc2)cc1 ZINC000613663763 1023468401 /nfs/dbraw/zinc/46/84/01/1023468401.db2.gz FIBXJUYNVNERMO-UHFFFAOYSA-N -1 1 349.434 4.306 20 0 EIADMM CC[C@H](C)Oc1ccc([N-]S(=O)(=O)c2cc(F)ccc2C)cc1 ZINC000511688466 1023831320 /nfs/dbraw/zinc/83/13/20/1023831320.db2.gz RQHNGAVKCVJFFD-ZDUSSCGKSA-N -1 1 337.416 4.112 20 0 EIADMM CCOCc1cccc([N-]S(=O)(=O)c2cccc3ccccc32)c1 ZINC000084460848 1023874152 /nfs/dbraw/zinc/87/41/52/1023874152.db2.gz SBOPVENLXWFIEG-UHFFFAOYSA-N -1 1 341.432 4.177 20 0 EIADMM O=C([O-])c1ccccc1CC1CCN(Cc2cc(F)cc(F)c2)CC1 ZINC000581955512 1023928428 /nfs/dbraw/zinc/92/84/28/1023928428.db2.gz PLSZTQXUPDMAMB-UHFFFAOYSA-N -1 1 345.389 4.118 20 0 EIADMM C[C@@H](c1ccc(F)cc1F)N1CCC(C(=O)c2ccc([O-])cc2)CC1 ZINC000618440727 1024076360 /nfs/dbraw/zinc/07/63/60/1024076360.db2.gz QAQOQACSYUQJQZ-ZDUSSCGKSA-N -1 1 345.389 4.326 20 0 EIADMM Cc1ccc(C(=O)Nc2ccc([O-])c(Cl)c2)cc1Br ZINC000093297608 1024217121 /nfs/dbraw/zinc/21/71/21/1024217121.db2.gz ZFGFSAXSJVAANS-UHFFFAOYSA-N -1 1 340.604 4.369 20 0 EIADMM CC(C)(C)c1cc(CS(=O)(=O)[N-]c2cccc3ccccc32)no1 ZINC000430990684 1024373484 /nfs/dbraw/zinc/37/34/84/1024373484.db2.gz WRZHYMJTQFZKNE-UHFFFAOYSA-N -1 1 344.436 4.067 20 0 EIADMM CC(=O)c1cccc(S(=O)(=O)[N-]c2c(C)cccc2C(C)C)c1 ZINC000016130556 1024747501 /nfs/dbraw/zinc/74/75/01/1024747501.db2.gz CEKZTGUNDCAFGG-UHFFFAOYSA-N -1 1 331.437 4.122 20 0 EIADMM Cc1cc([C@@H](C)N2CC[C@H](Oc3ccccc3Cl)C2)oc1C(=O)[O-] ZINC000652434839 1024829986 /nfs/dbraw/zinc/82/99/86/1024829986.db2.gz GBWKAHGQUWGLLF-OLZOCXBDSA-N -1 1 349.814 4.154 20 0 EIADMM CC1(C)CN(C(=O)c2ncc3ccccc3c2[O-])[C@H]1c1cccs1 ZINC000663166718 1024864187 /nfs/dbraw/zinc/86/41/87/1024864187.db2.gz OHOGNQWOEWHKRE-KRWDZBQOSA-N -1 1 338.432 4.225 20 0 EIADMM O=C(NCC(C1CCC1)C1CCC1)c1ccc(C(F)(F)F)c([O-])c1 ZINC001167788004 1024881866 /nfs/dbraw/zinc/88/18/66/1024881866.db2.gz WJBYDQGNISAIOY-UHFFFAOYSA-N -1 1 341.373 4.357 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2ccc(-c3ccc[nH]3)cc2)c(C)s1 ZINC000341948682 1025006609 /nfs/dbraw/zinc/00/66/09/1025006609.db2.gz VJVNLJJUEXPHIH-UHFFFAOYSA-N -1 1 332.450 4.161 20 0 EIADMM C[C@H]1CO[C@@H](c2ccccc2)CN1C(=O)c1cc2ccccc2cc1[O-] ZINC000110315574 1033267763 /nfs/dbraw/zinc/26/77/63/1033267763.db2.gz QJJPDAQSPBNJRQ-YCRPNKLZSA-N -1 1 347.414 4.148 20 0 EIADMM CO[C@@H](CSc1nc(-c2ccccc2)c(C)c(=O)[n-]1)C1CCCC1 ZINC000657256753 1025419883 /nfs/dbraw/zinc/41/98/83/1025419883.db2.gz FVJREEPJFWFLAP-INIZCTEOSA-N -1 1 344.480 4.455 20 0 EIADMM CC(C)C1CCN(Cc2csc(-c3cccc(C(=O)[O-])c3)n2)CC1 ZINC000519413021 1025809100 /nfs/dbraw/zinc/80/91/00/1025809100.db2.gz XTTVKBWFIKBHID-UHFFFAOYSA-N -1 1 344.480 4.376 20 0 EIADMM CCC(C)(C)[N-]S(=O)(=O)c1c(Cl)cc(Cl)cc1Cl ZINC000048664542 1026043088 /nfs/dbraw/zinc/04/30/88/1026043088.db2.gz CJRVOAYHQMNUCR-UHFFFAOYSA-N -1 1 330.664 4.114 20 0 EIADMM O=S(=O)([N-]c1cccc(OC(F)F)c1)c1cccc(C(F)F)c1 ZINC000780375189 1026272869 /nfs/dbraw/zinc/27/28/69/1026272869.db2.gz FMLUQMLLSHSGOQ-UHFFFAOYSA-N -1 1 349.305 4.026 20 0 EIADMM O=C(c1ccc(C(F)(F)F)cc1[O-])N1CCCCc2sccc21 ZINC000684786998 1026299234 /nfs/dbraw/zinc/29/92/34/1026299234.db2.gz NBQDRVYELNHFKN-UHFFFAOYSA-N -1 1 341.354 4.456 20 0 EIADMM C[C@H]([N-]C(=O)C(F)(F)c1cc(Cl)ccc1Cl)c1ccccn1 ZINC001125591768 1026419821 /nfs/dbraw/zinc/41/98/21/1026419821.db2.gz ICLLFPVVFKFJOL-VIFPVBQESA-N -1 1 345.176 4.358 20 0 EIADMM [O-]c1c(Cl)cc(Br)cc1Nc1cc(F)nc(F)c1 ZINC001213084416 1026462399 /nfs/dbraw/zinc/46/23/99/1026462399.db2.gz ARDRMCNPHNFURN-UHFFFAOYSA-N -1 1 335.535 4.225 20 0 EIADMM O=C([O-])C[C@@H](NCc1ccc(Cl)cc1Cl)c1ccsc1 ZINC000426681598 1026470492 /nfs/dbraw/zinc/47/04/92/1026470492.db2.gz BKBDOAHQSONTSX-CYBMUJFWSA-N -1 1 330.236 4.361 20 0 EIADMM O=C([O-])[C@H](NCc1ccc(F)cc1Cl)c1ccc(Cl)c(F)c1 ZINC000426723452 1026505059 /nfs/dbraw/zinc/50/50/59/1026505059.db2.gz ZBFDVAIPLFFCTF-CQSZACIVSA-N -1 1 346.160 4.187 20 0 EIADMM C[C@H](C(=O)[O-])[C@@H](NCc1ccccc1Br)c1ccccc1 ZINC000426740543 1026521815 /nfs/dbraw/zinc/52/18/15/1026521815.db2.gz BFGUESGJYPWPGP-BLLLJJGKSA-N -1 1 348.240 4.001 20 0 EIADMM CCCCOc1ccc(CN[C@@H](CC(=O)[O-])c2ccc(C)o2)cc1 ZINC000426764429 1026529338 /nfs/dbraw/zinc/52/93/38/1026529338.db2.gz JGRNUGULPHOKKA-KRWDZBQOSA-N -1 1 331.412 4.073 20 0 EIADMM O=C([O-])[C@H](NCc1ccc(Cl)c(Cl)c1)c1ccccc1F ZINC000426782906 1026554828 /nfs/dbraw/zinc/55/48/28/1026554828.db2.gz IARROWAIYIHHSZ-CQSZACIVSA-N -1 1 328.170 4.048 20 0 EIADMM Cc1ccc(-c2ccc(CN[C@@H](CCc3ccccc3)C(=O)[O-])o2)cc1 ZINC000426784534 1026558349 /nfs/dbraw/zinc/55/83/49/1026558349.db2.gz RRVHJCZMKWHRRI-FQEVSTJZSA-N -1 1 349.430 4.431 20 0 EIADMM Cc1ccc([C@@H](CC(=O)[O-])NCc2cnc(-c3cccs3)s2)o1 ZINC000426790186 1026562416 /nfs/dbraw/zinc/56/24/16/1026562416.db2.gz BJBUDYGSPCZESE-GFCCVEGCSA-N -1 1 348.449 4.079 20 0 EIADMM Cc1ccc([C@H](CC(=O)[O-])NCc2cc(Cl)cc3cccnc32)o1 ZINC000426786592 1026563726 /nfs/dbraw/zinc/56/37/26/1026563726.db2.gz WRXQMLXJMRMSLW-HNNXBMFYSA-N -1 1 344.798 4.095 20 0 EIADMM O=C(c1ccc(C(F)(F)F)c([O-])c1)N1CCC[C@@H]1c1cccs1 ZINC000684870202 1026627715 /nfs/dbraw/zinc/62/77/15/1026627715.db2.gz SCNREYIWICGFHN-GFCCVEGCSA-N -1 1 341.354 4.450 20 0 EIADMM O=C(Nc1cnc2ccccc2c1)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684870831 1026633606 /nfs/dbraw/zinc/63/36/06/1026633606.db2.gz LWKQKFUOVYXVIT-UHFFFAOYSA-N -1 1 332.281 4.212 20 0 EIADMM CC(C)c1csc2nc(-c3ccc(OC(F)F)cn3)[n-]c(=O)c12 ZINC000342611331 1026736948 /nfs/dbraw/zinc/73/69/48/1026736948.db2.gz XRQIDPMUAQAHEQ-UHFFFAOYSA-N -1 1 337.351 4.184 20 0 EIADMM COc1ccc(NC(=O)Nc2ccc([O-])c(Cl)c2)c2ncccc12 ZINC000582522304 1026747229 /nfs/dbraw/zinc/74/72/29/1026747229.db2.gz ROYCPLVXCLKEMK-UHFFFAOYSA-N -1 1 343.770 4.246 20 0 EIADMM COc1cc(C(=O)N([C@H](C)c2ccccc2)C2CC2)cc(Cl)c1[O-] ZINC000342692327 1026852237 /nfs/dbraw/zinc/85/22/37/1026852237.db2.gz QCEABMRWBJHEMW-GFCCVEGCSA-N -1 1 345.826 4.420 20 0 EIADMM O=C([O-])c1cccc(C[N@@H+](CCC(F)(F)F)CC2CC2)c1Cl ZINC000582611582 1026860087 /nfs/dbraw/zinc/86/00/87/1026860087.db2.gz FIKAWLNHJVPENU-UHFFFAOYSA-N -1 1 335.753 4.203 20 0 EIADMM O=C([O-])c1cccc(CN(CCC(F)(F)F)CC2CC2)c1Cl ZINC000582611582 1026860094 /nfs/dbraw/zinc/86/00/94/1026860094.db2.gz FIKAWLNHJVPENU-UHFFFAOYSA-N -1 1 335.753 4.203 20 0 EIADMM COc1cnc(=S)[n-]c1O[C@@H](C)c1ccc(Cl)c(Cl)c1 ZINC001226242015 1026906470 /nfs/dbraw/zinc/90/64/70/1026906470.db2.gz GLUSOGYHMRBUJT-ZETCQYMHSA-N -1 1 331.224 4.221 20 0 EIADMM CCOc1cc(-c2noc([C@H]3CC3(Cl)Cl)n2)cc(Cl)c1[O-] ZINC000277826444 1027016937 /nfs/dbraw/zinc/01/69/37/1027016937.db2.gz DTMRYGTZLBUSAI-SSDOTTSWSA-N -1 1 349.601 4.156 20 0 EIADMM Cc1onc(-c2ccccc2)c1C(=O)[N-]c1nc(C(C)(C)C)ns1 ZINC000075444698 1027040565 /nfs/dbraw/zinc/04/05/65/1027040565.db2.gz WYTFLAMLZWQKIE-UHFFFAOYSA-N -1 1 342.424 4.051 20 0 EIADMM CCOc1cc(-c2noc([C@@H]3CCCS3)n2)cc(Cl)c1[O-] ZINC000277836554 1027042006 /nfs/dbraw/zinc/04/20/06/1027042006.db2.gz FLOINPOTRBBTAF-NSHDSACASA-N -1 1 326.805 4.062 20 0 EIADMM Cc1ccc(-c2noc([N-]Cc3nc(-c4ccccc4)c[nH]3)n2)cc1 ZINC000302085276 1027212660 /nfs/dbraw/zinc/21/26/60/1027212660.db2.gz ZEOIIJPDSYLAIM-UHFFFAOYSA-N -1 1 331.379 4.047 20 0 EIADMM COc1cc(C(=O)N(C)C/C(C)=C/c2ccccc2)cc(Cl)c1[O-] ZINC000427555128 1027250763 /nfs/dbraw/zinc/25/07/63/1027250763.db2.gz JGIJZBQFPHLWNC-UKTHLTGXSA-N -1 1 345.826 4.230 20 0 EIADMM COc1c(C)ccc([N-]S(=O)(=O)c2cccc(Cl)c2C)c1C ZINC000614786933 1027674455 /nfs/dbraw/zinc/67/44/55/1027674455.db2.gz KMXXODUYQSFSKE-UHFFFAOYSA-N -1 1 339.844 4.075 20 0 EIADMM CC(C)Cc1ccc(S(=O)(=O)[N-]c2ccc3ncsc3c2)cc1 ZINC000614803050 1027792483 /nfs/dbraw/zinc/79/24/83/1027792483.db2.gz RIOYYCKHOBLCJH-UHFFFAOYSA-N -1 1 346.477 4.296 20 0 EIADMM COc1cc(C(=O)N2CCC3(CCCCC3)CC2)cc(Cl)c1[O-] ZINC000153726798 1027892949 /nfs/dbraw/zinc/89/29/49/1027892949.db2.gz QOHYFPYIRNVYKH-UHFFFAOYSA-N -1 1 337.847 4.241 20 0 EIADMM COc1cc(C)cc(C)c1S(=O)(=O)[N-]c1c(C)cc(C)cc1C ZINC000331331424 1027949373 /nfs/dbraw/zinc/94/93/73/1027949373.db2.gz UEKQDGGZTRZMQD-UHFFFAOYSA-N -1 1 333.453 4.038 20 0 EIADMM Cc1nc(CNCc2cccc(-c3ccccc3)c2)ccc1C(=O)[O-] ZINC000426635166 1027952741 /nfs/dbraw/zinc/95/27/41/1027952741.db2.gz VIZRZFLZKMQJIM-UHFFFAOYSA-N -1 1 332.403 4.045 20 0 EIADMM O=c1cc(C(F)F)nc(SC[C@H]2CCC3(CCCCC3)O2)[n-]1 ZINC000329773052 1028120690 /nfs/dbraw/zinc/12/06/90/1028120690.db2.gz HWFRNFJIIRLNAO-SNVBAGLBSA-N -1 1 330.400 4.094 20 0 EIADMM CC[C@H](C)[C@@H](C)[N-]S(=O)(=O)c1c(Cl)cccc1C(F)(F)F ZINC000523567144 1028218528 /nfs/dbraw/zinc/21/85/28/1028218528.db2.gz RWISACNKLDSGKL-DTWKUNHWSA-N -1 1 343.798 4.072 20 0 EIADMM CCOc1cc(-c2noc([C@@H](C)c3cccnc3)n2)cc(Cl)c1[O-] ZINC000445427785 1028524101 /nfs/dbraw/zinc/52/41/01/1028524101.db2.gz RVYWMKXLHCUTPA-JTQLQIEISA-N -1 1 345.786 4.041 20 0 EIADMM CCOc1ccc(OCc2nc(-c3ccc([O-])cc3Cl)no2)cc1 ZINC000445448377 1028537021 /nfs/dbraw/zinc/53/70/21/1028537021.db2.gz VWVMRAJRNIEZRQ-UHFFFAOYSA-N -1 1 346.770 4.073 20 0 EIADMM CC[C@H](C)n1nc(-c2nc(-c3ccc([O-])cc3Cl)no2)cc1C ZINC000445447076 1028582738 /nfs/dbraw/zinc/58/27/38/1028582738.db2.gz GPYNZUXQGBMYTP-VIFPVBQESA-N -1 1 332.791 4.239 20 0 EIADMM [O-]c1ccc(-c2noc(Cc3ccc(O)cc3Cl)n2)c(Cl)c1 ZINC000445447344 1028583595 /nfs/dbraw/zinc/58/35/95/1028583595.db2.gz OKUGAIVGZMDWOR-UHFFFAOYSA-N -1 1 337.162 4.045 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cccc(-c4cscn4)c3)n2)c(F)c1 ZINC000445456261 1028609072 /nfs/dbraw/zinc/60/90/72/1028609072.db2.gz NNZBVTDIOCRKHN-UHFFFAOYSA-N -1 1 339.351 4.372 20 0 EIADMM [O-]c1ccc(-c2noc(-c3sccc3Br)n2)c(F)c1 ZINC000445457698 1028612578 /nfs/dbraw/zinc/61/25/78/1028612578.db2.gz OSZJSMRTLLPEET-UHFFFAOYSA-N -1 1 341.161 4.072 20 0 EIADMM [O-]c1ccc(-c2noc(-c3ccc4ccc(Cl)cc4n3)n2)c(F)c1 ZINC000445458897 1028613613 /nfs/dbraw/zinc/61/36/13/1028613613.db2.gz VUZFDWFVAQACSL-UHFFFAOYSA-N -1 1 341.729 4.450 20 0 EIADMM [O-]c1ccc(-c2noc(-c3csc(-c4ccccc4)n3)n2)c(F)c1 ZINC000445457815 1028614096 /nfs/dbraw/zinc/61/40/96/1028614096.db2.gz ZUXPKSHTTBSHQW-UHFFFAOYSA-N -1 1 339.351 4.372 20 0 EIADMM [O-]c1ccc(-c2noc([C@@H]3C[C@H]3c3cccc(F)c3F)n2)c(F)c1 ZINC000445460391 1028617710 /nfs/dbraw/zinc/61/77/10/1028617710.db2.gz ACDFMVMFGNDJFH-NWDGAFQWSA-N -1 1 332.281 4.131 20 0 EIADMM [O-]c1ccc(-c2noc(/C=C\c3nc4ccccc4s3)n2)c(F)c1 ZINC000445462194 1028621365 /nfs/dbraw/zinc/62/13/65/1028621365.db2.gz JOVUSCGGXRVOJH-FPLPWBNLSA-N -1 1 339.351 4.361 20 0 EIADMM Cc1c(Cl)cccc1OCc1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445480747 1028627535 /nfs/dbraw/zinc/62/75/35/1028627535.db2.gz IXGYSBIZSOQVGW-UHFFFAOYSA-N -1 1 334.734 4.122 20 0 EIADMM Cn1cc(/C=C\c2nc(-c3ccc([O-])c(F)c3)no2)c2ccccc21 ZINC000445481753 1028627788 /nfs/dbraw/zinc/62/77/88/1028627788.db2.gz QGLZFYYEBZIWEZ-CLFYSBASSA-N -1 1 335.338 4.243 20 0 EIADMM [O-]c1ccc(-c2noc([C@@H]3C[C@H]3c3cccc(F)c3F)n2)cc1F ZINC000445484166 1028633082 /nfs/dbraw/zinc/63/30/82/1028633082.db2.gz WICNIOQGYPJKCJ-WDEREUQCSA-N -1 1 332.281 4.131 20 0 EIADMM CC(C)c1cc(-c2nc(-c3ccc([O-])c(F)c3)no2)nn1C(C)(C)C ZINC000445475162 1028645675 /nfs/dbraw/zinc/64/56/75/1028645675.db2.gz SVCMLDVESLZBJY-UHFFFAOYSA-N -1 1 344.390 4.323 20 0 EIADMM [O-]c1ccc(Oc2ccccc2)cc1-c1nc([C@H]2CCCOC2)no1 ZINC000445517147 1028672919 /nfs/dbraw/zinc/67/29/19/1028672919.db2.gz YDAKUCPMEOVYNP-ZDUSSCGKSA-N -1 1 338.363 4.129 20 0 EIADMM CCOc1cc(C(=O)Nc2cc(C)c(OC)cc2C)cc(Cl)c1[O-] ZINC000278243427 1028677405 /nfs/dbraw/zinc/67/74/05/1028677405.db2.gz WLTLCIRCBWXMOS-UHFFFAOYSA-N -1 1 349.814 4.322 20 0 EIADMM O=S(=O)([N-]c1cc(F)ccc1F)c1c(Cl)cccc1Cl ZINC000016129389 1028786517 /nfs/dbraw/zinc/78/65/17/1028786517.db2.gz BSBHKLNYVBMLJS-UHFFFAOYSA-N -1 1 338.162 4.072 20 0 EIADMM C[N@@H+](Cc1ccsc1C(=O)[O-])Cc1cccc(C(F)(F)F)c1 ZINC000583505081 1028818649 /nfs/dbraw/zinc/81/86/49/1028818649.db2.gz RCZKPVGTZXZOOF-UHFFFAOYSA-N -1 1 329.343 4.097 20 0 EIADMM CN(Cc1ccsc1C(=O)[O-])Cc1cccc(C(F)(F)F)c1 ZINC000583505081 1028818658 /nfs/dbraw/zinc/81/86/58/1028818658.db2.gz RCZKPVGTZXZOOF-UHFFFAOYSA-N -1 1 329.343 4.097 20 0 EIADMM CC[C@@H](C)c1ccc(S(=O)(=O)[N-]c2ccccc2COC)cc1 ZINC000614808300 1029391649 /nfs/dbraw/zinc/39/16/49/1029391649.db2.gz UTBQFUUORVSXOT-CQSZACIVSA-N -1 1 333.453 4.147 20 0 EIADMM Cc1ccc(Cl)c([N-]S(=O)(=O)c2cc(F)c(C)cc2F)c1C ZINC000446957510 1029651449 /nfs/dbraw/zinc/65/14/49/1029651449.db2.gz MUUFWAURBZHPNT-UHFFFAOYSA-N -1 1 345.798 4.344 20 0 EIADMM Cc1ccc([C@H](C)Nc2ccc(-c3nc(C)c(C)c(=O)[n-]3)cn2)cc1 ZINC000301375226 1029720723 /nfs/dbraw/zinc/72/07/23/1029720723.db2.gz RDORNHMGEZTHSH-HNNXBMFYSA-N -1 1 334.423 4.343 20 0 EIADMM CC[C@H]1CCC[C@@H](Nc2ccc(-c3nc(C)c(C)c(=O)[n-]3)cn2)C1 ZINC000301393945 1029724301 /nfs/dbraw/zinc/72/43/01/1029724301.db2.gz JYAXTUPWBRPQDV-GOEBONIOSA-N -1 1 326.444 4.242 20 0 EIADMM Cc1cc(C)c(CNc2ccc(-c3nc(C)c(C)c(=O)[n-]3)cn2)c(C)c1 ZINC000301410672 1029728233 /nfs/dbraw/zinc/72/82/33/1029728233.db2.gz OVRIDBGFHZPLLX-UHFFFAOYSA-N -1 1 348.450 4.398 20 0 EIADMM Fc1ccccc1[N-]c1nnc(Sc2ncc(Cl)cn2)s1 ZINC000301476663 1029740369 /nfs/dbraw/zinc/74/03/69/1029740369.db2.gz BIPOWRNZDUHFCM-UHFFFAOYSA-N -1 1 339.808 4.015 20 0 EIADMM Cc1nc(-c2ccc(N(C)C3CCC(C)(C)CC3)nc2)[n-]c(=O)c1C ZINC000301578719 1029763900 /nfs/dbraw/zinc/76/39/00/1029763900.db2.gz SBDMZFUFKLHHKO-UHFFFAOYSA-N -1 1 340.471 4.266 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1cc(C(F)(F)F)ccc1F ZINC000176839091 1029818348 /nfs/dbraw/zinc/81/83/48/1029818348.db2.gz ODPWSSHEABWACM-UHFFFAOYSA-N -1 1 333.668 4.456 20 0 EIADMM Cc1ccsc1S(=O)(=O)[N-]c1ccc(-c2ccco2)cc1F ZINC000447263019 1029949004 /nfs/dbraw/zinc/94/90/04/1029949004.db2.gz HJMGQALCAUYDGS-UHFFFAOYSA-N -1 1 337.397 4.256 20 0 EIADMM COc1cc(C)cc([N-]S(=O)(=O)c2cccc(Cl)c2C)c1C ZINC000447265851 1029952190 /nfs/dbraw/zinc/95/21/90/1029952190.db2.gz JEVFWIDTEIXPSU-UHFFFAOYSA-N -1 1 339.844 4.075 20 0 EIADMM Cc1ccc(-c2nnco2)cc1NC(=O)c1cc2ccccc2cc1[O-] ZINC000094013597 1030000794 /nfs/dbraw/zinc/00/07/94/1030000794.db2.gz CFEAEBYMXWRCLY-UHFFFAOYSA-N -1 1 345.358 4.156 20 0 EIADMM CC1(C)[C@@H](c2cccc(F)c2)CCN1C(=O)c1ccc([O-])c(F)c1 ZINC000530035528 1030061000 /nfs/dbraw/zinc/06/10/00/1030061000.db2.gz BGHGFBDJQMXTLM-OAHLLOKOSA-N -1 1 331.362 4.079 20 0 EIADMM O=C([O-])c1cccc(CN2CCC(=Cc3ccccc3F)CC2)c1 ZINC000262955995 1030105137 /nfs/dbraw/zinc/10/51/37/1030105137.db2.gz BHNZKLMOQMUQFA-UHFFFAOYSA-N -1 1 325.383 4.203 20 0 EIADMM Cc1cccc([N-]S(=O)(=O)c2ccc(F)c(C(F)(F)F)c2)c1C ZINC000063911015 1030124353 /nfs/dbraw/zinc/12/43/53/1030124353.db2.gz YYDBKYVIGXVHLQ-UHFFFAOYSA-N -1 1 347.333 4.262 20 0 EIADMM Cc1cccc(C)c1CS(=O)(=O)[N-]c1ccccc1C(F)(F)F ZINC000450968270 1030144406 /nfs/dbraw/zinc/14/44/06/1030144406.db2.gz JNGMQSAIQUZMHM-UHFFFAOYSA-N -1 1 343.370 4.264 20 0 EIADMM C[C@@H]1CC(C(=O)[O-])C[C@@H](C)N1Cc1csc(C2CCCCC2)n1 ZINC000530176319 1030195673 /nfs/dbraw/zinc/19/56/73/1030195673.db2.gz SKXIWJOCXWSMKN-CHWSQXEVSA-N -1 1 336.501 4.264 20 0 EIADMM [O-]c1ccc(-c2noc(-c3ccccc3Oc3cccnc3)n2)cc1F ZINC000685366358 1030236142 /nfs/dbraw/zinc/23/61/42/1030236142.db2.gz IORPKPGWOVZWAH-UHFFFAOYSA-N -1 1 349.321 4.436 20 0 EIADMM O=C(c1c(F)ccc([O-])c1F)N1CCC(=Cc2cccc(F)c2)CC1 ZINC000685422714 1030302741 /nfs/dbraw/zinc/30/27/41/1030302741.db2.gz JQSHNDWZKSZUQA-UHFFFAOYSA-N -1 1 347.336 4.129 20 0 EIADMM O=C(c1cncc([O-])c1)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000171909902 1030425066 /nfs/dbraw/zinc/42/50/66/1030425066.db2.gz RSQHLIZPCXBNJS-HNNXBMFYSA-N -1 1 337.206 4.071 20 0 EIADMM O=C([O-])CC[C@@H]1CCCN(Cc2csc(-c3ccccc3F)n2)C1 ZINC000263137881 1030593864 /nfs/dbraw/zinc/59/38/64/1030593864.db2.gz NVJSXROZSNTLFK-ZDUSSCGKSA-N -1 1 348.443 4.026 20 0 EIADMM COc1ccccc1Cc1noc(-c2ccc3ccccc3c2[O-])n1 ZINC000393059696 1030674353 /nfs/dbraw/zinc/67/43/53/1030674353.db2.gz PRSIKEZIEUXXMJ-UHFFFAOYSA-N -1 1 332.359 4.195 20 0 EIADMM CCC[C@H]1CCCC[C@@H]1NC(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC000527487390 1030699815 /nfs/dbraw/zinc/69/98/15/1030699815.db2.gz PRCHMHPUZDNHSX-FZMZJTMJSA-N -1 1 325.836 4.143 20 0 EIADMM C[C@H]1CC[C@@H](C(=O)[O-])CN1Cc1cc(C(F)(F)F)ccc1Cl ZINC000263396036 1030848677 /nfs/dbraw/zinc/84/86/77/1030848677.db2.gz ZKHQTHXMYNJPRU-VHSXEESVSA-N -1 1 335.753 4.044 20 0 EIADMM C[C@H]1CC[C@H](C(=O)[O-])CN1Cc1cc(C(F)(F)F)ccc1Cl ZINC000263396034 1030849186 /nfs/dbraw/zinc/84/91/86/1030849186.db2.gz ZKHQTHXMYNJPRU-UWVGGRQHSA-N -1 1 335.753 4.044 20 0 EIADMM COc1ccc2c(c1)CCCN2C(=O)c1cc2ccccc2cc1[O-] ZINC000843786182 1031147769 /nfs/dbraw/zinc/14/77/69/1031147769.db2.gz ZALPWYFOFYSLDJ-UHFFFAOYSA-N -1 1 333.387 4.147 20 0 EIADMM CC(C)(C)CCCC(=O)N1CCC(C(=O)c2ccc([O-])cc2)CC1 ZINC000103519921 1031265780 /nfs/dbraw/zinc/26/57/80/1031265780.db2.gz AOHWZCZHABMKJF-UHFFFAOYSA-N -1 1 331.456 4.030 20 0 EIADMM C[C@@H]1CC[C@@H](c2noc(-c3cc(Oc4ccccc4)ccc3[O-])n2)O1 ZINC000528232961 1031279984 /nfs/dbraw/zinc/27/99/84/1031279984.db2.gz IKUNXFAAELZUMU-PXAZEXFGSA-N -1 1 338.363 4.475 20 0 EIADMM O=C(Nc1ccc(F)cc1[O-])[C@@H]1C[C@@H]1c1ccccc1C(F)(F)F ZINC000532621093 1031429350 /nfs/dbraw/zinc/42/93/50/1031429350.db2.gz VWBLZKJYTWQEEV-VXGBXAGGSA-N -1 1 339.288 4.292 20 0 EIADMM C[C@H](C(=O)Nc1ccc(F)cc1[O-])c1ccc(Br)s1 ZINC000532621998 1031435188 /nfs/dbraw/zinc/43/51/88/1031435188.db2.gz XTYDJNNVCMLUJO-ZETCQYMHSA-N -1 1 344.205 4.098 20 0 EIADMM Cc1cccc([N-]S(=O)(=O)c2cc(F)c(C)cc2F)c1Cl ZINC000531642229 1031437126 /nfs/dbraw/zinc/43/71/26/1031437126.db2.gz IEGNLCRXTKVARQ-UHFFFAOYSA-N -1 1 331.771 4.036 20 0 EIADMM CCOc1cc(-c2noc(CC3CC(F)(F)C3)n2)cc(Cl)c1[O-] ZINC000453163036 1031665295 /nfs/dbraw/zinc/66/52/95/1031665295.db2.gz LSURJGMMTHDZFT-UHFFFAOYSA-N -1 1 344.745 4.082 20 0 EIADMM CCc1ccc(S(=O)(=O)[N-]c2cc(-c3ncco3)ccc2C)cc1 ZINC000134688193 1032008032 /nfs/dbraw/zinc/00/80/32/1032008032.db2.gz RWCDMIQBAQKLEO-UHFFFAOYSA-N -1 1 342.420 4.013 20 0 EIADMM CCc1ccc([C@@H]2CN(Cc3cccc([O-])c3Cl)CCO2)cc1 ZINC000513185388 1034831183 /nfs/dbraw/zinc/83/11/83/1034831183.db2.gz ZGUMCRYUPOVJLN-SFHVURJKSA-N -1 1 331.843 4.182 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1ccc(Oc2ccccc2)cn1 ZINC000571485166 1036051033 /nfs/dbraw/zinc/05/10/33/1036051033.db2.gz UKUKBNCIZUKBPL-UHFFFAOYSA-N -1 1 340.766 4.485 20 0 EIADMM CC(C)(C)OC(=O)Nc1ccc(C(=O)Nc2ccsc2)c([O-])c1 ZINC000156599871 1036052123 /nfs/dbraw/zinc/05/21/23/1036052123.db2.gz ITGLVQBZCJLTET-UHFFFAOYSA-N -1 1 334.397 4.053 20 0 EIADMM O=C(Cc1cscc1Br)Nc1ccc([O-])c(Cl)c1 ZINC000485654506 1036122515 /nfs/dbraw/zinc/12/25/15/1036122515.db2.gz FOXSSZVMBGDPDH-UHFFFAOYSA-N -1 1 346.633 4.051 20 0 EIADMM CC1(C)CC[C@@H](CNC(=O)c2c(F)ccc([O-])c2F)c2ccccc21 ZINC000572648069 1036804922 /nfs/dbraw/zinc/80/49/22/1036804922.db2.gz MPDFSXLNABGXAT-LBPRGKRZSA-N -1 1 345.389 4.255 20 0 EIADMM O=C(Nc1cc([O-])c(F)cc1F)[C@@H](c1cccnc1)C1CCCCC1 ZINC000909988298 1037256418 /nfs/dbraw/zinc/25/64/18/1037256418.db2.gz FCQPWPWNOQDQAX-GOSISDBHSA-N -1 1 346.377 4.368 20 0 EIADMM CCc1ccccc1S(=O)(=O)[N-]c1cccc(-c2nccs2)c1 ZINC000488230460 1037431337 /nfs/dbraw/zinc/43/13/37/1037431337.db2.gz JDRDBLLQRXVVDI-UHFFFAOYSA-N -1 1 344.461 4.173 20 0 EIADMM CC(C)O[C@@H](CSc1nc(C(F)F)cc(=O)[n-]1)c1ccccc1 ZINC000488265336 1037467243 /nfs/dbraw/zinc/46/72/43/1037467243.db2.gz QHHSPFPWWNYZRL-ZDUSSCGKSA-N -1 1 340.395 4.378 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1CCCO[C@H](c2ccccc2)C1 ZINC000591795346 1037584008 /nfs/dbraw/zinc/58/40/08/1037584008.db2.gz JPCXOGLZPZITAV-NRFANRHFSA-N -1 1 347.414 4.149 20 0 EIADMM Cc1cc(Cl)cc2nc(SCC(=O)c3ccc([O-])cc3)oc21 ZINC000604933612 1037584798 /nfs/dbraw/zinc/58/47/98/1037584798.db2.gz AUCWFXLATBLJGD-UHFFFAOYSA-N -1 1 333.796 4.470 20 0 EIADMM COc1cc([N-]S(=O)(=O)c2ccc(Cl)cc2C)c(C)cc1C ZINC000478709670 1037596255 /nfs/dbraw/zinc/59/62/55/1037596255.db2.gz ICKYGOSKBYBJKE-UHFFFAOYSA-N -1 1 339.844 4.075 20 0 EIADMM O=C([O-])[C@@H]1CCCN1Cc1ccc(-c2ccc(C(F)(F)F)cc2)o1 ZINC000414670952 1037767578 /nfs/dbraw/zinc/76/75/78/1037767578.db2.gz AIXPPKICXPFXEN-AWEZNQCLSA-N -1 1 339.313 4.014 20 0 EIADMM CC[C@@H](C)N(CC(=O)[O-])Cc1ccc(-c2nc3ccccc3s2)o1 ZINC000414673366 1037775045 /nfs/dbraw/zinc/77/50/45/1037775045.db2.gz DKQIUFNOZBABGW-GFCCVEGCSA-N -1 1 344.436 4.241 20 0 EIADMM O=C(C[C@H](c1ccccc1)C(F)(F)F)Nc1c([O-])cccc1F ZINC000605437004 1037786320 /nfs/dbraw/zinc/78/63/20/1037786320.db2.gz NYFGFXXIMZZNNI-LLVKDONJSA-N -1 1 327.277 4.206 20 0 EIADMM Cc1cc(C)c(C(=O)CCCC(=O)Nc2c([O-])cccc2F)c(C)c1 ZINC000605435638 1037788472 /nfs/dbraw/zinc/78/84/72/1037788472.db2.gz IAAPVFGRUNLESH-UHFFFAOYSA-N -1 1 343.398 4.448 20 0 EIADMM O=C(CCCOc1cccc2ccccc21)Nc1c([O-])cccc1F ZINC000605438367 1037788768 /nfs/dbraw/zinc/78/87/68/1037788768.db2.gz SVIZSWIKNPUUCM-UHFFFAOYSA-N -1 1 339.366 4.482 20 0 EIADMM O=C([O-])[C@@H]1CCCN1Cc1ccc(-c2cccc(Cl)c2Cl)o1 ZINC000414688240 1037826898 /nfs/dbraw/zinc/82/68/98/1037826898.db2.gz XZSVJGUZTSSIPC-ZDUSSCGKSA-N -1 1 340.206 4.302 20 0 EIADMM CCOc1c(Cl)cccc1CN[C@H](CC(=O)[O-])c1cccs1 ZINC000669472803 1037937193 /nfs/dbraw/zinc/93/71/93/1037937193.db2.gz WVLAFZPWVJJEHH-CYBMUJFWSA-N -1 1 339.844 4.106 20 0 EIADMM S=c1[nH]nc(Cc2cccs2)n1C[N@H+]1CCC2(C1)CCCCC2 ZINC000172938157 1038019367 /nfs/dbraw/zinc/01/93/67/1038019367.db2.gz JKYQCHSFCAQLTJ-UHFFFAOYSA-N -1 1 348.541 4.207 20 0 EIADMM Cc1ccccc1S(=O)(=O)[N-]c1ccc(Cl)c(OC(F)F)c1 ZINC000504027287 1038095928 /nfs/dbraw/zinc/09/59/28/1038095928.db2.gz SVLAAXDMHVOARU-UHFFFAOYSA-N -1 1 347.770 4.051 20 0 EIADMM O=C([N-]c1nc(-c2cccs2)ns1)c1sccc1Cl ZINC000504045146 1038113084 /nfs/dbraw/zinc/11/30/84/1038113084.db2.gz VNVFQSGYSBTBLL-UHFFFAOYSA-N -1 1 327.843 4.234 20 0 EIADMM Cc1ccc2c(c1)[C@H](Nc1ccc(-c3nc(C)c(C)c(=O)[n-]3)cn1)CC2 ZINC000608085460 1038506575 /nfs/dbraw/zinc/50/65/75/1038506575.db2.gz SCAFJRHRLLEAOE-GOSISDBHSA-N -1 1 346.434 4.269 20 0 EIADMM CCCCN(CC)c1ccc(C(=O)Nc2c([O-])cccc2F)cc1 ZINC000608365735 1038802874 /nfs/dbraw/zinc/80/28/74/1038802874.db2.gz AXYAZSDORMTNQS-UHFFFAOYSA-N -1 1 330.403 4.410 20 0 EIADMM Cc1nc(-c2cccc(C(=O)Nc3c([O-])cccc3F)c2)cs1 ZINC000608365255 1038803757 /nfs/dbraw/zinc/80/37/57/1038803757.db2.gz BWNKTVHMSWQKQC-UHFFFAOYSA-N -1 1 328.368 4.216 20 0 EIADMM C[C@H]1CCCN(Cc2cc(Cl)cc(C(F)(F)F)c2)[C@H]1C(=O)[O-] ZINC000424424872 1038845285 /nfs/dbraw/zinc/84/52/85/1038845285.db2.gz XPGICPBUMHDFCJ-TVQRCGJNSA-N -1 1 335.753 4.044 20 0 EIADMM C[C@@H]1CCCN(Cc2ccc(Cl)c(C(F)(F)F)c2)[C@H]1C(=O)[O-] ZINC000424413219 1038851014 /nfs/dbraw/zinc/85/10/14/1038851014.db2.gz FIOIPHQRILXNEW-NOZJJQNGSA-N -1 1 335.753 4.044 20 0 EIADMM O=C(NCc1ccc([O-])c(Cl)c1)[C@@H](c1ccncc1)C1CCCC1 ZINC000899192683 1038860267 /nfs/dbraw/zinc/86/02/67/1038860267.db2.gz MRCKTEULOXNLNN-GOSISDBHSA-N -1 1 344.842 4.031 20 0 EIADMM CC(C)[C@H](NCc1n[nH]c(=O)[n-]1)c1ccc(C2CCCCC2)cc1 ZINC000539247845 1038894987 /nfs/dbraw/zinc/89/49/87/1038894987.db2.gz FKDCIJGFLNABCN-SFHVURJKSA-N -1 1 328.460 4.045 20 0 EIADMM O=S(=O)([N-]c1ccc(C(F)(F)F)cc1Cl)c1cccs1 ZINC000119639765 1038981748 /nfs/dbraw/zinc/98/17/48/1038981748.db2.gz MUTQBSUNLOZWTK-UHFFFAOYSA-N -1 1 341.763 4.221 20 0 EIADMM O=C(Nc1ccc(F)cc1[O-])c1ccc(C(F)(F)F)cc1Cl ZINC000539354318 1039005087 /nfs/dbraw/zinc/00/50/87/1039005087.db2.gz PQSVOGSOSYHUNF-UHFFFAOYSA-N -1 1 333.668 4.456 20 0 EIADMM Cc1c(C([O-])=C(C#N)c2cc(C)nc(C)n2)sc2cccc(F)c12 ZINC000041562741 1039482004 /nfs/dbraw/zinc/48/20/04/1039482004.db2.gz QDERJMOHIDAFTF-LBPRGKRZSA-N -1 1 339.395 4.246 20 0 EIADMM Cc1cccc(OCCCCC(=O)Nc2ccc([O-])c(F)c2F)c1 ZINC000456780431 1039601796 /nfs/dbraw/zinc/60/17/96/1039601796.db2.gz CIFWXVNNAPJBHX-UHFFFAOYSA-N -1 1 335.350 4.167 20 0 EIADMM O=C([O-])c1cc(Cl)ccc1CN1CCC(Oc2ccccc2)CC1 ZINC001142647517 1039682226 /nfs/dbraw/zinc/68/22/26/1039682226.db2.gz ZGOFNNFCXDSIKR-UHFFFAOYSA-N -1 1 345.826 4.082 20 0 EIADMM C[C@H](c1cccc(Cl)c1)N(C)C(=O)c1c[nH]c2ccccc2c1=O ZINC000097106392 1039864246 /nfs/dbraw/zinc/86/42/46/1039864246.db2.gz XYZVXKWPKPUIBT-GFCCVEGCSA-N -1 1 340.810 4.015 20 0 EIADMM Cc1ccc2c(c1)N(C(=O)c1ccc3ccccc3c1[O-])C[C@H](C)O2 ZINC000537672846 1039880211 /nfs/dbraw/zinc/88/02/11/1039880211.db2.gz HBZUSHSHDOBIJC-AWEZNQCLSA-N -1 1 333.387 4.282 20 0 EIADMM Cc1nc(-c2ccc(N[C@H]3C[C@H](c4ccccc4)C3)nc2)[n-]c(=O)c1C ZINC000366612686 1039965403 /nfs/dbraw/zinc/96/54/03/1039965403.db2.gz ZRSHDCFIKNSCQU-IYARVYRRSA-N -1 1 346.434 4.219 20 0 EIADMM O=S(=O)([N-]c1cccc(Cl)c1F)c1cc(Cl)ccc1F ZINC000551109360 1039982112 /nfs/dbraw/zinc/98/21/12/1039982112.db2.gz JWWDXUVIYUWIII-UHFFFAOYSA-N -1 1 338.162 4.072 20 0 EIADMM COc1cc(C(=O)N2C[C@@H](C)C[C@@H]2c2ccccc2)cc(Cl)c1[O-] ZINC000553337669 1040146673 /nfs/dbraw/zinc/14/66/73/1040146673.db2.gz RMEYYGNPJBKMFW-BLLLJJGKSA-N -1 1 345.826 4.278 20 0 EIADMM O=S(=O)([N-]c1ccnc(-c2ccccc2)c1)c1ccc(Cl)cc1 ZINC000479307259 1040247806 /nfs/dbraw/zinc/24/78/06/1040247806.db2.gz FHHIVHOKPJWXEZ-UHFFFAOYSA-N -1 1 344.823 4.203 20 0 EIADMM CC(C)[C@@H](C(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)c1ccccc1 ZINC000477130504 1040250019 /nfs/dbraw/zinc/25/00/19/1040250019.db2.gz ANBHECMXTHEVTO-LJQANCHMSA-N -1 1 335.407 4.161 20 0 EIADMM C[C@H](c1ccccc1)[C@H](C)NC(=O)c1ccc(Br)c([O-])c1 ZINC000491243129 1040330579 /nfs/dbraw/zinc/33/05/79/1040330579.db2.gz KQSDGQILAJWCCX-RYUDHWBXSA-N -1 1 348.240 4.077 20 0 EIADMM Cc1cc(Br)c([O-])c(NC(=O)c2ccc(F)c(C)c2)c1 ZINC000482608065 1040380414 /nfs/dbraw/zinc/38/04/14/1040380414.db2.gz VFTHOYZCKLOVPI-UHFFFAOYSA-N -1 1 338.176 4.163 20 0 EIADMM C[C@H](Cc1cncc2ccccc21)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000553951276 1040656640 /nfs/dbraw/zinc/65/66/40/1040656640.db2.gz JRGVDTDNIWCUNP-GFCCVEGCSA-N -1 1 340.810 4.411 20 0 EIADMM CSc1ccccc1S(=O)(=O)[N-]c1ccc(Cl)cc1C ZINC000436012637 1040806473 /nfs/dbraw/zinc/80/64/73/1040806473.db2.gz KGLYRSPOFGKIKN-UHFFFAOYSA-N -1 1 327.858 4.171 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc(OC(C)C)cc2Cl)s1 ZINC000436158670 1040914151 /nfs/dbraw/zinc/91/41/51/1040914151.db2.gz XFHSIYGTGRZDDR-UHFFFAOYSA-N -1 1 345.873 4.298 20 0 EIADMM Cc1cc(F)cc(S(=O)(=O)[N-]c2cccc(C(C)(F)F)c2)c1 ZINC000436165486 1040919035 /nfs/dbraw/zinc/91/90/35/1040919035.db2.gz OIXSWZFMIBOEHK-UHFFFAOYSA-N -1 1 329.343 4.047 20 0 EIADMM O=c1nc(-c2ccc(OC3CCCCC3)cc2)[n-]c2ccsc21 ZINC000505773589 1040956616 /nfs/dbraw/zinc/95/66/16/1040956616.db2.gz OGMVWAFMUWZAGY-UHFFFAOYSA-N -1 1 326.421 4.363 20 0 EIADMM COc1ccc(CSc2nc(-c3ccccc3)c(C)c(=O)[n-]2)cc1 ZINC000436211116 1040962321 /nfs/dbraw/zinc/96/23/21/1040962321.db2.gz PDODDGXPMCJVIU-UHFFFAOYSA-N -1 1 338.432 4.459 20 0 EIADMM CC[C@H](Cc1ccccc1)Nc1ccc(-c2nc(C)c(C)c(=O)[n-]2)cn1 ZINC000462803420 1040971933 /nfs/dbraw/zinc/97/19/33/1040971933.db2.gz AWEFCEFEECLUOK-GOSISDBHSA-N -1 1 348.450 4.294 20 0 EIADMM O=C([N-]c1cc(F)cc(F)c1F)c1cc(-c2cccc(F)c2)no1 ZINC000554354037 1041009828 /nfs/dbraw/zinc/00/98/28/1041009828.db2.gz OTANSDICTYHYOY-UHFFFAOYSA-N -1 1 336.244 4.150 20 0 EIADMM O=S(=O)([N-]c1ncccc1F)c1ccc(C2CCCCC2)cc1 ZINC000480178610 1041044684 /nfs/dbraw/zinc/04/46/84/1041044684.db2.gz MFJLHVXBVGPLCD-UHFFFAOYSA-N -1 1 334.416 4.069 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1cc(-c2ccc(Cl)cc2)[nH]n1 ZINC000554426231 1041105779 /nfs/dbraw/zinc/10/57/79/1041105779.db2.gz KTUJYTCHNPAEFA-UHFFFAOYSA-N -1 1 348.189 4.341 20 0 EIADMM C[C@@H](c1nc2ccccc2s1)N(C)C(=O)c1ccc(Cl)cc1[O-] ZINC000194811594 1041211934 /nfs/dbraw/zinc/21/19/34/1041211934.db2.gz URNWPMHISKWPDW-JTQLQIEISA-N -1 1 346.839 4.489 20 0 EIADMM CC(C)c1ccc([C@@H](CC(=O)[O-])NCc2ccncc2Cl)cc1 ZINC000904002162 1041250141 /nfs/dbraw/zinc/25/01/41/1041250141.db2.gz OUXCRSMKKQJMRK-QGZVFWFLSA-N -1 1 332.831 4.164 20 0 EIADMM CCc1nc([C@H](C)NC(=O)c2cc3ccccc3cc2[O-])cs1 ZINC000436554742 1041327592 /nfs/dbraw/zinc/32/75/92/1041327592.db2.gz LNVLFNSSJNBGRS-NSHDSACASA-N -1 1 326.421 4.055 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N1CCC[C@H](Cc2ccccc2)C1 ZINC000436553769 1041328321 /nfs/dbraw/zinc/32/83/21/1041328321.db2.gz GYYSOMGQMVXYIY-OAHLLOKOSA-N -1 1 329.827 4.141 20 0 EIADMM CC(C)c1ccc(C(=O)Nc2ccc(-c3cncnc3)cc2)c([O-])c1 ZINC000436540981 1041334116 /nfs/dbraw/zinc/33/41/16/1041334116.db2.gz YNVGTMHNEWRUFJ-UHFFFAOYSA-N -1 1 333.391 4.225 20 0 EIADMM COc1ccc(C(=O)Nc2ccc(-c3nc(C)cs3)cc2)c([O-])c1 ZINC000436540008 1041336675 /nfs/dbraw/zinc/33/66/75/1041336675.db2.gz XJLXLYFVPUCCHW-UHFFFAOYSA-N -1 1 340.404 4.085 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N1C[C@H](c2ccccc2)[C@H]2CCC[C@H]21 ZINC000436557199 1041341459 /nfs/dbraw/zinc/34/14/59/1041341459.db2.gz SWXMUMGFGCRSBT-KBAYOESNSA-N -1 1 341.838 4.454 20 0 EIADMM COc1ccccc1[C@@H]1CCCN1C(=O)c1ccc(Cl)cc1[O-] ZINC000436566101 1041347438 /nfs/dbraw/zinc/34/74/38/1041347438.db2.gz PFVRGMTUWUZNJR-HNNXBMFYSA-N -1 1 331.799 4.032 20 0 EIADMM CCOc1ccc(OC)cc1NC(=O)c1cc2ccccc2cc1[O-] ZINC000436566354 1041347589 /nfs/dbraw/zinc/34/75/89/1041347589.db2.gz LMPLLIQVQZXNDM-UHFFFAOYSA-N -1 1 337.375 4.205 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N(Cc1ccccc1)CC(F)F ZINC000436571211 1041348275 /nfs/dbraw/zinc/34/82/75/1041348275.db2.gz UUCNTVIRLADZTF-UHFFFAOYSA-N -1 1 341.357 4.453 20 0 EIADMM Cc1ccnc(Oc2cc(NC(=O)c3ccccc3[O-])ccc2C)c1 ZINC000436569106 1041349568 /nfs/dbraw/zinc/34/95/68/1041349568.db2.gz ZUYBGHGFYTXRAT-UHFFFAOYSA-N -1 1 334.375 4.449 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1CCOC2(C1)CCCCCC2 ZINC000436594230 1041354775 /nfs/dbraw/zinc/35/47/75/1041354775.db2.gz DRKJQSGJFGCAHI-UHFFFAOYSA-N -1 1 339.435 4.111 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1CC[C@@H](c2ccc(F)cc2)C1 ZINC000436582995 1041359580 /nfs/dbraw/zinc/35/95/80/1041359580.db2.gz FPHYSLCZDBSJPB-MRXNPFEDSA-N -1 1 335.378 4.314 20 0 EIADMM O=C(C[C@H]1CCCN1C(=O)c1ccc2ccccc2c1[O-])c1ccco1 ZINC000436581651 1041360601 /nfs/dbraw/zinc/36/06/01/1041360601.db2.gz BGPALDJPIPZDNK-OAHLLOKOSA-N -1 1 349.386 4.016 20 0 EIADMM O=C(Nc1ccc(COCc2ccccc2)cc1)c1ccccc1[O-] ZINC000436589425 1041366481 /nfs/dbraw/zinc/36/64/81/1041366481.db2.gz KPBMMMOCAHZQBI-UHFFFAOYSA-N -1 1 333.387 4.361 20 0 EIADMM O=C(c1cc(F)ccc1[O-])N1CCC[C@H]1CCCc1ccccc1 ZINC000436607743 1041370280 /nfs/dbraw/zinc/37/02/80/1041370280.db2.gz TZGDYBSNBFRLEB-QGZVFWFLSA-N -1 1 327.399 4.159 20 0 EIADMM Cc1cc(OCc2ccccc2)ccc1NC(=O)c1ccc(O)cc1[O-] ZINC000436668575 1041408367 /nfs/dbraw/zinc/40/83/67/1041408367.db2.gz CWBYTEKALFDGBG-UHFFFAOYSA-N -1 1 349.386 4.238 20 0 EIADMM O=C([O-])c1ccc2nc(/C=C/c3cc(F)c(O)c(F)c3)ccc2c1 ZINC000436669051 1041408473 /nfs/dbraw/zinc/40/84/73/1041408473.db2.gz ZIWRQZSSMAHEGI-DAFODLJHSA-N -1 1 327.286 4.087 20 0 EIADMM CC(C)Oc1ncccc1-c1noc(-c2ccc3ccccc3c2[O-])n1 ZINC000436685988 1041421822 /nfs/dbraw/zinc/42/18/22/1041421822.db2.gz FCMABVLXEUNLKL-UHFFFAOYSA-N -1 1 347.374 4.445 20 0 EIADMM CC(C)c1ccc(C(=O)Nc2ccc(NC(=O)C3CC3)cc2)c([O-])c1 ZINC000436699559 1041432153 /nfs/dbraw/zinc/43/21/53/1041432153.db2.gz SAIGFPBVXYJJDF-UHFFFAOYSA-N -1 1 338.407 4.116 20 0 EIADMM O=C(C(=O)N1CCCCC[C@@H]1/C=C\c1ccccc1)c1ccc([O-])cc1 ZINC000436704459 1041434018 /nfs/dbraw/zinc/43/40/18/1041434018.db2.gz PBYMNVYKUDGSQV-QTJNJRLBSA-N -1 1 349.430 4.060 20 0 EIADMM O=C(c1cc(F)ccc1[O-])N1C[C@H](c2ccccc2)[C@@H]2CCCC[C@@H]21 ZINC000436704238 1041435800 /nfs/dbraw/zinc/43/58/00/1041435800.db2.gz GMMGQJITKYKACC-UHOSZYNNSA-N -1 1 339.410 4.330 20 0 EIADMM C[C@H]1CC[C@@]2(CCN(C(=O)c3ccc(C(F)(F)F)cc3[O-])C2)C1 ZINC000436725819 1041437279 /nfs/dbraw/zinc/43/72/79/1041437279.db2.gz VHDFAJXYLOXFSX-MEDUHNTESA-N -1 1 327.346 4.063 20 0 EIADMM Cc1ccccc1OCCN(C)C(=O)c1ccc2ccccc2c1[O-] ZINC000436757612 1041456325 /nfs/dbraw/zinc/45/63/25/1041456325.db2.gz VDYQURQCHJMOLO-UHFFFAOYSA-N -1 1 335.403 4.005 20 0 EIADMM CC[C@@H](NC(=O)c1cc(Cl)c([O-])c(OC)c1)c1ccc(C)cc1 ZINC000436763128 1041459775 /nfs/dbraw/zinc/45/97/75/1041459775.db2.gz FBZFATAHDYNTNV-OAHLLOKOSA-N -1 1 333.815 4.244 20 0 EIADMM O=C(c1ccc(C(F)(F)F)cc1[O-])N1CCC[C@@H]2CCCC[C@H]21 ZINC000436763091 1041460248 /nfs/dbraw/zinc/46/02/48/1041460248.db2.gz ISNKVFXMIMRWEL-SMDDNHRTSA-N -1 1 327.346 4.206 20 0 EIADMM CC[C@H](NC(=O)c1cc(Cl)c([O-])c(OC)c1)c1ccc(C)cc1 ZINC000436762927 1041460376 /nfs/dbraw/zinc/46/03/76/1041460376.db2.gz FBZFATAHDYNTNV-HNNXBMFYSA-N -1 1 333.815 4.244 20 0 EIADMM CCS[C@@H]1CCCCN(C(=O)c2ccc(C(F)(F)F)cc2[O-])C1 ZINC000436750263 1041463824 /nfs/dbraw/zinc/46/38/24/1041463824.db2.gz FQVRSKGONYPIIX-GFCCVEGCSA-N -1 1 347.402 4.159 20 0 EIADMM CCN(Cc1cccc(F)c1)C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436769253 1041477582 /nfs/dbraw/zinc/47/75/82/1041477582.db2.gz YSDNTLPPKJAOBL-UHFFFAOYSA-N -1 1 341.304 4.212 20 0 EIADMM CC(C)c1cc(C(=O)Nc2ccc(F)cc2[O-])nn1-c1ccccc1 ZINC000436814521 1041492429 /nfs/dbraw/zinc/49/24/29/1041492429.db2.gz RXOCZQIVTVSPQX-UHFFFAOYSA-N -1 1 339.370 4.093 20 0 EIADMM CN(Cc1cccc2[nH]ccc21)C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436821894 1041500747 /nfs/dbraw/zinc/50/07/47/1041500747.db2.gz MTEUOYAXFUEYJL-UHFFFAOYSA-N -1 1 348.324 4.165 20 0 EIADMM CSc1ccc(N(C)C(=O)c2ccc(C(F)(F)F)cc2[O-])cc1 ZINC000436821178 1041502296 /nfs/dbraw/zinc/50/22/96/1041502296.db2.gz VRJXAUIRDJEZKS-UHFFFAOYSA-N -1 1 341.354 4.410 20 0 EIADMM CC[C@@H](c1cccc(OC)c1)N(C)C(=O)c1cc(Cl)ccc1[O-] ZINC000436846336 1041514629 /nfs/dbraw/zinc/51/46/29/1041514629.db2.gz MGCGQVPVBPJLID-INIZCTEOSA-N -1 1 333.815 4.278 20 0 EIADMM CC(C)n1ncc(-c2nc(-c3ccc([O-])cc3Cl)no2)c1C1CC1 ZINC000436870333 1041528214 /nfs/dbraw/zinc/52/82/14/1041528214.db2.gz HKQQWXUVGUBUBJ-UHFFFAOYSA-N -1 1 344.802 4.417 20 0 EIADMM C[C@@H](Cc1cncc2ccccc21)c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000436874099 1041531824 /nfs/dbraw/zinc/53/18/24/1041531824.db2.gz PGWSHWGVFWACGZ-LBPRGKRZSA-N -1 1 349.365 4.476 20 0 EIADMM [O-]c1ccc(-c2noc(Cc3ccc(Cl)c(F)c3)n2)c(Cl)c1 ZINC000436875062 1041532692 /nfs/dbraw/zinc/53/26/92/1041532692.db2.gz VYVSGEDNFOLFHF-UHFFFAOYSA-N -1 1 339.153 4.479 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cnccc3Oc3ccccc3)n2)cc1F ZINC000436880970 1041538566 /nfs/dbraw/zinc/53/85/66/1041538566.db2.gz UTLNWUYNKPBIRM-UHFFFAOYSA-N -1 1 349.321 4.436 20 0 EIADMM [O-]c1ccc(F)cc1-c1nc(-c2ccc(C(F)(F)F)c(F)c2)no1 ZINC000436903678 1041546521 /nfs/dbraw/zinc/54/65/21/1041546521.db2.gz NPWFKSKKNCAWHU-UHFFFAOYSA-N -1 1 342.223 4.406 20 0 EIADMM COc1ccc(-c2nc(-c3ccccc3OCC(C)C)no2)c([O-])c1 ZINC000436908826 1041548247 /nfs/dbraw/zinc/54/82/47/1041548247.db2.gz KJXXDXGVNGLPGJ-UHFFFAOYSA-N -1 1 340.379 4.153 20 0 EIADMM COc1ccc(N(CCC(C)C)C(=O)c2ccc([O-])cc2F)cc1 ZINC000436912315 1041550073 /nfs/dbraw/zinc/55/00/73/1041550073.db2.gz SKYMPKGYDQEGHV-UHFFFAOYSA-N -1 1 331.387 4.233 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1CC[C@@H](COc2ccccc2)C1 ZINC000436915112 1041556433 /nfs/dbraw/zinc/55/64/33/1041556433.db2.gz OXINRAUTLRPGTG-MRXNPFEDSA-N -1 1 347.414 4.087 20 0 EIADMM [O-]c1ccc(F)cc1-c1nc(Cc2c[nH]c3cc(Cl)ccc23)no1 ZINC000436921129 1041557432 /nfs/dbraw/zinc/55/74/32/1041557432.db2.gz UOGABEOHMJGXOM-UHFFFAOYSA-N -1 1 343.745 4.307 20 0 EIADMM Cc1cc(O)ccc1-c1nc2ccc(-c3ccccc3)cc2c(=O)[n-]1 ZINC000436922919 1041558894 /nfs/dbraw/zinc/55/88/94/1041558894.db2.gz ROOSQGPRVKQWPX-UHFFFAOYSA-N -1 1 328.371 4.271 20 0 EIADMM [O-]c1ccc(F)cc1-c1nc(Cc2cc(Cl)ccc2Cl)no1 ZINC000436928389 1041562546 /nfs/dbraw/zinc/56/25/46/1041562546.db2.gz AUKLYKXNPKTMKM-UHFFFAOYSA-N -1 1 339.153 4.479 20 0 EIADMM COc1ccc(-c2nc(CCCc3ccccc3Cl)no2)c([O-])c1 ZINC000436933737 1041565805 /nfs/dbraw/zinc/56/58/05/1041565805.db2.gz IVYMQQNSYPBGFA-UHFFFAOYSA-N -1 1 344.798 4.280 20 0 EIADMM Oc1cc2ccccc2cc1-c1nc(-c2ccc3[nH]cnc3c2)no1 ZINC000436937924 1041567565 /nfs/dbraw/zinc/56/75/65/1041567565.db2.gz HMSCRWGMVMKAGF-UHFFFAOYSA-N -1 1 328.331 4.139 20 0 EIADMM O=C(c1cc(Br)ccc1[O-])N(CC1CC1)c1ccccc1 ZINC000436964852 1041571879 /nfs/dbraw/zinc/57/18/79/1041571879.db2.gz HKYDXCDMQNSSBZ-UHFFFAOYSA-N -1 1 346.224 4.212 20 0 EIADMM COc1cccc(C2=CCN(C(=O)c3ccc4ccccc4c3[O-])C2)c1 ZINC000436959364 1041576693 /nfs/dbraw/zinc/57/66/93/1041576693.db2.gz MXPABCLROUNTJU-UHFFFAOYSA-N -1 1 345.398 4.093 20 0 EIADMM Cc1ccc(Cl)c([N-]S(=O)(=O)c2c(F)cccc2Cl)c1 ZINC000463799301 1041761806 /nfs/dbraw/zinc/76/18/06/1041761806.db2.gz NSSNXJFFVDMPOV-UHFFFAOYSA-N -1 1 334.199 4.242 20 0 EIADMM O=C(N[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1)c1ccc([O-])cc1F ZINC000437331414 1041762289 /nfs/dbraw/zinc/76/22/89/1041762289.db2.gz WWPPSWVWAHGLAJ-XHDPSFHLSA-N -1 1 340.181 4.124 20 0 EIADMM CCOc1cc(C(=O)N[C@H]2C[C@H](c3ccccc3)C2)cc(Cl)c1[O-] ZINC000437431138 1041803925 /nfs/dbraw/zinc/80/39/25/1041803925.db2.gz RLTXZYUWLJINOB-CTYIDZIISA-N -1 1 345.826 4.120 20 0 EIADMM CSc1ccncc1[N-]C(=O)c1nc(-c2ccccc2)cs1 ZINC000669906781 1042027294 /nfs/dbraw/zinc/02/72/94/1042027294.db2.gz BNWGRGXOKOJUIL-UHFFFAOYSA-N -1 1 327.434 4.179 20 0 EIADMM CCOc1cc(C(=O)N2CCCCC(C)(C)C2)cc(Cl)c1[O-] ZINC000438509951 1042221072 /nfs/dbraw/zinc/22/10/72/1042221072.db2.gz ZMPYNQNOTHXFBY-UHFFFAOYSA-N -1 1 325.836 4.097 20 0 EIADMM Cc1ccc(-c2csc3[n-]c(-c4cncs4)nc(=O)c23)cc1 ZINC000426091209 1042292334 /nfs/dbraw/zinc/29/23/34/1042292334.db2.gz WEOZLRZKRGRJAJ-UHFFFAOYSA-N -1 1 325.418 4.496 20 0 EIADMM COc1ccc(-c2csc3[n-]c(-c4cncs4)nc(=O)c23)cc1 ZINC000426122327 1042319843 /nfs/dbraw/zinc/31/98/43/1042319843.db2.gz HVKMWAZUEXHXNO-UHFFFAOYSA-N -1 1 341.417 4.196 20 0 EIADMM Cc1c(F)cccc1S(=O)(=O)[N-]c1ccccc1CC(F)(F)F ZINC000438755065 1042334494 /nfs/dbraw/zinc/33/44/94/1042334494.db2.gz LXHRGBNIFKFWBC-UHFFFAOYSA-N -1 1 347.333 4.040 20 0 EIADMM COc1cc(-c2nc([C@@H]3CCC(F)(F)C3)no2)cc(Cl)c1[O-] ZINC000439577069 1042697397 /nfs/dbraw/zinc/69/73/97/1042697397.db2.gz UMAHSSMWUMXYQD-SSDOTTSWSA-N -1 1 330.718 4.007 20 0 EIADMM COc1cc(C(=O)N2CC[C@@H](C(C)(C)C)C[C@@H]2C)cc(Cl)c1[O-] ZINC000493179468 1042837443 /nfs/dbraw/zinc/83/74/43/1042837443.db2.gz HQFKTWKADIEOHH-WCQYABFASA-N -1 1 339.863 4.341 20 0 EIADMM C[C@@H](c1ccc(Cl)cc1Cl)N1CCC2(C[C@@H]2C(=O)[O-])CC1 ZINC000405350632 1042949571 /nfs/dbraw/zinc/94/95/71/1042949571.db2.gz CJCHPAMUIDAGJL-GXFFZTMASA-N -1 1 328.239 4.241 20 0 EIADMM C[C@@H](c1ccc(Cl)cc1Cl)N1CCC2(C[C@H]2C(=O)[O-])CC1 ZINC000405350629 1042949771 /nfs/dbraw/zinc/94/97/71/1042949771.db2.gz CJCHPAMUIDAGJL-GWCFXTLKSA-N -1 1 328.239 4.241 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@@H]1C[C@@]12CCCc1ccccc12 ZINC000509153328 1043082463 /nfs/dbraw/zinc/08/24/63/1043082463.db2.gz GILRYDZOUHIQGL-HNAYVOBHSA-N -1 1 327.811 4.278 20 0 EIADMM CCCc1ccccc1[N-]S(=O)(=O)c1cccc(C(=O)CC)c1 ZINC000320833245 1043109102 /nfs/dbraw/zinc/10/91/02/1043109102.db2.gz QZALELVAWAVOGM-UHFFFAOYSA-N -1 1 331.437 4.033 20 0 EIADMM C[C@H](CCC(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)c1ccccc1 ZINC000441809260 1043116544 /nfs/dbraw/zinc/11/65/44/1043116544.db2.gz QGGAZLNUNCGTSW-CQSZACIVSA-N -1 1 335.407 4.305 20 0 EIADMM O=S(=O)([N-]c1ccccc1Cl)c1c(Cl)cccc1Cl ZINC000003100567 1043177459 /nfs/dbraw/zinc/17/74/59/1043177459.db2.gz MBORRJUKFTVUKG-UHFFFAOYSA-N -1 1 336.627 4.448 20 0 EIADMM COc1ccc([C@@H](C)N(C)C(=O)c2cc3ccccc3cc2[O-])cc1 ZINC000219205491 1043201575 /nfs/dbraw/zinc/20/15/75/1043201575.db2.gz UPLDUTJPSBZWEZ-CQSZACIVSA-N -1 1 335.403 4.387 20 0 EIADMM O=C(c1c([O-])cccc1Cl)N1CCC[C@H](c2ccccc2)CC1 ZINC000727489518 1043231778 /nfs/dbraw/zinc/23/17/78/1043231778.db2.gz YKOZOLBZZDACDW-HNNXBMFYSA-N -1 1 329.827 4.456 20 0 EIADMM Cc1ccc2ncccc2c1S(=O)(=O)[N-]c1ccccc1C(C)C ZINC000673983447 1043234128 /nfs/dbraw/zinc/23/41/28/1043234128.db2.gz VOAJFIGORBKWCE-UHFFFAOYSA-N -1 1 340.448 4.467 20 0 EIADMM C[C@@H](CC(=O)Nc1ccc([O-])c(Cl)c1)c1ccc(F)cc1F ZINC000509183331 1043234769 /nfs/dbraw/zinc/23/47/69/1043234769.db2.gz JXSQWSRGPVTIIK-VIFPVBQESA-N -1 1 325.742 4.456 20 0 EIADMM CSCc1cccc([N-]S(=O)(=O)c2cc(C)sc2C)c1 ZINC000521002730 1043483244 /nfs/dbraw/zinc/48/32/44/1043483244.db2.gz UOYQUNOFQJGHPU-UHFFFAOYSA-N -1 1 327.496 4.029 20 0 EIADMM CCc1ccc(S(=O)(=O)[N-]c2ccc(F)cc2C(F)(F)F)cc1 ZINC000442105313 1043501785 /nfs/dbraw/zinc/50/17/85/1043501785.db2.gz GVCOOOIWWFZDBB-UHFFFAOYSA-N -1 1 347.333 4.208 20 0 EIADMM CCc1nc2cc(NC(=O)Nc3ccc([O-])c(Cl)c3)ccc2o1 ZINC000190963398 1043755329 /nfs/dbraw/zinc/75/53/29/1043755329.db2.gz SBFBITPWMSGWFM-UHFFFAOYSA-N -1 1 331.759 4.393 20 0 EIADMM CC(C)(CC(=O)Nc1ccc(F)cc1[O-])CC(=O)c1ccccc1 ZINC000442575134 1043756707 /nfs/dbraw/zinc/75/67/07/1043756707.db2.gz ZVAIJSDSYJTPHS-UHFFFAOYSA-N -1 1 329.371 4.159 20 0 EIADMM Cc1ccc(-c2ocnc2C(=O)[N-]c2nnc(C(C)(C)C)s2)cc1 ZINC000172862056 1043796498 /nfs/dbraw/zinc/79/64/98/1043796498.db2.gz SBBHBPALNPBGFT-UHFFFAOYSA-N -1 1 342.424 4.051 20 0 EIADMM C[C@@H]1CO[C@H](c2ccccc2)[C@@H](C)N1C(=O)c1cc(Cl)ccc1[O-] ZINC000732017016 1043869650 /nfs/dbraw/zinc/86/96/50/1043869650.db2.gz LDHHRTGYWBFVII-VFVRVIDISA-N -1 1 345.826 4.036 20 0 EIADMM O=C(c1c([O-])cccc1Cl)N1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000732301572 1043895604 /nfs/dbraw/zinc/89/56/04/1043895604.db2.gz XQPNKJBDLBSCPT-GFCCVEGCSA-N -1 1 336.218 4.329 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)N[C@H](C1CCCC1)C(F)(F)F ZINC000192266605 1043897102 /nfs/dbraw/zinc/89/71/02/1043897102.db2.gz FBGRZRPWZVICGM-GFCCVEGCSA-N -1 1 336.741 4.288 20 0 EIADMM CCOc1cc(-c2nc(Cc3cccs3)no2)cc(Cl)c1[O-] ZINC000443090608 1044003769 /nfs/dbraw/zinc/00/37/69/1044003769.db2.gz GRPHWWGHQJPQQF-UHFFFAOYSA-N -1 1 336.800 4.147 20 0 EIADMM CCOc1cc(-c2nc(-c3ccccc3C)no2)cc(Cl)c1[O-] ZINC000443093814 1044024216 /nfs/dbraw/zinc/02/42/16/1044024216.db2.gz MKNWIJHOWVNDJL-UHFFFAOYSA-N -1 1 330.771 4.470 20 0 EIADMM CCOc1cc(-c2nc(-c3ncccc3CC)no2)cc(Cl)c1[O-] ZINC000443209580 1044099536 /nfs/dbraw/zinc/09/95/36/1044099536.db2.gz FZHLNNPZCFFXFZ-UHFFFAOYSA-N -1 1 345.786 4.119 20 0 EIADMM CCN(C(=O)c1cc(Cl)c([O-])c(OC)c1)c1cccc(C)c1C ZINC000443330320 1044182521 /nfs/dbraw/zinc/18/25/21/1044182521.db2.gz BYYXQKPVPNMLLE-UHFFFAOYSA-N -1 1 333.815 4.338 20 0 EIADMM O=C(Nc1ccc(Br)c([O-])c1)c1sccc1Cl ZINC001117935714 1044190339 /nfs/dbraw/zinc/19/03/39/1044190339.db2.gz AABOOZNKACNBRJ-UHFFFAOYSA-N -1 1 332.606 4.122 20 0 EIADMM CCOc1cc(C(=O)Nc2cccc(SC)c2)cc(Cl)c1[O-] ZINC000194038056 1044244034 /nfs/dbraw/zinc/24/40/34/1044244034.db2.gz GKWURXVEKOKPHN-UHFFFAOYSA-N -1 1 337.828 4.419 20 0 EIADMM COc1ccc2c(c1)CCCN2C(=O)c1ccc2ccccc2c1[O-] ZINC000843782694 1044315404 /nfs/dbraw/zinc/31/54/04/1044315404.db2.gz QYTRXBCTUACIDF-UHFFFAOYSA-N -1 1 333.387 4.147 20 0 EIADMM COCC[C@@H](Sc1nc(C)c(C2CC2)c(=O)[n-]1)c1ccccc1 ZINC000631024263 1044482152 /nfs/dbraw/zinc/48/21/52/1044482152.db2.gz QQWFCBKGHAVFMS-OAHLLOKOSA-N -1 1 330.453 4.238 20 0 EIADMM O=C(Nc1ccc(C(F)(F)F)cc1)Nc1cc(F)c([O-])c(F)c1 ZINC000168810445 1044607563 /nfs/dbraw/zinc/60/75/63/1044607563.db2.gz SREXQYZUQOLKGO-UHFFFAOYSA-N -1 1 332.228 4.333 20 0 EIADMM Cc1cnc(C(=O)N([C@H](C)c2ccc(Cl)cc2)C2CC2)c([O-])c1 ZINC000495111426 1044687748 /nfs/dbraw/zinc/68/77/48/1044687748.db2.gz LXEVIGUMLFMLFZ-GFCCVEGCSA-N -1 1 330.815 4.115 20 0 EIADMM C[C@@H]1CCCC[C@H]1OCc1nc(=O)c2c3ccccc3sc2[n-]1 ZINC000070694454 1044701628 /nfs/dbraw/zinc/70/16/28/1044701628.db2.gz BBRHKMDRCNTJNF-DGCLKSJQSA-N -1 1 328.437 4.233 20 0 EIADMM CC(C)(C)OC(=O)Nc1cccc(C(=O)Nc2c([O-])cccc2F)c1 ZINC000735924546 1044879767 /nfs/dbraw/zinc/87/97/67/1044879767.db2.gz CCWGVKVFBSYUAA-UHFFFAOYSA-N -1 1 346.358 4.131 20 0 EIADMM O=C(Nc1ccc(Cl)cc1[O-])c1ncoc1-c1ccc(F)cc1 ZINC000474362712 1044886468 /nfs/dbraw/zinc/88/64/68/1044886468.db2.gz KIPWQJLCZYMPQM-UHFFFAOYSA-N -1 1 332.718 4.092 20 0 EIADMM CSc1cccc(S(=O)(=O)[N-]c2cccc(C(C)(F)F)c2)c1 ZINC000509390127 1045087064 /nfs/dbraw/zinc/08/70/64/1045087064.db2.gz HMBZHGIPPDUSTC-UHFFFAOYSA-N -1 1 343.420 4.321 20 0 EIADMM CSc1cccc(S(=O)(=O)[N-]c2cccc3ccccc32)c1 ZINC000509104559 1045132319 /nfs/dbraw/zinc/13/23/19/1045132319.db2.gz XAYIQWDAWRBGMM-UHFFFAOYSA-N -1 1 329.446 4.363 20 0 EIADMM CSc1ccc(S(=O)(=O)[N-]c2cc(SC)ccc2C)cc1 ZINC000611412854 1045303671 /nfs/dbraw/zinc/30/36/71/1045303671.db2.gz OVHNUMVVZFDJSE-UHFFFAOYSA-N -1 1 339.507 4.240 20 0 EIADMM O=C(c1c([O-])cccc1Cl)N(Cc1c(F)cccc1F)C1CC1 ZINC000791029924 1045677801 /nfs/dbraw/zinc/67/78/01/1045677801.db2.gz PBHIVSQAKLAZOP-UHFFFAOYSA-N -1 1 337.753 4.129 20 0 EIADMM O=C(Nc1ccc(Oc2ccc(F)cc2)cn1)c1ccc([O-])c(F)c1 ZINC000767955156 1045691305 /nfs/dbraw/zinc/69/13/05/1045691305.db2.gz DBLKFBQDHZHGCB-UHFFFAOYSA-N -1 1 342.301 4.110 20 0 EIADMM C[C@@H](SCCC[N-]C(=O)C(F)(F)F)c1ccccc1Cl ZINC000769341319 1045930483 /nfs/dbraw/zinc/93/04/83/1045930483.db2.gz XOIUXTZGDRYTGZ-SECBINFHSA-N -1 1 325.783 4.203 20 0 EIADMM C[C@H](SCCC[N-]C(=O)C(F)(F)F)c1ccccc1Cl ZINC000769341328 1045930781 /nfs/dbraw/zinc/93/07/81/1045930781.db2.gz XOIUXTZGDRYTGZ-VIFPVBQESA-N -1 1 325.783 4.203 20 0 EIADMM COc1ccc([C@H]2CCCN2C(=O)c2c([O-])cccc2Cl)cc1 ZINC000769633885 1046028902 /nfs/dbraw/zinc/02/89/02/1046028902.db2.gz LJSVQVYSQRUJEB-OAHLLOKOSA-N -1 1 331.799 4.032 20 0 EIADMM Cc1cc(Br)cc2c1NC(=O)/C2=C\c1ccc([O-])c(F)c1 ZINC000769618037 1046035293 /nfs/dbraw/zinc/03/52/93/1046035293.db2.gz VOUVEQKUKAYNET-XGICHPGQSA-N -1 1 348.171 4.095 20 0 EIADMM CC(C)(C)OC(=O)c1cccc(C(=O)Nc2ccc([O-])c(Cl)c2)c1 ZINC000769743472 1046065306 /nfs/dbraw/zinc/06/53/06/1046065306.db2.gz ZMZCDGUESTWTEC-UHFFFAOYSA-N -1 1 347.798 4.253 20 0 EIADMM O=C(c1c([O-])cccc1Cl)N1CCCCC[C@@H]1[C@H]1CCCCC1=O ZINC000769973770 1046118732 /nfs/dbraw/zinc/11/87/32/1046118732.db2.gz HZGLFMILZWUCIK-UKRRQHHQSA-N -1 1 349.858 4.190 20 0 EIADMM CCN(C(=O)c1ncccc1[O-])[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000124097831 1046216926 /nfs/dbraw/zinc/21/69/26/1046216926.db2.gz KECRNXUHODMNLF-NSHDSACASA-N -1 1 338.329 4.029 20 0 EIADMM C[C@@H]1CC[C@@H](C(=O)[O-])CN1Cc1cc(Cl)cc(C(F)(F)F)c1 ZINC000263360485 1046279079 /nfs/dbraw/zinc/27/90/79/1046279079.db2.gz RVGJKMMRDXXMLQ-MWLCHTKSSA-N -1 1 335.753 4.044 20 0 EIADMM Cc1ccc(-c2nnc([N-]C(=O)c3c(F)cccc3F)s2)c(C)c1 ZINC000065083011 1046378912 /nfs/dbraw/zinc/37/89/12/1046378912.db2.gz PXBOMJPIALUZJS-UHFFFAOYSA-N -1 1 345.374 4.352 20 0 EIADMM CC(C)(C)OC(=O)Nc1ccc(-c2nc(-c3ccco3)no2)c([O-])c1 ZINC000497227703 1046454691 /nfs/dbraw/zinc/45/46/91/1046454691.db2.gz OWCQNEFDSPKUKM-UHFFFAOYSA-N -1 1 343.339 4.049 20 0 EIADMM CC[C@](C)(NC(=O)c1cc(Cl)c([O-])c(OC)c1)c1ccccc1 ZINC000785583434 1046711990 /nfs/dbraw/zinc/71/19/90/1046711990.db2.gz LMIUGHLGXLJWNK-SFHVURJKSA-N -1 1 333.815 4.109 20 0 EIADMM Cc1nocc1[N-]C(=O)c1csc(-c2ccc(OC(C)C)cc2)n1 ZINC001130575159 1047219558 /nfs/dbraw/zinc/21/95/58/1047219558.db2.gz KQICRUZBCLTOAI-UHFFFAOYSA-N -1 1 343.408 4.146 20 0 EIADMM Cc1nc(C(C)(C)C)[n-]c(=O)c1C(=O)NCCCCCCC(C)C ZINC000747355156 1047362512 /nfs/dbraw/zinc/36/25/12/1047362512.db2.gz LREMSDVLEIEAOF-UHFFFAOYSA-N -1 1 335.492 4.124 20 0 EIADMM CN(C)c1ccc(Cl)cc1NC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000476238110 1047434769 /nfs/dbraw/zinc/43/47/69/1047434769.db2.gz MXRZNQNRPZQJLI-UHFFFAOYSA-N -1 1 340.210 4.409 20 0 EIADMM Cc1nc(SCc2nsc3ccccc23)[n-]c(=O)c1C1CC1 ZINC000918462945 1047451828 /nfs/dbraw/zinc/45/18/28/1047451828.db2.gz KWJVHFLFWBLTPZ-UHFFFAOYSA-N -1 1 329.450 4.270 20 0 EIADMM CC1([N-]C(=O)C(F)(F)c2cc(F)cc(F)c2)CCC(F)(F)CC1 ZINC001131047475 1047501171 /nfs/dbraw/zinc/50/11/71/1047501171.db2.gz FANFREWPANRSIG-UHFFFAOYSA-N -1 1 339.279 4.141 20 0 EIADMM C[C@@H](c1cccs1)N(C)C(=O)c1ccc(Br)cc1[O-] ZINC000044491164 1047647169 /nfs/dbraw/zinc/64/71/69/1047647169.db2.gz ALXBKNVJPFZSQU-VIFPVBQESA-N -1 1 340.242 4.049 20 0 EIADMM O=S(=O)([N-]c1cc(Cl)ccc1F)c1cc(Cl)ccc1F ZINC000556346370 1047690558 /nfs/dbraw/zinc/69/05/58/1047690558.db2.gz HGWQAHFWWOEBFR-UHFFFAOYSA-N -1 1 338.162 4.072 20 0 EIADMM CC(C)[C@H]1CCCN(C(=O)c2ccc(Br)cc2[O-])CC1 ZINC000071029354 1047707567 /nfs/dbraw/zinc/70/75/67/1047707567.db2.gz MTGCACAQROBKSP-LBPRGKRZSA-N -1 1 340.261 4.053 20 0 EIADMM CC(C)c1cccc(C(C)C)c1NC(=O)CO[N-]C(=O)CC(C)(C)C ZINC000842061483 1047734693 /nfs/dbraw/zinc/73/46/93/1047734693.db2.gz YDHLTFQRPGFGRI-UHFFFAOYSA-N -1 1 348.487 4.356 20 0 EIADMM Cc1ccc(-c2cc(C(=O)OCc3csc(C(C)(C)C)n3)[nH]n2)o1 ZINC000919329816 1047813910 /nfs/dbraw/zinc/81/39/10/1047813910.db2.gz VPEYSKXJJNCBPC-UHFFFAOYSA-N -1 1 345.424 4.089 20 0 EIADMM C[C@@H]1CN(C(=O)c2ccc3ccccc3c2[O-])C[C@@H](c2ccccc2)O1 ZINC000130976829 1047818032 /nfs/dbraw/zinc/81/80/32/1047818032.db2.gz VEDQKFOEGWSSPX-QRWLVFNGSA-N -1 1 347.414 4.148 20 0 EIADMM Cc1c(NC(=O)c2ccccc2[O-])cccc1C(=O)Nc1ccccc1 ZINC000131218231 1047840701 /nfs/dbraw/zinc/84/07/01/1047840701.db2.gz QHLRDXAADWQCRN-UHFFFAOYSA-N -1 1 346.386 4.205 20 0 EIADMM CC[C@@H](NC(=O)c1ncc2ccccc2c1[O-])C(C)(C)c1ccccc1 ZINC001136921687 1047899749 /nfs/dbraw/zinc/89/97/49/1047899749.db2.gz KTCUEEHJIHXXOF-GOSISDBHSA-N -1 1 348.446 4.427 20 0 EIADMM CCc1occc1C(=O)Nc1c([O-])cc(Br)cc1Cl ZINC000556847434 1048061786 /nfs/dbraw/zinc/06/17/86/1048061786.db2.gz JLZKOEPTSXAFSG-UHFFFAOYSA-N -1 1 344.592 4.216 20 0 EIADMM C[C@@H]1C[C@@H](c2cccc(F)c2)N(C(=O)c2c([O-])cccc2Cl)C1 ZINC001137014972 1048065141 /nfs/dbraw/zinc/06/51/41/1048065141.db2.gz RURIHXOZQNBVFM-ABAIWWIYSA-N -1 1 333.790 4.408 20 0 EIADMM CSc1ccc(C(=O)[N-]c2nc(-c3sccc3C)ns2)o1 ZINC000131835606 1048156524 /nfs/dbraw/zinc/15/65/24/1048156524.db2.gz PJTQQPOFXWHVKO-UHFFFAOYSA-N -1 1 337.451 4.142 20 0 EIADMM CC(C)(C)c1ccc(S(=O)(=O)[N-]c2ccc3scnc3c2)cc1 ZINC000499226473 1048456201 /nfs/dbraw/zinc/45/62/01/1048456201.db2.gz CTFVIBIJNZRQFD-UHFFFAOYSA-N -1 1 346.477 4.395 20 0 EIADMM C[C@H]([N-]C(=O)C(F)(F)c1cccc(Cl)c1Cl)c1ccccn1 ZINC001135342152 1048672852 /nfs/dbraw/zinc/67/28/52/1048672852.db2.gz XEGTUDVVDLZWMT-VIFPVBQESA-N -1 1 345.176 4.358 20 0 EIADMM O=C(c1c([O-])cccc1Cl)N1CCC(Cc2ccccc2)CC1 ZINC000920429679 1048678756 /nfs/dbraw/zinc/67/87/56/1048678756.db2.gz WUZGZDRNSQJGNK-UHFFFAOYSA-N -1 1 329.827 4.141 20 0 EIADMM O=C(c1c([O-])cccc1Cl)N1CC=C(c2ccc(F)cc2)CC1 ZINC000920432131 1048678894 /nfs/dbraw/zinc/67/88/94/1048678894.db2.gz KYPDKEAFMGAJBC-UHFFFAOYSA-N -1 1 331.774 4.114 20 0 EIADMM COc1cccc([C@H]2CCC[N@@H+](Cc3cc(F)c([O-])cc3F)C2)c1 ZINC001144663556 1048782810 /nfs/dbraw/zinc/78/28/10/1048782810.db2.gz GKJBQHLXEMIVDN-AWEZNQCLSA-N -1 1 333.378 4.059 20 0 EIADMM CN(Cc1sccc1C(=O)[O-])Cc1ccc(Cl)c(Cl)c1 ZINC001144670785 1048789243 /nfs/dbraw/zinc/78/92/43/1048789243.db2.gz PHTHJZUGBXLIDO-UHFFFAOYSA-N -1 1 330.236 4.385 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N1CCCC[C@H]1Cc1ccc(F)cc1 ZINC001144672112 1048789769 /nfs/dbraw/zinc/78/97/69/1048789769.db2.gz CGDBEFZLWYUSRK-INIZCTEOSA-N -1 1 347.817 4.422 20 0 EIADMM CC(=O)Nc1cccc(OC(=O)c2cc3cc(Cl)sc3[n-]2)c1 ZINC000810533149 1048809024 /nfs/dbraw/zinc/80/90/24/1048809024.db2.gz VRAVCGLMMTWOLS-UHFFFAOYSA-N -1 1 334.784 4.060 20 0 EIADMM O=C(Nc1cccc(C2SCCS2)c1)c1cccc([O-])c1F ZINC001135618728 1048820683 /nfs/dbraw/zinc/82/06/83/1048820683.db2.gz KPQFMCTVJFDAEB-UHFFFAOYSA-N -1 1 335.425 4.262 20 0 EIADMM CSc1ccc([O-])c(C(=O)Nc2nc(-c3ccccc3)cs2)c1 ZINC001135607874 1048822103 /nfs/dbraw/zinc/82/21/03/1048822103.db2.gz VNNXVPXCGHWZEG-UHFFFAOYSA-N -1 1 342.445 4.490 20 0 EIADMM CCOc1cc(C(=O)N[C@H]2CCC[C@@H](C(C)C)C2)cc(Cl)c1[O-] ZINC001144746162 1048844375 /nfs/dbraw/zinc/84/43/75/1048844375.db2.gz VCOOHACVLJZGBW-OCCSQVGLSA-N -1 1 339.863 4.389 20 0 EIADMM C[C@H]1CCc2ccccc2N1C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC001135679588 1048854417 /nfs/dbraw/zinc/85/44/17/1048854417.db2.gz WDMUSCODHPTVIM-NSHDSACASA-N -1 1 335.325 4.393 20 0 EIADMM O=C(Nc1c(-c2ccccc2)nc2ccccn21)c1ccc([O-])c(F)c1 ZINC001135685130 1048857857 /nfs/dbraw/zinc/85/78/57/1048857857.db2.gz FCCWRDWKHHYFQP-UHFFFAOYSA-N -1 1 347.349 4.098 20 0 EIADMM Cc1ccc(Oc2ccc(NC(=O)c3ccc([O-])cc3F)cc2)nc1 ZINC001145112114 1048995129 /nfs/dbraw/zinc/99/51/29/1048995129.db2.gz WYAUYHCQGCMFFB-UHFFFAOYSA-N -1 1 338.338 4.279 20 0 EIADMM O=C(Nc1nc(/C=C/c2ccccc2)cs1)c1cc(F)ccc1[O-] ZINC001146400914 1049021120 /nfs/dbraw/zinc/02/11/20/1049021120.db2.gz ZCYIGBJAYOMPJT-SOFGYWHQSA-N -1 1 340.379 4.411 20 0 EIADMM C[C@H](Oc1ccccc1NC(=O)c1ccc([O-])cn1)c1ccccc1 ZINC001146852646 1049065709 /nfs/dbraw/zinc/06/57/09/1049065709.db2.gz ATOFZUMHZNZKDD-AWEZNQCLSA-N -1 1 334.375 4.180 20 0 EIADMM O=C(Nc1cccc(C(F)(F)F)c1)Nc1cc(F)c([O-])c(F)c1 ZINC000168883648 1049119203 /nfs/dbraw/zinc/11/92/03/1049119203.db2.gz IQUZMSSTPPZMMP-UHFFFAOYSA-N -1 1 332.228 4.333 20 0 EIADMM O=C(N[C@H]1CCC[C@H]1Cc1ccccc1)c1cc(Cl)ccc1[O-] ZINC001147496505 1049166158 /nfs/dbraw/zinc/16/61/58/1049166158.db2.gz ZFXONCNBJULPNB-YOEHRIQHSA-N -1 1 329.827 4.187 20 0 EIADMM O=C(N[C@H](c1ccccc1)C1CC1)c1ccc(Br)cc1[O-] ZINC001136149379 1049175413 /nfs/dbraw/zinc/17/54/13/1049175413.db2.gz IMHGZETWJUHSTK-MRXNPFEDSA-N -1 1 346.224 4.036 20 0 EIADMM CC[C@@]1(C)CCCN(C(=O)c2cc(-c3ccc(C=O)o3)ccc2[O-])C1 ZINC001147873310 1049231832 /nfs/dbraw/zinc/23/18/32/1049231832.db2.gz FPAIHTPHHPMZJN-FQEVSTJZSA-N -1 1 341.407 4.117 20 0 EIADMM CC(=CC(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)c1ccccc1C ZINC001136191098 1049269516 /nfs/dbraw/zinc/26/95/16/1049269516.db2.gz ZRPJPRMJXAKPQG-SDNWHVSQSA-N -1 1 333.391 4.133 20 0 EIADMM CC[C@H](Cc1ccccc1)N(C)C(=O)c1ccc2ccc(O)cc2c1[O-] ZINC001148232062 1049281903 /nfs/dbraw/zinc/28/19/03/1049281903.db2.gz DHZUCSIQQOFZRX-QGZVFWFLSA-N -1 1 349.430 4.344 20 0 EIADMM O=C([N-]c1nocc1C1CC1)c1cc(-c2cccc(Cl)c2)no1 ZINC001133060334 1049308810 /nfs/dbraw/zinc/30/88/10/1049308810.db2.gz DPKLREYESQOPNU-UHFFFAOYSA-N -1 1 329.743 4.113 20 0 EIADMM O=C([N-]c1ccc(F)c(F)c1F)c1snc(Cl)c1Cl ZINC001136345025 1049509191 /nfs/dbraw/zinc/50/91/91/1049509191.db2.gz GARONDACRLZIPK-UHFFFAOYSA-N -1 1 327.114 4.120 20 0 EIADMM O=C(NCC1(c2ccc(F)cc2)CCCCC1)c1c([O-])cccc1F ZINC001136400602 1049586477 /nfs/dbraw/zinc/58/64/77/1049586477.db2.gz UDKZJTCDNUHWQN-UHFFFAOYSA-N -1 1 345.389 4.302 20 0 EIADMM O=C([N-]Cc1cscc1Cl)C(F)(F)c1c(F)cccc1F ZINC001133602283 1049673574 /nfs/dbraw/zinc/67/35/74/1049673574.db2.gz ATKFQKCPSGMDEU-UHFFFAOYSA-N -1 1 337.725 4.088 20 0 EIADMM CC(C)[C@H]1CC[C@@H](C)C[C@H]1CNC(=O)Cc1ccc([O-])c(Cl)c1 ZINC001136488293 1049675138 /nfs/dbraw/zinc/67/51/38/1049675138.db2.gz KEKCURNHOTXDGB-VNQPRFMTSA-N -1 1 337.891 4.413 20 0 EIADMM Cc1nc(NC(=O)c2cccc([O-])c2F)sc1Cc1ccccc1 ZINC001136484026 1049676888 /nfs/dbraw/zinc/67/68/88/1049676888.db2.gz LDLPEJAVFCVCPZ-UHFFFAOYSA-N -1 1 342.395 4.139 20 0 EIADMM O=C(N[C@H]1CCSc2ccc(Cl)cc21)c1cc(F)ccc1[O-] ZINC001136483795 1049677398 /nfs/dbraw/zinc/67/73/98/1049677398.db2.gz BYWKMTWSNHNQQT-ZDUSSCGKSA-N -1 1 337.803 4.152 20 0 EIADMM CC(=O)c1ccc(-c2ccc(C(=O)Nc3cccc(F)c3[O-])o2)cc1 ZINC001171632614 1049763884 /nfs/dbraw/zinc/76/38/84/1049763884.db2.gz IKSYWVAOOAKHET-UHFFFAOYSA-N -1 1 339.322 4.246 20 0 EIADMM CCc1ccc(-c2cc(C(=O)Nc3cccc(F)c3[O-])no2)cc1 ZINC001171636659 1049779786 /nfs/dbraw/zinc/77/97/86/1049779786.db2.gz INHPHHPWLJCWBQ-UHFFFAOYSA-N -1 1 326.327 4.001 20 0 EIADMM CC[C@H](C)CON=c1ccc(Br)c(C(F)(F)F)[n-]1 ZINC000813623588 1049801527 /nfs/dbraw/zinc/80/15/27/1049801527.db2.gz ZAIPWLLDLFLBCA-ZETCQYMHSA-N -1 1 327.144 4.253 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2cccc(-c3nccs3)c2)cc1F ZINC000615959447 1049820914 /nfs/dbraw/zinc/82/09/14/1049820914.db2.gz SYCHKMFYDUWYRP-UHFFFAOYSA-N -1 1 348.424 4.058 20 0 EIADMM O=C(c1ccc2ccc(O)cc2c1[O-])N1CCCC2(CCCCC2)C1 ZINC001136674038 1049824607 /nfs/dbraw/zinc/82/46/07/1049824607.db2.gz RZCMLUFGTAUTOZ-UHFFFAOYSA-N -1 1 339.435 4.438 20 0 EIADMM Cc1nc(-c2cccc(NC(=O)c3cc(F)ccc3[O-])c2)oc1C ZINC000081944446 1049835268 /nfs/dbraw/zinc/83/52/68/1049835268.db2.gz RJTHTVHJZINDBQ-UHFFFAOYSA-N -1 1 326.327 4.055 20 0 EIADMM C[C@@H](Oc1cccc(Cl)c1)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000082194497 1049872120 /nfs/dbraw/zinc/87/21/20/1049872120.db2.gz CONIDFKESARQCW-SECBINFHSA-N -1 1 326.179 4.105 20 0 EIADMM CC(C)(CNC(=O)c1ccc(F)c([O-])c1)c1ccc(F)cc1Cl ZINC001136789027 1049882344 /nfs/dbraw/zinc/88/23/44/1049882344.db2.gz HBPRZXQHURKFFR-UHFFFAOYSA-N -1 1 339.769 4.031 20 0 EIADMM CC(C)CCc1nnc([N-]C(=O)c2cnc(-c3ccco3)s2)s1 ZINC000617096268 1049949843 /nfs/dbraw/zinc/94/98/43/1049949843.db2.gz NUCRXTOHXFOIQC-UHFFFAOYSA-N -1 1 348.453 4.096 20 0 EIADMM CCc1onc(C)c1[N-]C(=O)c1c(C)onc1-c1ccccc1Cl ZINC000089396211 1050117101 /nfs/dbraw/zinc/11/71/01/1050117101.db2.gz WYNYPHMTLZRFPU-UHFFFAOYSA-N -1 1 345.786 4.415 20 0 EIADMM CCc1onc(C)c1[N-]C(=O)c1ncoc1-c1ccccc1Cl ZINC000089399238 1050117179 /nfs/dbraw/zinc/11/71/79/1050117179.db2.gz ZBOLATAALFRTMV-UHFFFAOYSA-N -1 1 331.759 4.106 20 0 EIADMM CCOc1ccc(C#N)cc1NCc1cccc(Br)c1[O-] ZINC000181418126 1050120477 /nfs/dbraw/zinc/12/04/77/1050120477.db2.gz IACCYTBHHALYRL-UHFFFAOYSA-N -1 1 347.212 4.037 20 0 EIADMM Cc1c(F)cccc1S(=O)(=O)[N-]c1ccc(-c2ccco2)cc1 ZINC001185824911 1050172627 /nfs/dbraw/zinc/17/26/27/1050172627.db2.gz ZBCVYQITHNMUON-UHFFFAOYSA-N -1 1 331.368 4.195 20 0 EIADMM COc1cc(Nc2c(F)ccc([O-])c2Cl)cnc1Br ZINC001250228816 1050235617 /nfs/dbraw/zinc/23/56/17/1050235617.db2.gz LUMAAVGEGWUXHO-UHFFFAOYSA-N -1 1 347.571 4.094 20 0 EIADMM O=C(NCc1cccc(-c2cccs2)c1)c1ccc([O-])cc1F ZINC001186339318 1050303402 /nfs/dbraw/zinc/30/34/02/1050303402.db2.gz CMLOQXRZYPMADX-UHFFFAOYSA-N -1 1 327.380 4.190 20 0 EIADMM O=C(NCc1ccc(C(F)(F)F)cc1)Nc1cc(F)c(F)cc1[O-] ZINC001186816993 1050425255 /nfs/dbraw/zinc/42/52/55/1050425255.db2.gz XOAXZHZYNWVULQ-UHFFFAOYSA-N -1 1 346.255 4.011 20 0 EIADMM [O-]c1cnccc1-c1nc(-c2cccc(OCc3ccccc3)c2)no1 ZINC001212721539 1050436438 /nfs/dbraw/zinc/43/64/38/1050436438.db2.gz VXOGFGRMSXIHJI-UHFFFAOYSA-N -1 1 345.358 4.083 20 0 EIADMM Cc1ccc(-c2ccccc2)c(-c2noc(-c3ccncc3[O-])n2)c1 ZINC001212721611 1050436472 /nfs/dbraw/zinc/43/64/72/1050436472.db2.gz XOMCUAZHMQLCAD-UHFFFAOYSA-N -1 1 329.359 4.480 20 0 EIADMM C[C@H](NC(=O)c1ccc2ccc(O)cc2c1[O-])c1c(F)cccc1F ZINC001178389277 1050451302 /nfs/dbraw/zinc/45/13/02/1050451302.db2.gz ZLBQAJRFLOYAOF-JTQLQIEISA-N -1 1 343.329 4.020 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2cc3c(s2)CCCC3)c(Cl)c1 ZINC001187173491 1050501958 /nfs/dbraw/zinc/50/19/58/1050501958.db2.gz DUCYJGWDQKQPQT-UHFFFAOYSA-N -1 1 341.885 4.390 20 0 EIADMM O=C(Nc1cc(F)cc(F)c1)Nc1cccc([O-])c1Br ZINC001187580241 1050576913 /nfs/dbraw/zinc/57/69/13/1050576913.db2.gz QVQMQZNZQVHUDV-UHFFFAOYSA-N -1 1 343.127 4.077 20 0 EIADMM O=C(N[C@H]1CCC[C@H](c2ccccc2)CC1)c1cc(F)ccc1[O-] ZINC001179337233 1050677809 /nfs/dbraw/zinc/67/78/09/1050677809.db2.gz ZEJZNHYUGVBTCV-RDJZCZTQSA-N -1 1 327.399 4.378 20 0 EIADMM CCCc1cc(=O)[n-]c(S[C@H](C)Cc2ccc3ccccc3n2)n1 ZINC001188162742 1050711719 /nfs/dbraw/zinc/71/17/19/1050711719.db2.gz LJHFEXWKNKUTML-CYBMUJFWSA-N -1 1 339.464 4.406 20 0 EIADMM O=C(c1ccc(Nc2ccc(F)c(F)c2[O-])cc1)N1CCCCC1 ZINC001174074427 1050746641 /nfs/dbraw/zinc/74/66/41/1050746641.db2.gz LBAUTBBXSBFSRP-UHFFFAOYSA-N -1 1 332.350 4.040 20 0 EIADMM CCSCC[C@H](C)N(C)C(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC000619582450 1050825148 /nfs/dbraw/zinc/82/51/48/1050825148.db2.gz CFSJAYNCSIJOJA-JTQLQIEISA-N -1 1 335.391 4.015 20 0 EIADMM Cc1cc(Nc2cc([O-])c(F)c(F)c2F)cnc1Br ZINC001249957223 1050885570 /nfs/dbraw/zinc/88/55/70/1050885570.db2.gz CIHSLBOWOWQPSD-UHFFFAOYSA-N -1 1 333.107 4.019 20 0 EIADMM Cc1cc2ccccc2n1CC(=O)Nc1cccc(C(F)(F)F)c1[O-] ZINC001180433590 1050988743 /nfs/dbraw/zinc/98/87/43/1050988743.db2.gz YQGGFKWSMSGAMT-UHFFFAOYSA-N -1 1 348.324 4.313 20 0 EIADMM O=C(CSCc1ccc(Cl)cc1)Nc1cccc(F)c1[O-] ZINC001151771224 1051014344 /nfs/dbraw/zinc/01/43/44/1051014344.db2.gz FFYZYLSJFAEKEV-UHFFFAOYSA-N -1 1 325.792 4.057 20 0 EIADMM Cc1noc(-c2ccccc2)c1NC(=O)Nc1cc(Cl)ncc1[O-] ZINC001190342896 1051158168 /nfs/dbraw/zinc/15/81/68/1051158168.db2.gz YINPTXUQONOQSD-UHFFFAOYSA-N -1 1 344.758 4.048 20 0 EIADMM CCC(C)(C)c1ccc(S(=O)(=O)[N-]c2ccc([C@@H](C)O)cc2)cc1 ZINC001190445868 1051177114 /nfs/dbraw/zinc/17/71/14/1051177114.db2.gz YCKKRLAURGRSHK-CQSZACIVSA-N -1 1 347.480 4.228 20 0 EIADMM O=C(c1ccc(C(F)(F)F)c([O-])c1)N(CCC1CC1)CC1CC1 ZINC000620632000 1051181900 /nfs/dbraw/zinc/18/19/00/1051181900.db2.gz NLYCWCOZFBSRPZ-UHFFFAOYSA-N -1 1 327.346 4.063 20 0 EIADMM O=S(=O)([N-]c1ncc(Cl)cc1Cl)c1ccc(C2CC2)cc1 ZINC001190468899 1051194816 /nfs/dbraw/zinc/19/48/16/1051194816.db2.gz BFJDLOGDCBBWBC-UHFFFAOYSA-N -1 1 343.235 4.067 20 0 EIADMM C[C@@H]1Cc2cc(Cl)ccc2N1C(=O)Cc1ccc([O-])c(Cl)c1 ZINC001181548765 1051250651 /nfs/dbraw/zinc/25/06/51/1051250651.db2.gz NXZHYOZKCQZVIT-SNVBAGLBSA-N -1 1 336.218 4.219 20 0 EIADMM O=C(Nc1ccc(OC(F)(F)F)cc1)Nc1ccc(F)cc1[O-] ZINC001190736903 1051266310 /nfs/dbraw/zinc/26/63/10/1051266310.db2.gz DCMMVCKBHDTNAJ-UHFFFAOYSA-N -1 1 330.237 4.074 20 0 EIADMM O=c1oc2cc([O-])ccc2cc1Nc1ccc(F)cc1C(F)(F)F ZINC001175101018 1051347585 /nfs/dbraw/zinc/34/75/85/1051347585.db2.gz MSOLRZNJVPPFJW-UHFFFAOYSA-N -1 1 339.244 4.400 20 0 EIADMM O=C(Nc1ccc(OC2CCCC2)c(F)c1)c1ccc([O-])cc1F ZINC000154937069 1051351686 /nfs/dbraw/zinc/35/16/86/1051351686.db2.gz ZGUXXLGJGWORIN-UHFFFAOYSA-N -1 1 333.334 4.244 20 0 EIADMM COc1cccc(Nc2c(F)ccc([O-])c2F)c1C(=O)C(F)(F)F ZINC001175271113 1051509088 /nfs/dbraw/zinc/50/90/88/1051509088.db2.gz SHRQTRKUTOGWSY-UHFFFAOYSA-N -1 1 347.239 4.168 20 0 EIADMM [O-]c1c(Br)ccc(Cl)c1Nc1ccc(CO)cc1 ZINC001175570286 1051673216 /nfs/dbraw/zinc/67/32/16/1051673216.db2.gz STHPQWMTWPZLEV-UHFFFAOYSA-N -1 1 328.593 4.044 20 0 EIADMM CC(C)(C)c1ccc(C(=O)Nc2ccccc2-c2cc[nH]n2)c([O-])c1 ZINC001192335961 1051694991 /nfs/dbraw/zinc/69/49/91/1051694991.db2.gz QBUZBRBVAOIFES-UHFFFAOYSA-N -1 1 335.407 4.332 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1CC2(CCC2)[C@@H]1c1ccncc1 ZINC000621165475 1051708412 /nfs/dbraw/zinc/70/84/12/1051708412.db2.gz YLMYUOKYHDQICU-FQEVSTJZSA-N -1 1 344.414 4.308 20 0 EIADMM CSc1ccc([O-])c(C(=O)Nc2ccc3cn(C(C)C)nc3c2)c1 ZINC001182786704 1051710201 /nfs/dbraw/zinc/71/02/01/1051710201.db2.gz SCCORGIKHJBQML-UHFFFAOYSA-N -1 1 341.436 4.297 20 0 EIADMM CC(C)([N-]C(=O)C(F)(F)c1ccc(F)cc1)c1cc(Cl)ccn1 ZINC001182889981 1051733359 /nfs/dbraw/zinc/73/33/59/1051733359.db2.gz FVQJDJXSOVMMJE-UHFFFAOYSA-N -1 1 342.748 4.017 20 0 EIADMM CC(C)(NCc1ccc([O-])c(F)c1F)c1nc2ccccc2s1 ZINC001183094361 1051786256 /nfs/dbraw/zinc/78/62/56/1051786256.db2.gz JMQHJRBXUKXUSD-UHFFFAOYSA-N -1 1 334.391 4.305 20 0 EIADMM COCCOc1ccc(Nc2cc(Cl)cc(Cl)c2[O-])cc1 ZINC001175787376 1051786728 /nfs/dbraw/zinc/78/67/28/1051786728.db2.gz CFVUHPQHWAZNEN-UHFFFAOYSA-N -1 1 328.195 4.468 20 0 EIADMM O=C(Nc1ccc(OC(F)F)c(Cl)c1)c1cc([O-])cc(F)c1F ZINC001192664903 1051796898 /nfs/dbraw/zinc/79/68/98/1051796898.db2.gz HQTVFCCOKXFEKN-UHFFFAOYSA-N -1 1 349.667 4.178 20 0 EIADMM C[C@H](NC(=O)c1ccc(Br)c([O-])c1)[C@@H]1CCC[C@H](C)C1 ZINC001183706134 1051886693 /nfs/dbraw/zinc/88/66/93/1051886693.db2.gz FKJKXSQSIIEZIB-SDDRHHMPSA-N -1 1 340.261 4.099 20 0 EIADMM CN(C)C(=O)c1ccc(Nc2cc(Cl)cc(Cl)c2[O-])c(F)c1 ZINC001176204131 1051951808 /nfs/dbraw/zinc/95/18/08/1051951808.db2.gz FELAKLXEWLTSCC-UHFFFAOYSA-N -1 1 343.185 4.284 20 0 EIADMM [O-]c1c(F)c(F)ccc1Nc1cccc2c1cnn2[C@@H]1CCCCO1 ZINC001176323835 1051989539 /nfs/dbraw/zinc/98/95/39/1051989539.db2.gz REIZWIASPJMNHL-INIZCTEOSA-N -1 1 345.349 4.463 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc3ncoc3c2)c2ccccc12 ZINC001193823981 1052005336 /nfs/dbraw/zinc/00/53/36/1052005336.db2.gz AKQGBSDQJURKME-UHFFFAOYSA-N -1 1 338.388 4.090 20 0 EIADMM CCN(CC)C(=O)c1cc(F)cc(Nc2cc([O-])c(F)c(F)c2)c1 ZINC001176299259 1052006105 /nfs/dbraw/zinc/00/61/05/1052006105.db2.gz PCFSKZMISSTLIB-UHFFFAOYSA-N -1 1 338.329 4.035 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc3cccnc3c2)c2ccccc12 ZINC001193856848 1052015317 /nfs/dbraw/zinc/01/53/17/1052015317.db2.gz HBNMBBZOMPWXNA-UHFFFAOYSA-N -1 1 348.427 4.497 20 0 EIADMM C[C@H](OC(=O)c1ccc([O-])cc1F)c1ccc(OC(F)F)cc1 ZINC000773573460 1052032016 /nfs/dbraw/zinc/03/20/16/1052032016.db2.gz NXAIEEMZAIZRBN-VIFPVBQESA-N -1 1 326.270 4.051 20 0 EIADMM O=C([O-])C[C@@H](NCc1cc(C(F)(F)F)ccc1F)c1cccs1 ZINC000671161975 1052060234 /nfs/dbraw/zinc/06/02/34/1052060234.db2.gz BBNNZOFEUZYBLQ-GFCCVEGCSA-N -1 1 347.333 4.212 20 0 EIADMM Cc1cccc([N-]S(=O)(=O)c2cccc3c(Cl)nccc32)c1C ZINC001194455092 1052149143 /nfs/dbraw/zinc/14/91/43/1052149143.db2.gz KURPWBUXWFKUJM-UHFFFAOYSA-N -1 1 346.839 4.306 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2cccc3c(Cl)cccc32)cc1O ZINC001194431513 1052153531 /nfs/dbraw/zinc/15/35/31/1052153531.db2.gz KWMZIRLZCMAWEZ-UHFFFAOYSA-N -1 1 347.823 4.308 20 0 EIADMM COc1ccc(Nc2c(F)cc(F)c([O-])c2F)cc1Br ZINC001176672089 1052159257 /nfs/dbraw/zinc/15/92/57/1052159257.db2.gz SSOSGAXKZMJBII-UHFFFAOYSA-N -1 1 348.118 4.324 20 0 EIADMM COc1ccc(Nc2c(F)cc(F)c([O-])c2F)c(Br)c1 ZINC001176672474 1052160426 /nfs/dbraw/zinc/16/04/26/1052160426.db2.gz XFQYMHFLLHCIRX-UHFFFAOYSA-N -1 1 348.118 4.324 20 0 EIADMM O=C(Nc1ccc(F)c(F)c1)Nc1cccc([O-])c1Br ZINC001185099396 1052167037 /nfs/dbraw/zinc/16/70/37/1052167037.db2.gz GHUHJRRVIFECOI-UHFFFAOYSA-N -1 1 343.127 4.077 20 0 EIADMM Cc1cnc(Nc2c(F)cc(F)c([O-])c2F)c(Br)c1 ZINC001176662411 1052170818 /nfs/dbraw/zinc/17/08/18/1052170818.db2.gz OTAJXALZOGRJCK-UHFFFAOYSA-N -1 1 333.107 4.019 20 0 EIADMM O=C(Nc1ccc([O-])c(F)c1F)Oc1ccc(Br)cc1 ZINC001194598763 1052174807 /nfs/dbraw/zinc/17/48/07/1052174807.db2.gz DUPJOORZXNPMJD-UHFFFAOYSA-N -1 1 344.111 4.044 20 0 EIADMM Cc1ccc(C(F)(F)F)cc1[N-]S(=O)(=O)c1c(C)cccc1C ZINC001194603017 1052176656 /nfs/dbraw/zinc/17/66/56/1052176656.db2.gz NGVWXVXVHHDEOZ-UHFFFAOYSA-N -1 1 343.370 4.431 20 0 EIADMM Cc1cccc(C)c1S(=O)(=O)[N-]c1cccc(OC(F)(F)F)c1 ZINC001194634591 1052182394 /nfs/dbraw/zinc/18/23/94/1052182394.db2.gz VXEYYDWQVRIPLV-UHFFFAOYSA-N -1 1 345.342 4.003 20 0 EIADMM Cc1nc2cc(C)c([N-]S(=O)(=O)c3c(C)cccc3C)cc2s1 ZINC001194643266 1052185862 /nfs/dbraw/zinc/18/58/62/1052185862.db2.gz JWBMWSJXBRJOMA-UHFFFAOYSA-N -1 1 346.477 4.331 20 0 EIADMM Cc1cc([N-]S(=O)(=O)c2c(C)cccc2C)c2ccsc2n1 ZINC001194615924 1052188725 /nfs/dbraw/zinc/18/87/25/1052188725.db2.gz LZJXTSKULKFTEV-UHFFFAOYSA-N -1 1 332.450 4.022 20 0 EIADMM CC(C)c1cccc([N-]S(=O)(=O)c2ccc(-c3cnco3)cc2)c1 ZINC001185184809 1052188912 /nfs/dbraw/zinc/18/89/12/1052188912.db2.gz DSOXNDNQFBELPB-UHFFFAOYSA-N -1 1 342.420 4.266 20 0 EIADMM CCCc1ccc([N-]S(=O)(=O)c2ccc(-c3cnco3)cc2)cc1 ZINC001185185545 1052189645 /nfs/dbraw/zinc/18/96/45/1052189645.db2.gz NKIGLLWANNVMQR-UHFFFAOYSA-N -1 1 342.420 4.095 20 0 EIADMM CC(C)CCOc1ccc(C(=O)NCc2ccc([O-])c(Cl)c2)cc1 ZINC001176988059 1052214567 /nfs/dbraw/zinc/21/45/67/1052214567.db2.gz HVRPORHZCLWBPA-UHFFFAOYSA-N -1 1 347.842 4.401 20 0 EIADMM O=S(=O)([N-]c1ccc(OCC2CCCC2)cc1)c1ccsc1 ZINC001185383204 1052226527 /nfs/dbraw/zinc/22/65/27/1052226527.db2.gz ZINWJMSVWTZRCS-UHFFFAOYSA-N -1 1 337.466 4.118 20 0 EIADMM CCC(CC)Oc1cccc(F)c1[N-]S(=O)(=O)c1ccsc1 ZINC001185392076 1052227975 /nfs/dbraw/zinc/22/79/75/1052227975.db2.gz ITWLNYSKKJOWLL-UHFFFAOYSA-N -1 1 343.445 4.255 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2cc(F)c(F)cc2C)ccc1Cl ZINC001185524117 1052255218 /nfs/dbraw/zinc/25/52/18/1052255218.db2.gz AGFPLWYTJURCMX-UHFFFAOYSA-N -1 1 331.771 4.036 20 0 EIADMM CC(C)CN(C(=O)c1csc(=NC2CC2)[n-]1)c1ccc(Cl)cc1 ZINC000622440818 1052273309 /nfs/dbraw/zinc/27/33/09/1052273309.db2.gz MHLKIPZLXYTVDI-UHFFFAOYSA-N -1 1 349.887 4.096 20 0 EIADMM O=C(Nc1ccccc1OCCF)c1cc2ccccc2cc1[O-] ZINC000622629506 1052358341 /nfs/dbraw/zinc/35/83/41/1052358341.db2.gz QUYNMYUCAZRNDO-UHFFFAOYSA-N -1 1 325.339 4.146 20 0 EIADMM O=C(COc1cccc2ccccc21)Nc1ccc([O-])c(Cl)c1 ZINC000171881385 1052457846 /nfs/dbraw/zinc/45/78/46/1052457846.db2.gz BNHIMXBOLIUKNF-UHFFFAOYSA-N -1 1 327.767 4.216 20 0 EIADMM CCOC(=O)c1cnc(C(C)=Cc2csc3ccccc23)[n-]c1=O ZINC000347496464 1052681396 /nfs/dbraw/zinc/68/13/96/1052681396.db2.gz YLLNQRABPIRSRT-FLIBITNWSA-N -1 1 340.404 4.134 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cnc([C@H]4CCCO4)s3)n2)c(Cl)c1 ZINC000350810825 1052768148 /nfs/dbraw/zinc/76/81/48/1052768148.db2.gz ASWRLGKRWFQSPF-LLVKDONJSA-N -1 1 349.799 4.071 20 0 EIADMM COc1cc(C)c(S(=O)(=O)[N-]c2cccc3occc32)c(C)c1C ZINC001194866467 1053136201 /nfs/dbraw/zinc/13/62/01/1053136201.db2.gz IYPLIOPEOBDEOE-UHFFFAOYSA-N -1 1 345.420 4.167 20 0 EIADMM CC(C)Oc1cccc([N-]S(=O)(=O)c2cccc(C(C)C)c2)c1 ZINC001195154325 1053304178 /nfs/dbraw/zinc/30/41/78/1053304178.db2.gz XORXHNOMSXONJM-UHFFFAOYSA-N -1 1 333.453 4.398 20 0 EIADMM Cc1cc([N-]S(=O)(=O)c2cccc(C(C)C)c2)cc(F)c1F ZINC001195168995 1053314188 /nfs/dbraw/zinc/31/41/88/1053314188.db2.gz DTNMSPAROJRVPF-UHFFFAOYSA-N -1 1 325.380 4.197 20 0 EIADMM O=C([N-]c1nnc(-c2ccccc2)s1)c1conc1C1CCCC1 ZINC000864969327 1053397120 /nfs/dbraw/zinc/39/71/20/1053397120.db2.gz MRIFHROYUPPCPY-UHFFFAOYSA-N -1 1 340.408 4.103 20 0 EIADMM CCOC(=O)NC(=S)[N-]c1ccc(Oc2ccc(C)cc2)cc1 ZINC001195485161 1053419007 /nfs/dbraw/zinc/41/90/07/1053419007.db2.gz ZTGOJBALTJAWRJ-UHFFFAOYSA-N -1 1 330.409 4.230 20 0 EIADMM COc1ccccc1NC(=S)Nc1cc([O-])c(Cl)cc1F ZINC001196252169 1053618929 /nfs/dbraw/zinc/61/89/29/1053618929.db2.gz SEPGAPQHOXZGDR-UHFFFAOYSA-N -1 1 326.780 4.002 20 0 EIADMM O=C(Nc1cc(F)c([O-])cc1Cl)c1ccc(N2CCCCC2)cc1 ZINC000885675946 1053798471 /nfs/dbraw/zinc/79/84/71/1053798471.db2.gz GHYYJRDZPDSGNL-UHFFFAOYSA-N -1 1 348.805 4.427 20 0 EIADMM C[C@@H](c1cccc(F)c1)[NH+]1CCN(Cc2ccc(O)c(Cl)c2)CC1 ZINC001197069511 1053833238 /nfs/dbraw/zinc/83/32/38/1053833238.db2.gz JGDFGOITSVDSPL-AWEZNQCLSA-N -1 1 348.849 4.064 20 0 EIADMM CCCCN(CC(F)(F)F)C(=O)c1ccc2ccccc2c1[O-] ZINC000387152119 1053847825 /nfs/dbraw/zinc/84/78/25/1053847825.db2.gz YURPJEICBUAAKH-UHFFFAOYSA-N -1 1 325.330 4.350 20 0 EIADMM O=C(Nc1ccsc1Cl)c1cc(Br)ccc1[O-] ZINC000387173331 1053850818 /nfs/dbraw/zinc/85/08/18/1053850818.db2.gz BSTLLMLQQYOBMD-UHFFFAOYSA-N -1 1 332.606 4.122 20 0 EIADMM [O-]c1cc(NC(=S)Nc2ccccc2C(F)(F)F)c(F)cc1F ZINC001197260183 1053863584 /nfs/dbraw/zinc/86/35/84/1053863584.db2.gz NDCXIHAJLLWRRT-UHFFFAOYSA-N -1 1 348.296 4.498 20 0 EIADMM [O-]c1cccc(NC(=S)NCc2ccc(Cl)cc2)c1Cl ZINC001197578677 1053931592 /nfs/dbraw/zinc/93/15/92/1053931592.db2.gz WUJVDQVNURDTGP-UHFFFAOYSA-N -1 1 327.236 4.186 20 0 EIADMM [O-]c1c(NC(=S)Nc2cccc(F)c2)cccc1C(F)(F)F ZINC001197650083 1053959275 /nfs/dbraw/zinc/95/92/75/1053959275.db2.gz PUSXPODLACTUBB-UHFFFAOYSA-N -1 1 330.306 4.359 20 0 EIADMM S=c1[n-]nc(-c2cccs2)n1Cc1nc(C2CCCCC2)no1 ZINC000113712647 1053986299 /nfs/dbraw/zinc/98/62/99/1053986299.db2.gz ISILYLNKMHHSHA-UHFFFAOYSA-N -1 1 347.469 4.148 20 0 EIADMM Cc1ccc(Cl)cc1S(=O)(=O)[N-]c1ccc(OC(F)F)cc1 ZINC000031666160 1054075779 /nfs/dbraw/zinc/07/57/79/1054075779.db2.gz HMVGESXPAWAUOD-UHFFFAOYSA-N -1 1 347.770 4.051 20 0 EIADMM O=C(NCCc1cccc2cccnc21)c1cc2ccccc2cc1[O-] ZINC000032071634 1054092380 /nfs/dbraw/zinc/09/23/80/1054092380.db2.gz DGUGYBSRUXZLCL-UHFFFAOYSA-N -1 1 342.398 4.066 20 0 EIADMM O=C([N-]c1cc(F)c(F)c(F)c1F)c1conc1C1CCCC1 ZINC000871270748 1054182220 /nfs/dbraw/zinc/18/22/20/1054182220.db2.gz SAYSJJISAXOYSL-UHFFFAOYSA-N -1 1 328.265 4.141 20 0 EIADMM Cc1cccc(NC(=S)Nc2cccc([O-])c2Br)c1 ZINC001198696651 1054227123 /nfs/dbraw/zinc/22/71/23/1054227123.db2.gz IICXMWYGPJZJPH-UHFFFAOYSA-N -1 1 337.242 4.272 20 0 EIADMM CC(C)(C)OC(=O)Nc1ccc(C(=O)N[C@@H]2CCC(C)(C)C2)c([O-])c1 ZINC000857478520 1054267441 /nfs/dbraw/zinc/26/74/41/1054267441.db2.gz KUCNATKTDKBTCQ-CYBMUJFWSA-N -1 1 348.443 4.048 20 0 EIADMM CCCOc1ccc([N-]S(=O)(=O)c2ccc3occc3c2)cc1 ZINC001198857437 1054285127 /nfs/dbraw/zinc/28/51/27/1054285127.db2.gz YSKLLWLNOYIYON-UHFFFAOYSA-N -1 1 331.393 4.022 20 0 EIADMM CC(C)c1ncc(CN[C@@H](CC(=O)[O-])c2ccccc2Cl)s1 ZINC000871883251 1054319855 /nfs/dbraw/zinc/31/98/55/1054319855.db2.gz HFRBGNGSWDYONL-AWEZNQCLSA-N -1 1 338.860 4.226 20 0 EIADMM [O-]c1cccc(NC(=S)NCC2CCCCC2)c1Br ZINC001199927917 1054499744 /nfs/dbraw/zinc/49/97/44/1054499744.db2.gz JFHUDWYWQUSKQQ-UHFFFAOYSA-N -1 1 343.290 4.021 20 0 EIADMM CCc1onc(-c2ccccc2)c1C(=O)[N-]c1nc(C(C)C)ns1 ZINC000874694031 1054717693 /nfs/dbraw/zinc/71/76/93/1054717693.db2.gz ANJCBHFAKFLVBJ-UHFFFAOYSA-N -1 1 342.424 4.131 20 0 EIADMM CSc1ccc(S(=O)(=O)[N-]c2cccc3c2CCCC3)cc1 ZINC000064467869 1054861201 /nfs/dbraw/zinc/86/12/01/1054861201.db2.gz NQSJEXHJFDIVSN-UHFFFAOYSA-N -1 1 333.478 4.088 20 0 EIADMM CCCCCc1ccc(NC(=O)c2cc(NC(C)=O)ccc2[O-])cc1 ZINC000065632216 1054945491 /nfs/dbraw/zinc/94/54/91/1054945491.db2.gz RICPLTQIRYISNM-UHFFFAOYSA-N -1 1 340.423 4.336 20 0 EIADMM O=C(Nc1ccc2ccccc2c1)c1nc[n-]c1C(=O)c1ccccc1 ZINC000776312773 1055192716 /nfs/dbraw/zinc/19/27/16/1055192716.db2.gz ONQNUSLGQGMXMU-UHFFFAOYSA-N -1 1 341.370 4.046 20 0 EIADMM O=C(COc1ccccc1C(F)(F)F)Nc1ccc([O-])c(Cl)c1 ZINC000111667976 1055224317 /nfs/dbraw/zinc/22/43/17/1055224317.db2.gz KCVGIRZWTOUPTH-UHFFFAOYSA-N -1 1 345.704 4.082 20 0 EIADMM CN(C(=O)c1ccc(C(F)(F)F)cc1[O-])C(C)(C)c1ccccc1 ZINC000671893340 1055613026 /nfs/dbraw/zinc/61/30/26/1055613026.db2.gz QENCTOVYFGNLAV-UHFFFAOYSA-N -1 1 337.341 4.418 20 0 EIADMM COc1ccc([N-]S(=O)(=O)c2ccc(C)c(Cl)c2)cc1Cl ZINC000107276697 1055812930 /nfs/dbraw/zinc/81/29/30/1055812930.db2.gz YFMIJJFJWYKCCX-UHFFFAOYSA-N -1 1 346.235 4.111 20 0 EIADMM C/C=C\C[C@H]1CCCN(c2ccc(-c3nc(C)c(C)c(=O)[n-]3)cn2)C1 ZINC000624778134 1056504361 /nfs/dbraw/zinc/50/43/61/1056504361.db2.gz KCVXLRZRJJJVFG-AWFCHZOYSA-N -1 1 338.455 4.044 20 0 EIADMM COc1ccccc1[C@H]1CC[C@@H](C)CN1C(=O)c1ccc([O-])c(F)c1 ZINC000672141437 1056666698 /nfs/dbraw/zinc/66/66/98/1056666698.db2.gz JRARLLGITWHVEC-CXAGYDPISA-N -1 1 343.398 4.153 20 0 EIADMM O=c1cc(Nc2cc(F)c(OC(F)F)c(F)c2)n(C2CCCC2)[n-]1 ZINC001212444459 1056755425 /nfs/dbraw/zinc/75/54/25/1056755425.db2.gz AAACZSQUNAPTGT-UHFFFAOYSA-N -1 1 345.296 4.327 20 0 EIADMM O=S(=O)([N-]c1ccc(F)c(C2CC2)c1)c1ccc2ncsc2c1 ZINC000499502716 1056823570 /nfs/dbraw/zinc/82/35/70/1056823570.db2.gz LZNVHKSNDVXQIU-UHFFFAOYSA-N -1 1 348.424 4.114 20 0 EIADMM O=C([O-])C[C@@H](NCc1c(Cl)oc2ccccc21)c1cccs1 ZINC000388539159 1060282145 /nfs/dbraw/zinc/28/21/45/1060282145.db2.gz DEYDVWCTYPLSQY-GFCCVEGCSA-N -1 1 335.812 4.453 20 0 EIADMM O=C(Nc1ccc(-n2ccc(=O)[n-]2)cc1)[C@@H]1CC[C@H]2CCCC[C@H]2C1 ZINC001168913923 1060517670 /nfs/dbraw/zinc/51/76/70/1060517670.db2.gz HKUXAPDBJKUPGQ-OWCLPIDISA-N -1 1 339.439 4.123 20 0 EIADMM O=C(Nc1ccc(-n2ccc(=O)[n-]2)cc1)[C@@H]1CC[C@@H]2CCCC[C@H]2C1 ZINC001168913921 1060517994 /nfs/dbraw/zinc/51/79/94/1060517994.db2.gz HKUXAPDBJKUPGQ-HRCADAONSA-N -1 1 339.439 4.123 20 0 EIADMM C[C@@H]([N-]C(=O)C(F)(F)c1ccccc1F)c1cccc(F)c1F ZINC000766628507 1060707869 /nfs/dbraw/zinc/70/78/69/1060707869.db2.gz MQDMMNYWPOEXNL-SECBINFHSA-N -1 1 329.268 4.073 20 0 EIADMM [O-]c1c(Br)c(F)ccc1Nc1ccc(Cl)c(O)c1 ZINC001212593942 1060913171 /nfs/dbraw/zinc/91/31/71/1060913171.db2.gz MMUOQJIFQJFBKR-UHFFFAOYSA-N -1 1 332.556 4.396 20 0 EIADMM O=S(=O)([N-]c1cc(C2CCCCC2)n[nH]1)c1cc2ccccc2o1 ZINC000532139746 1032062967 /nfs/dbraw/zinc/06/29/67/1032062967.db2.gz RUBJAGVVOYDOBJ-UHFFFAOYSA-N -1 1 345.424 4.004 20 0 EIADMM COC(=O)c1c[n-]c(S[C@@H](C)c2ccc(C(F)(F)F)cc2)n1 ZINC000193540007 1032158582 /nfs/dbraw/zinc/15/85/82/1032158582.db2.gz NTFLCQLVTBXHEJ-QMMMGPOBSA-N -1 1 330.331 4.068 20 0 EIADMM C[C@@H]1CC[C@H](CCC(=O)Nc2cc(Cl)c([O-])c3ccccc23)O1 ZINC000529538530 1032443466 /nfs/dbraw/zinc/44/34/66/1032443466.db2.gz CSAGCNDPAQOOLC-VXGBXAGGSA-N -1 1 333.815 4.485 20 0 EIADMM C[C@H]1C(=O)CC[C@H]1CC(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000529538377 1032444268 /nfs/dbraw/zinc/44/42/68/1032444268.db2.gz BLFXUOJNQKYQKM-MNOVXSKESA-N -1 1 331.799 4.143 20 0 EIADMM C[C@@H](NC(=O)c1ccc([O-])cc1F)c1ccc(-c2cccnc2)cc1 ZINC000181249566 1032650389 /nfs/dbraw/zinc/65/03/89/1032650389.db2.gz KAIIAUKQPCVCMR-CYBMUJFWSA-N -1 1 336.366 4.084 20 0 EIADMM Cc1cnc(S[C@@H](C)C(=O)c2ccc(C(C)(C)C)cc2)[n-]c1=O ZINC000583945717 1018877427 /nfs/dbraw/zinc/87/74/27/1018877427.db2.gz DMCKYXYRSYDOAC-LBPRGKRZSA-N -1 1 330.453 4.152 20 0 EIADMM Cc1ccc(C)c(CN(C)C(=O)c2ccc(Br)c([O-])c2)c1 ZINC000430186785 1019054472 /nfs/dbraw/zinc/05/44/72/1019054472.db2.gz NHYDSPZAEUOIIO-UHFFFAOYSA-N -1 1 348.240 4.044 20 0 EIADMM Cc1ccc(C(F)(F)F)cc1[N-]S(=O)(=O)c1ccccc1C ZINC000387486865 1019117428 /nfs/dbraw/zinc/11/74/28/1019117428.db2.gz ZPBBUVFHMOYUMA-UHFFFAOYSA-N -1 1 329.343 4.123 20 0 EIADMM CCCc1cc(=O)[n-]c(SCc2coc(-c3ccccc3)n2)n1 ZINC000036620298 1020039306 /nfs/dbraw/zinc/03/93/06/1020039306.db2.gz IGSHFPXBNGUVAL-UHFFFAOYSA-N -1 1 327.409 4.082 20 0 EIADMM CC(C)N(CCc1ccccc1)C(=O)c1ccc2ccc(O)cc2c1[O-] ZINC001625851484 1020285470 /nfs/dbraw/zinc/28/54/70/1020285470.db2.gz DDONCWRWKPBCCD-UHFFFAOYSA-N -1 1 349.430 4.344 20 0 EIADMM Cc1cccc(S(=O)(=O)[N-]c2ccc3oc(C(C)C)nc3c2)c1 ZINC000046303819 1021078676 /nfs/dbraw/zinc/07/86/76/1021078676.db2.gz CHDZLITZXIARAL-UHFFFAOYSA-N -1 1 330.409 4.060 20 0 EIADMM COC(=O)[C@H](C)Cc1ccc(NCc2cccc([O-])c2Cl)cc1 ZINC000512511176 1032963821 /nfs/dbraw/zinc/96/38/21/1032963821.db2.gz CXDGQKRDSXCDRQ-GFCCVEGCSA-N -1 1 333.815 4.009 20 0 EIADMM COC[C@H]([N-]c1nc(-c2ccccc2)no1)c1ccc(Cl)cc1 ZINC000683755892 1021336596 /nfs/dbraw/zinc/33/65/96/1021336596.db2.gz BMGPWQONGPXRSS-HNNXBMFYSA-N -1 1 329.787 4.190 20 0 EIADMM O=C1c2ccc([O-])cc2O/C1=C\c1csc(-c2ccsc2)n1 ZINC000066407164 1021807952 /nfs/dbraw/zinc/80/79/52/1021807952.db2.gz RQTPICMRZPVPKK-RZNTYIFUSA-N -1 1 327.386 4.193 20 0 EIADMM O=C(Nc1ccc(Oc2ccccc2F)nc1)c1ccc([O-])c(F)c1 ZINC000683883986 1021875349 /nfs/dbraw/zinc/87/53/49/1021875349.db2.gz SDRDLFTWLPJVQY-UHFFFAOYSA-N -1 1 342.301 4.110 20 0 EIADMM COc1ccc(C=C2SC(=S)[N-]C2=O)cc1OCCC(C)C ZINC000050234265 1022035761 /nfs/dbraw/zinc/03/57/61/1022035761.db2.gz DFTGHRPSIIBNJG-ZROIWOOFSA-N -1 1 337.466 4.449 20 0 EIADMM O=C(Cc1ccc([O-])c(Cl)c1)Nc1ccc(C(F)(F)F)c(F)c1 ZINC001167427233 1022329232 /nfs/dbraw/zinc/32/92/32/1022329232.db2.gz CZNWNPLRPQFJLX-UHFFFAOYSA-N -1 1 347.695 4.385 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1CCS[C@H]2CCCC[C@H]21 ZINC000175456944 1022358265 /nfs/dbraw/zinc/35/82/65/1022358265.db2.gz HDXZAZNLDOYZRS-AEFFLSMTSA-N -1 1 327.449 4.046 20 0 EIADMM CCOc1cc(C(=O)Nc2cccc3ccn(C)c32)cc(Cl)c1[O-] ZINC000188124335 1022457502 /nfs/dbraw/zinc/45/75/02/1022457502.db2.gz NURPRKFILHZNDT-UHFFFAOYSA-N -1 1 344.798 4.188 20 0 EIADMM CC(=O)Nc1ccc(-c2cc(F)c([O-])cc2F)c(C(F)(F)F)c1 ZINC001211353535 1022541916 /nfs/dbraw/zinc/54/19/16/1022541916.db2.gz XLGMMGRKVGQLGJ-UHFFFAOYSA-N -1 1 331.240 4.315 20 0 EIADMM CCOc1cc(C(=O)N(C)[C@H]2CCCC[C@@H]2C)cc(Cl)c1[O-] ZINC000186565635 1022674076 /nfs/dbraw/zinc/67/40/76/1022674076.db2.gz QLZINBMQBQDFQU-FZMZJTMJSA-N -1 1 325.836 4.095 20 0 EIADMM Cc1cccc(S(=O)(=O)[N-]c2cc(Cl)ccc2Cl)c1F ZINC000313224591 1023126475 /nfs/dbraw/zinc/12/64/75/1023126475.db2.gz VGRRNHXSDLWJRI-UHFFFAOYSA-N -1 1 334.199 4.242 20 0 EIADMM C[C@H](c1c(F)cccc1F)N1CCC(C(=O)c2ccc([O-])cc2)CC1 ZINC000613578206 1023134806 /nfs/dbraw/zinc/13/48/06/1023134806.db2.gz DTISONPTIHGOOE-CYBMUJFWSA-N -1 1 345.389 4.326 20 0 EIADMM CSCc1cccc([N-]S(=O)(=O)c2ccc(Cl)cc2C)c1 ZINC000584736944 1023255044 /nfs/dbraw/zinc/25/50/44/1023255044.db2.gz IVELGTWREUWULS-UHFFFAOYSA-N -1 1 341.885 4.312 20 0 EIADMM C[C@@H]1CC[C@H](C(=O)[O-])[C@H](C)N1Cc1csc(C2CCCCC2)n1 ZINC000659798395 1023281436 /nfs/dbraw/zinc/28/14/36/1023281436.db2.gz YOADTMPEHGCUBF-WWGRRREGSA-N -1 1 336.501 4.264 20 0 EIADMM Cc1cc(Cl)cc(C)c1CNCc1ccc(C(=O)[O-])c(C2CC2)n1 ZINC000417702727 1023410334 /nfs/dbraw/zinc/41/03/34/1023410334.db2.gz KWLVNBYNWVGKQV-UHFFFAOYSA-N -1 1 344.842 4.217 20 0 EIADMM Cc1ccc(CCCC(=O)Nc2ccc(-c3cc(=O)[nH][n-]3)cc2)cc1 ZINC000613668435 1023488573 /nfs/dbraw/zinc/48/85/73/1023488573.db2.gz SLMGFTNGKIYTRE-UHFFFAOYSA-N -1 1 335.407 4.052 20 0 EIADMM Cc1nc(-c2ccccc2NC(=O)c2ccc([O-])c(F)c2)cs1 ZINC000684502983 1023972628 /nfs/dbraw/zinc/97/26/28/1023972628.db2.gz JRBSENCTXZXQBU-UHFFFAOYSA-N -1 1 328.368 4.216 20 0 EIADMM O=C([N-]c1c(F)cc(Br)cc1F)c1ccc(Cl)o1 ZINC000088173874 1024070532 /nfs/dbraw/zinc/07/05/32/1024070532.db2.gz WSTUGEGJBUCEEU-UHFFFAOYSA-N -1 1 336.519 4.226 20 0 EIADMM O=S(=O)([N-]C1CCC2(CCCCC2)CC1)c1cccc(F)c1F ZINC001211525986 1024493910 /nfs/dbraw/zinc/49/39/10/1024493910.db2.gz LPZVGLYGSSNJQI-UHFFFAOYSA-N -1 1 343.439 4.136 20 0 EIADMM COc1c(Cl)cccc1[N-]S(=O)(=O)/C=C/c1ccc(C)cc1 ZINC000104766498 1024656038 /nfs/dbraw/zinc/65/60/38/1024656038.db2.gz IFRULTHAFKVDFR-ZHACJKMWSA-N -1 1 337.828 4.070 20 0 EIADMM Cc1cc(C)c(S(=O)(=O)[N-]c2cc(F)c(F)cc2Cl)s1 ZINC000431159775 1024740620 /nfs/dbraw/zinc/74/06/20/1024740620.db2.gz QYXHSPKTTKHGAA-UHFFFAOYSA-N -1 1 337.800 4.097 20 0 EIADMM C[C@H](Oc1cccc(Cl)c1)c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445483803 1024740967 /nfs/dbraw/zinc/74/09/67/1024740967.db2.gz VIRCBWZAHRHZLM-VIFPVBQESA-N -1 1 334.734 4.375 20 0 EIADMM Cc1c(F)cccc1-c1ccc(CN[C@@H](CC(C)(C)C)C(=O)[O-])o1 ZINC000426776916 1024759393 /nfs/dbraw/zinc/75/93/93/1024759393.db2.gz IVCUMHYDYVRQLZ-INIZCTEOSA-N -1 1 333.403 4.373 20 0 EIADMM O=C(Nc1ccccc1CCC(F)(F)F)c1cc(F)ccc1[O-] ZINC000092433522 1024807018 /nfs/dbraw/zinc/80/70/18/1024807018.db2.gz PVHVJHMKYAQNIR-UHFFFAOYSA-N -1 1 327.277 4.279 20 0 EIADMM Cc1cc(F)ccc1-c1ccc(CN[C@@H](CC(C)(C)C)C(=O)[O-])o1 ZINC000426777384 1024825409 /nfs/dbraw/zinc/82/54/09/1024825409.db2.gz MXJZRJAJDJCBCG-INIZCTEOSA-N -1 1 333.403 4.373 20 0 EIADMM CCc1cccc(C)c1[N-]S(=O)(=O)c1cc(F)cc(Cl)c1 ZINC000535892095 1025220102 /nfs/dbraw/zinc/22/01/02/1025220102.db2.gz OUWVPYVKHFGXQQ-UHFFFAOYSA-N -1 1 327.808 4.151 20 0 EIADMM COc1cc(C(=O)Nc2ccc(F)c(C3CC3)c2)cc(Cl)c1[O-] ZINC000343907815 1025254703 /nfs/dbraw/zinc/25/47/03/1025254703.db2.gz PXYHZFLWIHDODC-UHFFFAOYSA-N -1 1 335.762 4.323 20 0 EIADMM CC(C)CN1C(=O)c2ccccc2N[C@@H]1c1ccc([O-])c(Cl)c1 ZINC000519275830 1025673979 /nfs/dbraw/zinc/67/39/79/1025673979.db2.gz AWCQBTBZGUQJLX-KRWDZBQOSA-N -1 1 330.815 4.268 20 0 EIADMM CC(C)CN(Cc1cccc(Cl)c1)C(=O)c1cccc([O-])c1F ZINC001167840488 1025868369 /nfs/dbraw/zinc/86/83/69/1025868369.db2.gz PWCVHHMWKJBOIW-UHFFFAOYSA-N -1 1 335.806 4.483 20 0 EIADMM O=C(CCSc1ccc(F)cc1)Nc1ccc([O-])c(Cl)c1 ZINC000111668428 1026314306 /nfs/dbraw/zinc/31/43/06/1026314306.db2.gz HFVQTRMBENMSGS-UHFFFAOYSA-N -1 1 325.792 4.306 20 0 EIADMM O=C(CCCOCCc1ccccc1)Nc1ccc([O-])c(Cl)c1 ZINC000111667262 1026314598 /nfs/dbraw/zinc/31/45/98/1026314598.db2.gz AUABIANUCTUVCL-UHFFFAOYSA-N -1 1 333.815 4.024 20 0 EIADMM CCCN(CC(=O)Nc1ccccc1C)Cc1cccc([O-])c1Cl ZINC000506963956 1026558474 /nfs/dbraw/zinc/55/84/74/1026558474.db2.gz TVSCOEYEUYBYES-UHFFFAOYSA-N -1 1 346.858 4.205 20 0 EIADMM C[C@@H](NCc1cccc([O-])c1Cl)c1ccc(Br)cn1 ZINC000645177824 1026572719 /nfs/dbraw/zinc/57/27/19/1026572719.db2.gz SNMLDLVVXPHFRQ-SECBINFHSA-N -1 1 341.636 4.054 20 0 EIADMM CN(C(=O)c1ccc(C(F)(F)F)c([O-])c1)[C@H]1CCc2ccccc21 ZINC000684870473 1026630822 /nfs/dbraw/zinc/63/08/22/1026630822.db2.gz DCDCXURLPPARHJ-HNNXBMFYSA-N -1 1 335.325 4.171 20 0 EIADMM C[C@H](c1ccc(F)cc1)N(C)C(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684870905 1026632725 /nfs/dbraw/zinc/63/27/25/1026632725.db2.gz PRPQOOQAMSDHBK-SNVBAGLBSA-N -1 1 341.304 4.383 20 0 EIADMM CCc1cccc(C)c1[N-]S(=O)(=O)c1ccc2nc(C)sc2c1 ZINC000427122151 1026731243 /nfs/dbraw/zinc/73/12/43/1026731243.db2.gz AADLQGXWKBUQOE-UHFFFAOYSA-N -1 1 346.477 4.276 20 0 EIADMM CCOC(=O)c1cnc(C(C)=Cc2ccc(C(C)(C)C)s2)[n-]c1=O ZINC000432707299 1026807732 /nfs/dbraw/zinc/80/77/32/1026807732.db2.gz KNIOUQOCGDOKFC-LUAWRHEFSA-N -1 1 346.452 4.278 20 0 EIADMM CC(=O)c1cc([N-]S(=O)(=O)c2ccc(C(C)(C)C)cc2)ccc1F ZINC000507586120 1026842429 /nfs/dbraw/zinc/84/24/29/1026842429.db2.gz UEMVHMZJRXNQTH-UHFFFAOYSA-N -1 1 349.427 4.127 20 0 EIADMM CCCc1ccccc1[N-]S(=O)(=O)c1cccc(C(F)F)c1 ZINC000780377820 1027092671 /nfs/dbraw/zinc/09/26/71/1027092671.db2.gz ZUIBTSDJXPLRBI-UHFFFAOYSA-N -1 1 325.380 4.378 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)C1(CCOCc2ccccc2)CC1 ZINC000474509180 1027166255 /nfs/dbraw/zinc/16/62/55/1027166255.db2.gz HKWQXQCQWXFXEM-UHFFFAOYSA-N -1 1 345.826 4.371 20 0 EIADMM Cc1nc(-c2ccc(NCc3ccc(C4CC4)cc3)nc2)[n-]c(=O)c1C ZINC000302701430 1027366305 /nfs/dbraw/zinc/36/63/05/1027366305.db2.gz IAJACDTYMYFFLW-UHFFFAOYSA-N -1 1 346.434 4.351 20 0 EIADMM Cc1c(Cl)cccc1S(=O)(=O)[N-]c1ccc(OC(F)F)cc1 ZINC000614739145 1027428455 /nfs/dbraw/zinc/42/84/55/1027428455.db2.gz BZZDKLCBINFPQD-UHFFFAOYSA-N -1 1 347.770 4.051 20 0 EIADMM O=C(NCc1ccc(Cl)cc1Cl)c1c([O-])cccc1Cl ZINC000049080432 1027525947 /nfs/dbraw/zinc/52/59/47/1027525947.db2.gz UOARVTSOTZKTOH-UHFFFAOYSA-N -1 1 330.598 4.282 20 0 EIADMM Cc1oc([C@H](C)N(C)Cc2cccc(OC(C)C)c2)cc1C(=O)[O-] ZINC000582127816 1027735730 /nfs/dbraw/zinc/73/57/30/1027735730.db2.gz KGONGLAPOIYEID-ZDUSSCGKSA-N -1 1 331.412 4.266 20 0 EIADMM Cc1nc(-c2cccc(NC(=O)c3c(F)ccc([O-])c3F)c2)oc1C ZINC000343074007 1028082822 /nfs/dbraw/zinc/08/28/22/1028082822.db2.gz TZOWJZDOMADDPV-UHFFFAOYSA-N -1 1 344.317 4.195 20 0 EIADMM Cn1cc(-c2nc(-c3ccc([O-])cc3Cl)no2)c2ccccc21 ZINC000445449365 1028538542 /nfs/dbraw/zinc/53/85/42/1028538542.db2.gz OFDUBLZBQSXUJE-UHFFFAOYSA-N -1 1 325.755 4.254 20 0 EIADMM O=c1ccc(-c2noc(-c3cc(Oc4ccccc4)ccc3[O-])n2)c[nH]1 ZINC000445439203 1028561319 /nfs/dbraw/zinc/56/13/19/1028561319.db2.gz ODEONNHDAKFNFB-UHFFFAOYSA-N -1 1 347.330 4.002 20 0 EIADMM C[C@@H](Oc1ccccc1Cl)c1nc(-c2ccc([O-])cc2F)no1 ZINC000445460697 1028616456 /nfs/dbraw/zinc/61/64/56/1028616456.db2.gz CFPUGQDLVJJKLJ-SECBINFHSA-N -1 1 334.734 4.375 20 0 EIADMM [O-]c1ccc(-c2noc(CSc3nc4ccccc4o3)n2)c(F)c1 ZINC000445460018 1028617792 /nfs/dbraw/zinc/61/77/92/1028617792.db2.gz LQSJFAPCQSXPSP-UHFFFAOYSA-N -1 1 343.339 4.015 20 0 EIADMM CCCOc1ccc(CCc2nc(-c3ccc([O-])c(F)c3)no2)cc1 ZINC000445478318 1028625302 /nfs/dbraw/zinc/62/53/02/1028625302.db2.gz CKTOICWATDWEFB-UHFFFAOYSA-N -1 1 342.370 4.155 20 0 EIADMM Cc1cccc(CSCc2nc(-c3ccc([O-])c(F)c3)no2)c1 ZINC000445481116 1028630917 /nfs/dbraw/zinc/63/09/17/1028630917.db2.gz JYFCRQOCTDQMCY-UHFFFAOYSA-N -1 1 330.384 4.323 20 0 EIADMM Cc1sc(-c2ccco2)nc1-c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445481001 1028631524 /nfs/dbraw/zinc/63/15/24/1028631524.db2.gz NCMGIHWVQFKGPG-UHFFFAOYSA-N -1 1 343.339 4.273 20 0 EIADMM [O-]c1ccc(-c2noc([C@H]3C[C@@H]3c3cc(F)ccc3F)n2)cc1F ZINC000445484439 1028634090 /nfs/dbraw/zinc/63/40/90/1028634090.db2.gz ZFCJMVTZGPLHJK-PWSUYJOCSA-N -1 1 332.281 4.131 20 0 EIADMM [O-]c1ccc(-c2noc(CCCOc3ccc(Cl)cc3)n2)cc1F ZINC000445473916 1028642736 /nfs/dbraw/zinc/64/27/36/1028642736.db2.gz OYARZTMNAVSOHJ-UHFFFAOYSA-N -1 1 348.761 4.246 20 0 EIADMM CNc1cccc(Br)c1Nc1cc(F)c([O-])c(F)c1 ZINC001213384384 1028718656 /nfs/dbraw/zinc/71/86/56/1028718656.db2.gz JSDYQBVINDJYEF-UHFFFAOYSA-N -1 1 329.144 4.218 20 0 EIADMM CC(C)c1cc(C(=O)[N-]c2nnc(CC3CCCCC3)s2)no1 ZINC000156424548 1028732297 /nfs/dbraw/zinc/73/22/97/1028732297.db2.gz VQJSOEAZEWLPRM-UHFFFAOYSA-N -1 1 334.445 4.025 20 0 EIADMM Cc1cc(Nc2cc(Br)cc(Cl)c2[O-])ccc1CO ZINC001211591922 1028983634 /nfs/dbraw/zinc/98/36/34/1028983634.db2.gz ICWYBZXWVQDOQY-UHFFFAOYSA-N -1 1 342.620 4.352 20 0 EIADMM C[C@H](CC1CCCC1)C(=O)N1CCC(C(=O)c2ccc([O-])cc2)CC1 ZINC000114537012 1029172394 /nfs/dbraw/zinc/17/23/94/1029172394.db2.gz WFIVZFIRQKGFLK-OAHLLOKOSA-N -1 1 343.467 4.030 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc3nc(C4CCC4)[nH]c3c2)s1 ZINC000343470340 1029318001 /nfs/dbraw/zinc/31/80/01/1029318001.db2.gz RREAVJMKLWDRJA-UHFFFAOYSA-N -1 1 347.465 4.001 20 0 EIADMM CC(C)c1cccc([N-]S(=O)(=O)c2ccc3ncccc3c2)c1 ZINC000525330896 1029573544 /nfs/dbraw/zinc/57/35/44/1029573544.db2.gz QRERLGZWRIELIX-UHFFFAOYSA-N -1 1 326.421 4.159 20 0 EIADMM Cc1nc(-c2ccc(NCCC3CCCCC3)nc2)[n-]c(=O)c1C ZINC000301374080 1029718389 /nfs/dbraw/zinc/71/83/89/1029718389.db2.gz QOAKPCUHFAAQES-UHFFFAOYSA-N -1 1 326.444 4.243 20 0 EIADMM Cc1nc(-c2ccc(NC[C@H]3C[C@@H]3c3ccccc3)nc2)[n-]c(=O)c1C ZINC000301398702 1029725127 /nfs/dbraw/zinc/72/51/27/1029725127.db2.gz OOXMZNWAZLYICU-QZTJIDSGSA-N -1 1 346.434 4.077 20 0 EIADMM Cc1nc(-c2ccc(N[C@@H]3C[C@@H]3C3CCCCC3)nc2)[n-]c(=O)c1C ZINC000301429891 1029731381 /nfs/dbraw/zinc/73/13/81/1029731381.db2.gz QDAJWGYTGUBIRW-IAGOWNOFSA-N -1 1 338.455 4.242 20 0 EIADMM C[C@H](N(C)Cc1csc(-c2ccc(C(=O)[O-])cc2)n1)C1(C)CC1 ZINC000584356565 1029752355 /nfs/dbraw/zinc/75/23/55/1029752355.db2.gz SWNQEERKZMTOJE-LBPRGKRZSA-N -1 1 330.453 4.129 20 0 EIADMM CCc1nc(SCc2ccc(Br)s2)[n-]c(=O)c1C ZINC000584362215 1029756842 /nfs/dbraw/zinc/75/68/42/1029756842.db2.gz QPRCIFPUGSKMTA-UHFFFAOYSA-N -1 1 345.287 4.169 20 0 EIADMM CCC(CC)c1nnc([N-]C(=O)c2ccc(F)c(F)c2F)s1 ZINC000170584520 1029851762 /nfs/dbraw/zinc/85/17/62/1029851762.db2.gz LOFJRNAUPKKSAC-UHFFFAOYSA-N -1 1 329.347 4.111 20 0 EIADMM COc1ccc(-c2nc(-c3cc(Cl)cc(Cl)c3)no2)c([O-])c1 ZINC000318253909 1029852329 /nfs/dbraw/zinc/85/23/29/1029852329.db2.gz BOWRCMMJDSWXPC-UHFFFAOYSA-N -1 1 337.162 4.425 20 0 EIADMM CC(C)c1cc(NCCc2n[n-]c(=S)n2C(C)C)nc(C(C)C)n1 ZINC000090093759 1029862244 /nfs/dbraw/zinc/86/22/44/1029862244.db2.gz MXMMYYKULKNLHZ-UHFFFAOYSA-N -1 1 348.520 4.213 20 0 EIADMM CCc1ccccc1S(=O)(=O)[N-]c1ccccc1C(C)(F)F ZINC000451091253 1030231058 /nfs/dbraw/zinc/23/10/58/1030231058.db2.gz VXGRZQNZZICYBV-UHFFFAOYSA-N -1 1 325.380 4.162 20 0 EIADMM [O-]c1ccc(-c2noc(-c3ccccc3OC3CCC3)n2)c(F)c1 ZINC000685365511 1030239393 /nfs/dbraw/zinc/23/93/93/1030239393.db2.gz KXMPWSKWQOLADW-UHFFFAOYSA-N -1 1 326.327 4.180 20 0 EIADMM CCc1cc2c(CNc3ccc(F)c(C)c3)cc(=O)oc2cc1[O-] ZINC000728593531 1030279690 /nfs/dbraw/zinc/27/96/90/1030279690.db2.gz XJHQBEMYBYULJH-UHFFFAOYSA-N -1 1 327.355 4.121 20 0 EIADMM COc1cc(C(=O)N(C)Cc2ccc(C(C)C)cc2)cc(Cl)c1[O-] ZINC000526949467 1030343183 /nfs/dbraw/zinc/34/31/83/1030343183.db2.gz SLHBSLVLHDADTI-UHFFFAOYSA-N -1 1 347.842 4.450 20 0 EIADMM O=C(N[C@H]1CCC[C@H](c2ccccc2)C1)c1c(F)ccc([O-])c1F ZINC000685482818 1030370566 /nfs/dbraw/zinc/37/05/66/1030370566.db2.gz SHZILTVQBVEPGD-KBPBESRZSA-N -1 1 331.362 4.127 20 0 EIADMM Cc1ccc(Cl)c(S(=O)(=O)[N-]CCCC(C)(F)F)c1Cl ZINC000451611526 1030612924 /nfs/dbraw/zinc/61/29/24/1030612924.db2.gz XOBLYPRQWDOSLW-UHFFFAOYSA-N -1 1 346.226 4.016 20 0 EIADMM [O-]c1c(-c2nc(Cc3cc(F)cc(F)c3)no2)ccc2ccccc21 ZINC000393051300 1030662821 /nfs/dbraw/zinc/66/28/21/1030662821.db2.gz MCAGQUPWJRQYLV-UHFFFAOYSA-N -1 1 338.313 4.464 20 0 EIADMM CC[C@H](CNC(=O)c1ccc(C(F)(F)F)c([O-])c1)CC(F)(F)F ZINC000665998220 1031148367 /nfs/dbraw/zinc/14/83/67/1031148367.db2.gz DUJPDJHNDZFHFQ-QMMMGPOBSA-N -1 1 343.267 4.119 20 0 EIADMM CC(C)Oc1cccc(F)c1Nc1cc2ccc([O-])cc2oc1=O ZINC001211775624 1033883012 /nfs/dbraw/zinc/88/30/12/1033883012.db2.gz SYKKLCHTNSVYNW-UHFFFAOYSA-N -1 1 329.327 4.169 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2c(C)c(F)ccc2Cl)sc1C ZINC000433177667 1034010402 /nfs/dbraw/zinc/01/04/02/1034010402.db2.gz VHDGEKNLECXFQZ-UHFFFAOYSA-N -1 1 333.837 4.267 20 0 EIADMM COC(=O)c1[n-]c(=N[C@@H](C)c2cccc(Cl)c2Cl)sc1C ZINC000434089773 1035157880 /nfs/dbraw/zinc/15/78/80/1035157880.db2.gz BQXHRIGPRVGNKX-ZETCQYMHSA-N -1 1 345.251 4.140 20 0 EIADMM CCOc1cc(-c2noc(C(C)(C)CC(F)F)n2)cc(Cl)c1[O-] ZINC000420496718 1035647712 /nfs/dbraw/zinc/64/77/12/1035647712.db2.gz YEPAAOMMLPYPHM-UHFFFAOYSA-N -1 1 346.761 4.427 20 0 EIADMM CCC[C@]1(C)CCCN(C(=O)c2ccc(Br)c([O-])c2)C1 ZINC000491028010 1035774189 /nfs/dbraw/zinc/77/41/89/1035774189.db2.gz MVVXKTIMOAXIQC-MRXNPFEDSA-N -1 1 340.261 4.197 20 0 EIADMM Cc1cccc(S(=O)(=O)[N-]c2cccc(OC3CCCC3)c2)c1 ZINC000491057480 1035798680 /nfs/dbraw/zinc/79/86/80/1035798680.db2.gz FKRQCXHCBYJDFK-UHFFFAOYSA-N -1 1 331.437 4.117 20 0 EIADMM [O-]c1c(Cl)cc(CN2C[C@H]3CCC[C@@H]3C2)cc1Br ZINC001231746514 1036059551 /nfs/dbraw/zinc/05/95/51/1036059551.db2.gz VWNNMUNLABMTIT-GHMZBOCLSA-N -1 1 330.653 4.040 20 0 EIADMM O=S(=O)([N-]c1ccc2c[nH]nc2c1)c1ccccc1-c1ccccc1 ZINC000485819628 1036301515 /nfs/dbraw/zinc/30/15/15/1036301515.db2.gz VDAYQYCQJMSEJP-UHFFFAOYSA-N -1 1 349.415 4.031 20 0 EIADMM Cn1ccc2c1cccc2[N-]S(=O)(=O)c1ccc2ccccc2c1 ZINC000588834742 1036543601 /nfs/dbraw/zinc/54/36/01/1036543601.db2.gz VSQJICBTCILEMB-UHFFFAOYSA-N -1 1 336.416 4.132 20 0 EIADMM CO[C@@H](C)c1cccc([N-]S(=O)(=O)c2cccc(Cl)c2C)c1 ZINC000588833550 1036545285 /nfs/dbraw/zinc/54/52/85/1036545285.db2.gz PNOAHOBZVDFRHC-LBPRGKRZSA-N -1 1 339.844 4.157 20 0 EIADMM Cc1ccc(-c2nnc(SCC(=O)c3ccc([O-])cc3)o2)c(C)c1 ZINC000589275210 1036725657 /nfs/dbraw/zinc/72/56/57/1036725657.db2.gz KBUWYOAIBNQAOC-UHFFFAOYSA-N -1 1 340.404 4.034 20 0 EIADMM O=C(Nc1nc2ccsc2s1)Nc1ccc([O-])c(Cl)c1 ZINC000486931158 1036894114 /nfs/dbraw/zinc/89/41/14/1036894114.db2.gz ALMTXZBBXJDDRY-UHFFFAOYSA-N -1 1 325.802 4.361 20 0 EIADMM CCOc1ccc(F)c(NC(=O)Nc2ccc([O-])c(Cl)c2)c1F ZINC000486959981 1036919616 /nfs/dbraw/zinc/91/96/16/1036919616.db2.gz AERVDYFNFWJJNU-UHFFFAOYSA-N -1 1 342.729 4.367 20 0 EIADMM Cn1cc(NC(=O)Nc2ccc([O-])c(Cl)c2)c(-c2ccccc2)n1 ZINC000487179516 1037034150 /nfs/dbraw/zinc/03/41/50/1037034150.db2.gz FLBCHQANYWQJQL-UHFFFAOYSA-N -1 1 342.786 4.090 20 0 EIADMM O=C(CC1CCC(C(F)(F)F)CC1)Nc1cc([O-])c(F)cc1F ZINC000909985613 1037226479 /nfs/dbraw/zinc/22/64/79/1037226479.db2.gz MVXKBHBIPOBDOF-UHFFFAOYSA-N -1 1 337.288 4.368 20 0 EIADMM O=C([O-])c1ccccc1CC1CCN(Cc2ccc(F)cc2F)CC1 ZINC000573104248 1037348134 /nfs/dbraw/zinc/34/81/34/1037348134.db2.gz DCCKTNQCMDGCQZ-UHFFFAOYSA-N -1 1 345.389 4.118 20 0 EIADMM C[C@H](OCCCC[P@](=O)([O-])O)c1ccc(Cl)cc1Cl ZINC001225023126 1037648785 /nfs/dbraw/zinc/64/87/85/1037648785.db2.gz VEJCIANVEUPBEH-VIFPVBQESA-N -1 1 327.144 4.029 20 0 EIADMM Cc1cc(F)c(CN[C@H](CC(=O)[O-])c2cccs2)c(Cl)c1 ZINC000669472599 1037942652 /nfs/dbraw/zinc/94/26/52/1037942652.db2.gz CBNBLLNZAQYFKC-CYBMUJFWSA-N -1 1 327.808 4.155 20 0 EIADMM O=C(Nc1csc2ccccc12)c1nc[n-]c1C(=O)c1ccccc1 ZINC000503877327 1037957811 /nfs/dbraw/zinc/95/78/11/1037957811.db2.gz VPNMIYRNFHOABY-UHFFFAOYSA-N -1 1 347.399 4.108 20 0 EIADMM O=C(CC/C=C/c1ccccc1)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC000606530686 1038144655 /nfs/dbraw/zinc/14/46/55/1038144655.db2.gz JNYMQNGKLDFOIR-XBXARRHUSA-N -1 1 333.391 4.214 20 0 EIADMM [O-]c1cccc(CN2CCCn3c(cc4ccccc43)C2)c1Cl ZINC000646203830 1038380457 /nfs/dbraw/zinc/38/04/57/1038380457.db2.gz RBTKPHLSRFSVMV-UHFFFAOYSA-N -1 1 326.827 4.406 20 0 EIADMM O=C([O-])CC[C@@H]1CCCCN1Cc1csc(C2CCCCC2)n1 ZINC000424257484 1038755861 /nfs/dbraw/zinc/75/58/61/1038755861.db2.gz KLUBZRJVKTULDG-INIZCTEOSA-N -1 1 336.501 4.410 20 0 EIADMM O=C([O-])CC[C@H]1CCCCN1Cc1csc(-c2ccccc2F)n1 ZINC000424267718 1038762924 /nfs/dbraw/zinc/76/29/24/1038762924.db2.gz YJPZMGWBQSDNIE-CQSZACIVSA-N -1 1 348.443 4.169 20 0 EIADMM O=C(CCc1ccc(-c2ccccc2)o1)Nc1c([O-])cccc1F ZINC000608366192 1038803083 /nfs/dbraw/zinc/80/30/83/1038803083.db2.gz OTSWHCBTEYUYMI-UHFFFAOYSA-N -1 1 325.339 4.363 20 0 EIADMM Cc1nc(-c2ccccc2)sc1C(=O)Nc1c([O-])cccc1F ZINC000608367451 1038804408 /nfs/dbraw/zinc/80/44/08/1038804408.db2.gz QWVCKBCFWNVCCB-UHFFFAOYSA-N -1 1 328.368 4.216 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2ccc3c(cnn3C(C)C)c2)cc1C ZINC000476499844 1038831881 /nfs/dbraw/zinc/83/18/81/1038831881.db2.gz ONPRGFZNBKPDRA-UHFFFAOYSA-N -1 1 343.452 4.035 20 0 EIADMM Cc1cc(C)c([N-]S(=O)(=O)c2ccc(C(=O)C(C)C)cc2)c(C)c1 ZINC000539110423 1038854188 /nfs/dbraw/zinc/85/41/88/1038854188.db2.gz LXEMTWYMRFHEQV-UHFFFAOYSA-N -1 1 345.464 4.251 20 0 EIADMM O=C(Nc1ccc(-c2nc3ccccc3s2)cc1)c1cncc([O-])c1 ZINC000534182414 1039188814 /nfs/dbraw/zinc/18/88/14/1039188814.db2.gz NKQXRNRXQJWLMF-UHFFFAOYSA-N -1 1 347.399 4.316 20 0 EIADMM CCSc1cccc([N-]S(=O)(=O)c2cccc(Cl)c2)c1 ZINC000505316328 1039215965 /nfs/dbraw/zinc/21/59/65/1039215965.db2.gz JIWVKNPOZXDZDZ-UHFFFAOYSA-N -1 1 327.858 4.253 20 0 EIADMM Cc1nc(C2CCCC2)sc1C(=O)Nc1ccc([O-])c(F)c1F ZINC000456775742 1039597569 /nfs/dbraw/zinc/59/75/69/1039597569.db2.gz DHYURCSLHNKJKC-UHFFFAOYSA-N -1 1 338.379 4.345 20 0 EIADMM O=C(Nc1ccc([O-])c(F)c1F)c1ccnc(OC2CCCCC2)c1 ZINC000456777742 1039598190 /nfs/dbraw/zinc/59/81/90/1039598190.db2.gz GOAJUZPJQSIROI-UHFFFAOYSA-N -1 1 348.349 4.029 20 0 EIADMM Cc1ccc(C)c(OCCCCC(=O)Nc2ccc([O-])c(F)c2F)c1 ZINC000456792240 1039611557 /nfs/dbraw/zinc/61/15/57/1039611557.db2.gz HXJWGAPADIBEMW-UHFFFAOYSA-N -1 1 349.377 4.475 20 0 EIADMM O=C(CCCc1ccc(F)c(F)c1)Nc1ccc([O-])c(Cl)c1 ZINC000122278454 1039640660 /nfs/dbraw/zinc/64/06/60/1039640660.db2.gz KCNCQYGEOUOKKM-UHFFFAOYSA-N -1 1 325.742 4.285 20 0 EIADMM CCc1c(C(=O)Nc2ccc([O-])c(Cl)c2)cnn1C(CC)CC ZINC000478348968 1039689049 /nfs/dbraw/zinc/68/90/49/1039689049.db2.gz ZYNKXSWBQSVOTI-UHFFFAOYSA-N -1 1 335.835 4.418 20 0 EIADMM CC(C)(C)[C@H]1CCCN(C(=O)c2ccc(Br)c([O-])c2)C1 ZINC000478471644 1039784518 /nfs/dbraw/zinc/78/45/18/1039784518.db2.gz WHZSIUVCQOTYEO-LBPRGKRZSA-N -1 1 340.261 4.053 20 0 EIADMM CCOc1cc(C(=O)N2CCC[C@@H](C(C)(C)C)C2)cc(Cl)c1[O-] ZINC000478475433 1039784635 /nfs/dbraw/zinc/78/46/35/1039784635.db2.gz WFFVDMXZOQPNPD-CYBMUJFWSA-N -1 1 339.863 4.343 20 0 EIADMM CCCCCc1nnc([N-]C(=O)c2cc(F)c(Cl)cc2F)s1 ZINC000481881784 1039879970 /nfs/dbraw/zinc/87/99/70/1039879970.db2.gz VAEDWLQHMOTYOE-UHFFFAOYSA-N -1 1 345.802 4.455 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc3oc(C4CC4)nc3c2)c(C)c1 ZINC000032097206 1040210182 /nfs/dbraw/zinc/21/01/82/1040210182.db2.gz NOMBIOIMVXPODS-UHFFFAOYSA-N -1 1 342.420 4.123 20 0 EIADMM C[C@@]1(C(=O)Nc2ccc(-c3cc(=O)[nH][n-]3)cc2)CCCc2ccccc21 ZINC000477106481 1040217396 /nfs/dbraw/zinc/21/73/96/1040217396.db2.gz KUWCOJOZRWEYLE-OAQYLSRUSA-N -1 1 347.418 4.015 20 0 EIADMM CCc1ccc(C(C)(C)C(=O)Nc2ccc(-c3cc(=O)[nH][n-]3)cc2)cc1 ZINC000477112188 1040236412 /nfs/dbraw/zinc/23/64/12/1040236412.db2.gz ZWAFAJOKXAATMU-UHFFFAOYSA-N -1 1 349.434 4.261 20 0 EIADMM CC(C)[C@H](C(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)c1ccccc1 ZINC000477130503 1040250070 /nfs/dbraw/zinc/25/00/70/1040250070.db2.gz ANBHECMXTHEVTO-IBGZPJMESA-N -1 1 335.407 4.161 20 0 EIADMM Cc1ccccc1C(C)(C)C(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC000477129007 1040250329 /nfs/dbraw/zinc/25/03/29/1040250329.db2.gz XNVNVEXMZULCFJ-UHFFFAOYSA-N -1 1 335.407 4.007 20 0 EIADMM C[C@@H](c1ccc(C(=O)[O-])o1)N(C)Cc1cccc(OC(F)(F)F)c1 ZINC000568068168 1040491470 /nfs/dbraw/zinc/49/14/70/1040491470.db2.gz GHBJADQKIVMCOL-JTQLQIEISA-N -1 1 343.301 4.069 20 0 EIADMM CCCc1cc(=O)[n-]c(SCc2csc(-c3ccc(C)o3)n2)n1 ZINC000032322906 1040644568 /nfs/dbraw/zinc/64/45/68/1040644568.db2.gz QTODRBRSNXTEIZ-UHFFFAOYSA-N -1 1 347.465 4.452 20 0 EIADMM O=c1cc(C(F)(F)F)nc(SCc2cnc3ccccc3c2)[n-]1 ZINC000539708792 1040716969 /nfs/dbraw/zinc/71/69/69/1040716969.db2.gz NRUWXWUZZGUINM-UHFFFAOYSA-N -1 1 337.326 4.042 20 0 EIADMM CCn1cc(C(=O)Nc2ccc(-c3cc(=O)[nH][n-]3)cc2)c2ccccc21 ZINC000554145731 1040828325 /nfs/dbraw/zinc/82/83/25/1040828325.db2.gz XCOWJQJMXBQZJO-UHFFFAOYSA-N -1 1 346.390 4.009 20 0 EIADMM CCc1ccc(S(=O)(=O)[N-]c2nc(C)c(Cl)cc2Cl)cc1 ZINC000539956348 1040940224 /nfs/dbraw/zinc/94/02/24/1040940224.db2.gz BHYJVGRGIDPRQK-UHFFFAOYSA-N -1 1 345.251 4.060 20 0 EIADMM Cc1nc(-c2ccc(N[C@@H]3CCC[C@H](C(C)C)C3)nc2)[n-]c(=O)c1C ZINC000462828810 1040982189 /nfs/dbraw/zinc/98/21/89/1040982189.db2.gz QPQLWQDCHBYXFF-DOTOQJQBSA-N -1 1 340.471 4.488 20 0 EIADMM Cc1ccc(-c2nc(CSc3nc(C4CC4)cc(=O)[n-]3)co2)cc1 ZINC000436239183 1040986728 /nfs/dbraw/zinc/98/67/28/1040986728.db2.gz HJVUISMOWKWNDW-UHFFFAOYSA-N -1 1 339.420 4.315 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2ccc(CC(F)(F)F)cc2)cc1F ZINC000480196493 1041054091 /nfs/dbraw/zinc/05/40/91/1041054091.db2.gz JMLDOQBPJQETLQ-UHFFFAOYSA-N -1 1 347.333 4.040 20 0 EIADMM C[C@H](c1nc2ccccc2s1)N(C)C(=O)c1ccc(Cl)cc1[O-] ZINC000194811612 1041212387 /nfs/dbraw/zinc/21/23/87/1041212387.db2.gz URNWPMHISKWPDW-SNVBAGLBSA-N -1 1 346.839 4.489 20 0 EIADMM CC(C)CCC[C@@H](NCc1ccc(-c2ccccc2F)o1)C(=O)[O-] ZINC000904037914 1041286332 /nfs/dbraw/zinc/28/63/32/1041286332.db2.gz CXLCIRXHIMHAON-QGZVFWFLSA-N -1 1 333.403 4.455 20 0 EIADMM Cc1nc2c(cccc2-c2noc(-c3ccc4ccccc4c3[O-])n2)[nH]1 ZINC000436520099 1041301193 /nfs/dbraw/zinc/30/11/93/1041301193.db2.gz CSYZPJWNQYPPMS-UHFFFAOYSA-N -1 1 342.358 4.447 20 0 EIADMM CC(C)(C)c1coc(CNC[C@@H](CC(=O)[O-])C2CCCCCC2)n1 ZINC000904026182 1041303265 /nfs/dbraw/zinc/30/32/65/1041303265.db2.gz CPZXNFAQJXSPTF-OAHLLOKOSA-N -1 1 336.476 4.123 20 0 EIADMM CCC[C@H]1CCCN(C(=O)c2cc(Cl)c([O-])c(OCC)c2)C1 ZINC000436523434 1041308492 /nfs/dbraw/zinc/30/84/92/1041308492.db2.gz SMCLAUMBZJTWKW-LBPRGKRZSA-N -1 1 325.836 4.097 20 0 EIADMM CC[C@](C)(NC(=O)c1cc2ccccc2cc1[O-])c1nccs1 ZINC000436525275 1041309429 /nfs/dbraw/zinc/30/94/29/1041309429.db2.gz ALGHSUFFLAFALO-SFHVURJKSA-N -1 1 326.421 4.057 20 0 EIADMM Cc1ccccc1[C@H]1C[C@H](C)N(C(=O)c2cc(Cl)ccc2[O-])C1 ZINC000436528916 1041313011 /nfs/dbraw/zinc/31/30/11/1041313011.db2.gz MYDXWDVEWPKZAJ-KBPBESRZSA-N -1 1 329.827 4.372 20 0 EIADMM O=C(c1cc(Cl)ccc1[O-])N1CCC[C@@H](Cc2ccccc2)C1 ZINC000436554932 1041329317 /nfs/dbraw/zinc/32/93/17/1041329317.db2.gz KUQGEMBZYVOZDH-HNNXBMFYSA-N -1 1 329.827 4.141 20 0 EIADMM C[C@H]1CN(C(=O)c2ccc3ccccc3c2[O-])[C@@H](c2ccccc2)CO1 ZINC000436577318 1041343010 /nfs/dbraw/zinc/34/30/10/1041343010.db2.gz TVRSFVFKGKEEOT-MGPUTAFESA-N -1 1 347.414 4.148 20 0 EIADMM CCC(CC)c1cc(CNC(=O)c2cc3ccccc3cc2[O-])on1 ZINC000436562075 1041343318 /nfs/dbraw/zinc/34/33/18/1041343318.db2.gz IPJHOSDITYDYDE-UHFFFAOYSA-N -1 1 338.407 4.367 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N(Cc1ccccc1)CC(F)F ZINC000436572438 1041348855 /nfs/dbraw/zinc/34/88/55/1041348855.db2.gz GBAVLEABXUORRI-UHFFFAOYSA-N -1 1 341.357 4.453 20 0 EIADMM C[C@@H]1[C@@H](Cc2ccccc2)CCN1C(=O)c1cc(Cl)ccc1[O-] ZINC000436574225 1041352453 /nfs/dbraw/zinc/35/24/53/1041352453.db2.gz JOBRQRJSQNRCPG-UKRRQHHQSA-N -1 1 329.827 4.139 20 0 EIADMM O=C(N[C@H](c1nccs1)c1ccccc1)c1ccc(Cl)cc1[O-] ZINC000436597030 1041354069 /nfs/dbraw/zinc/35/40/69/1041354069.db2.gz SNIGBIHYKZFNGH-HNNXBMFYSA-N -1 1 344.823 4.022 20 0 EIADMM CN(Cc1c(F)cccc1F)C(=O)c1cc2ccccc2cc1[O-] ZINC000436662173 1041403699 /nfs/dbraw/zinc/40/36/99/1041403699.db2.gz FQHOKZPHSLWLQP-UHFFFAOYSA-N -1 1 327.330 4.096 20 0 EIADMM O=C(Nc1nc(C(F)(F)F)cs1)c1cc2ccccc2cc1[O-] ZINC000436675586 1041415928 /nfs/dbraw/zinc/41/59/28/1041415928.db2.gz LJLWHSALLUTEEB-UHFFFAOYSA-N -1 1 338.310 4.273 20 0 EIADMM CN(C)c1cccc([C@@H]2CCCN2C(=O)c2ccc(Cl)cc2[O-])c1 ZINC000436717951 1041441067 /nfs/dbraw/zinc/44/10/67/1041441067.db2.gz JCXRILFDBHCROH-KRWDZBQOSA-N -1 1 344.842 4.089 20 0 EIADMM COc1cccc([C@@H]2CCCN2C(=O)c2ccc(Cl)cc2[O-])c1 ZINC000436722873 1041444617 /nfs/dbraw/zinc/44/46/17/1041444617.db2.gz QCHVHEQFJYKABS-INIZCTEOSA-N -1 1 331.799 4.032 20 0 EIADMM CC(C)CCn1ncc(NC(=O)c2ccc([O-])cc2F)c1C(C)C ZINC000436734795 1041456139 /nfs/dbraw/zinc/45/61/39/1041456139.db2.gz AXQLODNPEFKAQA-UHFFFAOYSA-N -1 1 333.407 4.150 20 0 EIADMM C[C@H]1C[C@@H]1c1ccc(CN(C(=O)c2cc(F)ccc2[O-])C2CC2)o1 ZINC000436760135 1041458266 /nfs/dbraw/zinc/45/82/66/1041458266.db2.gz MOHUDANGMQTSGW-NHYWBVRUSA-N -1 1 329.371 4.053 20 0 EIADMM CCN(Cc1cccs1)C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436761834 1041460464 /nfs/dbraw/zinc/46/04/64/1041460464.db2.gz AALRZEAMSDVFMV-UHFFFAOYSA-N -1 1 329.343 4.135 20 0 EIADMM CCc1oc2ccccc2c1CN(C)C(=O)c1cc(F)ccc1[O-] ZINC000436755386 1041466884 /nfs/dbraw/zinc/46/68/84/1041466884.db2.gz LXRQFJRQOIPAPC-UHFFFAOYSA-N -1 1 327.355 4.112 20 0 EIADMM O=C(Nc1ccc(Cn2cccn2)cc1)c1ccc2ccccc2c1[O-] ZINC000436779108 1041471946 /nfs/dbraw/zinc/47/19/46/1041471946.db2.gz JLQQNVXDFANYNU-UHFFFAOYSA-N -1 1 343.386 4.043 20 0 EIADMM O=C(Nc1cccc(-c2cnco2)c1)c1ccc2ccccc2c1[O-] ZINC000436787832 1041482473 /nfs/dbraw/zinc/48/24/73/1041482473.db2.gz YVFNLYYYYLAPLL-UHFFFAOYSA-N -1 1 330.343 4.453 20 0 EIADMM CCSc1cccc(-c2noc(-c3ccc(OC)cc3[O-])n2)c1 ZINC000436787809 1041482551 /nfs/dbraw/zinc/48/25/51/1041482551.db2.gz YLUUWOCYOVJJDT-UHFFFAOYSA-N -1 1 328.393 4.230 20 0 EIADMM CCc1ccc(C(=O)N2CCCc3cc(OC(F)F)ccc32)c([O-])c1 ZINC000436805941 1041489311 /nfs/dbraw/zinc/48/93/11/1041489311.db2.gz FCABOIRJGPYKBW-UHFFFAOYSA-N -1 1 347.361 4.149 20 0 EIADMM CC(C)c1ccc(C(=O)Nc2cn(C)nc2-c2ccccc2)c([O-])c1 ZINC000436813879 1041493486 /nfs/dbraw/zinc/49/34/86/1041493486.db2.gz JBFVEVFPCYGJCJ-UHFFFAOYSA-N -1 1 335.407 4.168 20 0 EIADMM COc1ccc(C(=O)Nc2sc(-c3ccccc3)nc2C)c([O-])c1 ZINC000436831758 1041496095 /nfs/dbraw/zinc/49/60/95/1041496095.db2.gz GJSPDHRJBOUTQI-UHFFFAOYSA-N -1 1 340.404 4.085 20 0 EIADMM Cc1sc(CNC(=O)c2ccc3ccccc3c2[O-])nc1C(C)C ZINC000436840843 1041508398 /nfs/dbraw/zinc/50/83/98/1041508398.db2.gz SDVPNOIXGUUMFH-UHFFFAOYSA-N -1 1 340.448 4.364 20 0 EIADMM CN(Cc1cc(F)c(F)c(F)c1)C(=O)c1ccc2ccccc2c1[O-] ZINC000436846188 1041511352 /nfs/dbraw/zinc/51/13/52/1041511352.db2.gz BESXRNPXBXJUEW-UHFFFAOYSA-N -1 1 345.320 4.235 20 0 EIADMM Cc1cccc([C@H]2CCN(C(=O)c3cc4ccccc4cc3[O-])C2)c1 ZINC000436850524 1041517037 /nfs/dbraw/zinc/51/70/37/1041517037.db2.gz IFWZPTKQHJYJFG-IBGZPJMESA-N -1 1 331.415 4.484 20 0 EIADMM O=C(c1ccc([O-])cc1F)N1CCC[C@H]1Cc1ccccc1Cl ZINC000436870112 1041527072 /nfs/dbraw/zinc/52/70/72/1041527072.db2.gz ONOIKKGPHQNIBG-ZDUSSCGKSA-N -1 1 333.790 4.032 20 0 EIADMM COc1ccc(-c2nc(-c3ccc([O-])c(F)c3)no2)c(OC(C)C)c1 ZINC000436869516 1041527770 /nfs/dbraw/zinc/52/77/70/1041527770.db2.gz AZBJVNKZDXPZER-UHFFFAOYSA-N -1 1 344.342 4.044 20 0 EIADMM Cc1nc(CC(C)C)oc1-c1nc(-c2ccc([O-])cc2Cl)no1 ZINC000436873300 1041530006 /nfs/dbraw/zinc/53/00/06/1041530006.db2.gz ZRVGMAGYCUDSHK-UHFFFAOYSA-N -1 1 333.775 4.258 20 0 EIADMM [O-]c1ccc(-c2noc(-c3ccccc3OC3CC3)n2)c(Cl)c1 ZINC000436870694 1041530261 /nfs/dbraw/zinc/53/02/61/1041530261.db2.gz IAUDNLIKTZUSQI-UHFFFAOYSA-N -1 1 328.755 4.304 20 0 EIADMM C[C@H](OCc1ccccc1)c1nc(-c2ccc([O-])cc2Cl)no1 ZINC000436873320 1041530353 /nfs/dbraw/zinc/53/03/53/1041530353.db2.gz PDMZXQIPCPNNKL-NSHDSACASA-N -1 1 330.771 4.373 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N1CC=C(c2c(F)cccc2F)CC1 ZINC000436873061 1041530504 /nfs/dbraw/zinc/53/05/04/1041530504.db2.gz RETLKYWWPWMPKB-UHFFFAOYSA-N -1 1 349.764 4.253 20 0 EIADMM O=C(N[C@@H]1CCCC[C@@H]1Cc1ccccc1)c1ccc([O-])cc1F ZINC000436880626 1041539619 /nfs/dbraw/zinc/53/96/19/1041539619.db2.gz KHBWVKZCAODJNB-DNVCBOLYSA-N -1 1 327.399 4.063 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1CCC(CC(F)(F)F)CC1 ZINC000436888348 1041542566 /nfs/dbraw/zinc/54/25/66/1041542566.db2.gz TXPZUBGBORBLFK-UHFFFAOYSA-N -1 1 337.341 4.350 20 0 EIADMM O=C(c1ccc(C(F)(F)F)cc1[O-])N1CC2(CCC2)c2ccccc21 ZINC000436889552 1041543993 /nfs/dbraw/zinc/54/39/93/1041543993.db2.gz QYHFYJIQJZCFDN-UHFFFAOYSA-N -1 1 347.336 4.493 20 0 EIADMM COc1ccc(N(CCC(C)C)C(=O)c2ccc(OC)cc2[O-])cc1 ZINC000436909470 1041548958 /nfs/dbraw/zinc/54/89/58/1041548958.db2.gz LUPPNLPGZGTZJI-UHFFFAOYSA-N -1 1 343.423 4.102 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N1CCC[C@H]1/C=C\c1ccccc1 ZINC000436902162 1041554369 /nfs/dbraw/zinc/55/43/69/1041554369.db2.gz OTVWXSZRLZVTIZ-YHWKNFMLSA-N -1 1 327.811 4.364 20 0 EIADMM COc1cc(C)c(NC(=O)c2ccc(C(F)(F)F)cc2[O-])cc1F ZINC000436932458 1041564138 /nfs/dbraw/zinc/56/41/38/1041564138.db2.gz CKPLWTHFLIVZDO-UHFFFAOYSA-N -1 1 343.276 4.119 20 0 EIADMM O=C1CCCCc2cc(-c3nc(-c4ccc([O-])cc4F)no3)ccc21 ZINC000436954269 1041573855 /nfs/dbraw/zinc/57/38/55/1041573855.db2.gz GAPWODWIMPQEPF-UHFFFAOYSA-N -1 1 338.338 4.157 20 0 EIADMM [O-]c1ccc(-c2noc(-c3nc4ccccc4cc3Cl)n2)cc1F ZINC000436956186 1041574574 /nfs/dbraw/zinc/57/45/74/1041574574.db2.gz POZNPTAEAYQBLD-UHFFFAOYSA-N -1 1 341.729 4.450 20 0 EIADMM CCOCc1ccc(CNC(=O)c2ccc3ccccc3c2[O-])cc1 ZINC000436989188 1041583144 /nfs/dbraw/zinc/58/31/44/1041583144.db2.gz ZCEZDTGSPCPYRV-UHFFFAOYSA-N -1 1 335.403 4.012 20 0 EIADMM C[C@H](NC(=O)c1c([O-])cccc1F)c1ccc(-c2cccnc2)cc1 ZINC000436988525 1041583641 /nfs/dbraw/zinc/58/36/41/1041583641.db2.gz LNZPGPUVAVGFJR-ZDUSSCGKSA-N -1 1 336.366 4.084 20 0 EIADMM O=C(c1cc(Cl)ccc1[O-])N(Cc1c(F)cccc1F)C1CC1 ZINC000436994244 1041585038 /nfs/dbraw/zinc/58/50/38/1041585038.db2.gz BEKNJSJWIXVZBA-UHFFFAOYSA-N -1 1 337.753 4.129 20 0 EIADMM Cc1cc2[nH]ncc2cc1NC(=O)c1c([O-])cc(Cl)cc1Cl ZINC000437006836 1041590851 /nfs/dbraw/zinc/59/08/51/1041590851.db2.gz WCKXOBIOCXDJPU-UHFFFAOYSA-N -1 1 336.178 4.136 20 0 EIADMM COc1ccc([C@@H](C)NC(=O)c2ccc3ccccc3c2[O-])cc1F ZINC000437005744 1041590945 /nfs/dbraw/zinc/59/09/45/1041590945.db2.gz UBXFCXGJJZGXJO-GFCCVEGCSA-N -1 1 339.366 4.184 20 0 EIADMM Cc1cc([N-]S(=O)(=O)c2cccc(F)c2C)c2cccnc2c1C ZINC000437330106 1041761910 /nfs/dbraw/zinc/76/19/10/1041761910.db2.gz RLHJSUGTAJSUNU-UHFFFAOYSA-N -1 1 344.411 4.100 20 0 EIADMM Cc1ccc([C@@H]2CCN(C(=O)c3ccc4ccccc4c3[O-])C2)cc1 ZINC000541479944 1041959163 /nfs/dbraw/zinc/95/91/63/1041959163.db2.gz DBQYPWQMAMNAOA-GOSISDBHSA-N -1 1 331.415 4.484 20 0 EIADMM O=c1cc(C(F)F)nc(SCc2csc(-c3ccoc3)n2)[n-]1 ZINC000517547945 1042075994 /nfs/dbraw/zinc/07/59/94/1042075994.db2.gz DCSZMKWVFTWPJA-UHFFFAOYSA-N -1 1 341.364 4.129 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccccc2SC(F)F)c(C)c1 ZINC000007055893 1042143997 /nfs/dbraw/zinc/14/39/97/1042143997.db2.gz PQCGTKUCSGKJFN-UHFFFAOYSA-N -1 1 343.420 4.419 20 0 EIADMM O=S(=O)([N-]c1cccc(CC(F)(F)F)c1)c1ccc(Cl)cc1 ZINC000438763071 1042337028 /nfs/dbraw/zinc/33/70/28/1042337028.db2.gz FPCUENBYBZLUDQ-UHFFFAOYSA-N -1 1 349.761 4.246 20 0 EIADMM Cc1ccc(C)c(S(=O)(=O)[N-]c2cccc(CC(F)(F)F)c2)c1 ZINC000438767849 1042339369 /nfs/dbraw/zinc/33/93/69/1042339369.db2.gz BAMDOQQTHBXMTL-UHFFFAOYSA-N -1 1 343.370 4.209 20 0 EIADMM CCCc1ccccc1[N-]S(=O)(=O)c1ccc(C(=O)C(C)C)cc1 ZINC000438811611 1042359364 /nfs/dbraw/zinc/35/93/64/1042359364.db2.gz ZWCGGNNURFDEFN-UHFFFAOYSA-N -1 1 345.464 4.279 20 0 EIADMM CC[C@H](c1nnc(NC(=O)c2ccccc2[O-])s1)c1ccccc1 ZINC000303283143 1042389528 /nfs/dbraw/zinc/38/95/28/1042389528.db2.gz JEUYKSPAKYICHK-ZDUSSCGKSA-N -1 1 339.420 4.038 20 0 EIADMM CC[C@H](C)c1ccc(S(=O)(=O)[N-]c2ccccc2N(C)C)cc1 ZINC000518332358 1042474055 /nfs/dbraw/zinc/47/40/55/1042474055.db2.gz USGFZIQLASDBCI-AWEZNQCLSA-N -1 1 332.469 4.067 20 0 EIADMM CC(C)c1cccc(S(=O)(=O)[N-]c2cccc(-c3cnco3)c2)c1 ZINC000172887292 1042508831 /nfs/dbraw/zinc/50/88/31/1042508831.db2.gz IHVSZXMWHJXJBN-UHFFFAOYSA-N -1 1 342.420 4.266 20 0 EIADMM CCc1onc(C)c1[N-]C(=O)c1cnc(-c2c(F)cccc2F)s1 ZINC001127257992 1042663854 /nfs/dbraw/zinc/66/38/54/1042663854.db2.gz OGOFFHMNSZQLLV-UHFFFAOYSA-N -1 1 349.362 4.199 20 0 EIADMM Cc1coc(-c2ccc(C)c([N-]S(=O)(=O)c3cccc(C)c3)c2)n1 ZINC000178037744 1042856872 /nfs/dbraw/zinc/85/68/72/1042856872.db2.gz OVYCSDPZCWTKMC-UHFFFAOYSA-N -1 1 342.420 4.068 20 0 EIADMM COc1cc(/C=C2\C(=O)Nc3ccc(Cl)cc32)cc(Cl)c1[O-] ZINC000111676723 1042873204 /nfs/dbraw/zinc/87/32/04/1042873204.db2.gz DOLQYDUVKWKDAE-WCIBSUBMSA-N -1 1 336.174 4.200 20 0 EIADMM CC1(C)CN(C(=O)c2cc(Cl)ccc2[O-])CC[C@H]1C(F)(F)F ZINC000190671856 1042942723 /nfs/dbraw/zinc/94/27/23/1042942723.db2.gz ZFSQSNXQSOANLV-GFCCVEGCSA-N -1 1 335.753 4.096 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccccc2-c2ccccc2)cc1N ZINC000391748913 1043018298 /nfs/dbraw/zinc/01/82/98/1043018298.db2.gz XOJYAMQFCWFVBF-UHFFFAOYSA-N -1 1 338.432 4.045 20 0 EIADMM CC[C@H](O[C@@H]1CCC[C@@H](C)C1)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000509167246 1043158251 /nfs/dbraw/zinc/15/82/51/1043158251.db2.gz DCNANQXAVWYVAL-KFNAQCHYSA-N -1 1 325.836 4.358 20 0 EIADMM CCOc1cc(C(=O)Nc2cccc(Cl)c2)cc(Cl)c1[O-] ZINC000215913638 1043168798 /nfs/dbraw/zinc/16/87/98/1043168798.db2.gz KFAUNKFONUCFCM-UHFFFAOYSA-N -1 1 326.179 4.350 20 0 EIADMM COc1cc(CN(C)Cc2cccc([O-])c2Cl)ccc1SC ZINC000507920377 1043189875 /nfs/dbraw/zinc/18/98/75/1043189875.db2.gz UTWOSGRJVIULQW-UHFFFAOYSA-N -1 1 337.872 4.408 20 0 EIADMM [O-]c1c(F)cc(Nc2ccc(Br)cc2CO)cc1Cl ZINC001214488923 1043190269 /nfs/dbraw/zinc/19/02/69/1043190269.db2.gz QGEIYUGPTZSAFA-UHFFFAOYSA-N -1 1 346.583 4.183 20 0 EIADMM Cc1ccc(Cl)cc1[N-]S(=O)(=O)c1c(C)ccc2ncccc21 ZINC000673982780 1043233438 /nfs/dbraw/zinc/23/34/38/1043233438.db2.gz PCWCTJNOXNFUJT-UHFFFAOYSA-N -1 1 346.839 4.306 20 0 EIADMM Cc1cc(C(=O)Nc2ccc(F)cc2[O-])c(C)cc1Br ZINC000508093810 1043268293 /nfs/dbraw/zinc/26/82/93/1043268293.db2.gz FQTCEOBRFAJUME-UHFFFAOYSA-N -1 1 338.176 4.163 20 0 EIADMM CCc1ccccc1S(=O)(=O)[N-]c1ccc(-c2cnc(C)o2)cc1 ZINC000187237085 1043336086 /nfs/dbraw/zinc/33/60/86/1043336086.db2.gz YWJSZADREAUXRO-UHFFFAOYSA-N -1 1 342.420 4.013 20 0 EIADMM Cc1ccccc1C(=O)COC(=O)c1ccc(Cl)c(Cl)c1[O-] ZINC000730360393 1043503503 /nfs/dbraw/zinc/50/35/03/1043503503.db2.gz UJKBKUXQECORNB-UHFFFAOYSA-N -1 1 339.174 4.047 20 0 EIADMM Cc1ccccc1C(F)(F)C(=O)[N-]Cc1cc(F)c(Cl)cc1F ZINC001128678033 1043507739 /nfs/dbraw/zinc/50/77/39/1043507739.db2.gz GBVVPONJQOPGPR-UHFFFAOYSA-N -1 1 345.723 4.335 20 0 EIADMM CCc1oc2ccccc2c1CN(C)C(=O)c1ccc([O-])c(F)c1 ZINC000681015674 1043649561 /nfs/dbraw/zinc/64/95/61/1043649561.db2.gz KCWDOAYUFABNEG-UHFFFAOYSA-N -1 1 327.355 4.112 20 0 EIADMM COc1ccc(Cl)cc1NC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000190910695 1043750651 /nfs/dbraw/zinc/75/06/51/1043750651.db2.gz ZHBQAOAWMKIINA-UHFFFAOYSA-N -1 1 327.167 4.352 20 0 EIADMM COc1cc(C(=O)N(C)CCCCc2ccccc2)cc(Cl)c1[O-] ZINC000442733901 1043820497 /nfs/dbraw/zinc/82/04/97/1043820497.db2.gz QQIBGSMLHGPDHN-UHFFFAOYSA-N -1 1 347.842 4.149 20 0 EIADMM Cc1cccc2nc(-c3ccc(Oc4cccnc4)cc3)[n-]c(=O)c12 ZINC000521677518 1043887624 /nfs/dbraw/zinc/88/76/24/1043887624.db2.gz CTUCEFVYJZLECM-UHFFFAOYSA-N -1 1 329.359 4.086 20 0 EIADMM Cc1ccnn1-c1ccccc1NC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000192266079 1043897306 /nfs/dbraw/zinc/89/73/06/1043897306.db2.gz LBZJOSGDLKXQAW-UHFFFAOYSA-N -1 1 342.786 4.184 20 0 EIADMM Cc1c(F)c(C(F)(F)F)ccc1C(=O)Nc1ccc(F)cc1[O-] ZINC000443065428 1043984321 /nfs/dbraw/zinc/98/43/21/1043984321.db2.gz QJTLSQIQGAKRHW-UHFFFAOYSA-N -1 1 331.240 4.250 20 0 EIADMM CCCOc1ccc(NC(=O)c2cc(Cl)c([O-])c(OC)c2)cc1 ZINC000443119961 1044035004 /nfs/dbraw/zinc/03/50/04/1044035004.db2.gz UFQYMPDIWCAHKV-UHFFFAOYSA-N -1 1 335.787 4.095 20 0 EIADMM Cc1nc2c(s1)[C@H]([N@@H+](C)Cc1cc(C(=O)[O-])sc1C)CCC2 ZINC000522007582 1044152399 /nfs/dbraw/zinc/15/23/99/1044152399.db2.gz GCGITVREPYPXRG-CYBMUJFWSA-N -1 1 336.482 4.029 20 0 EIADMM CCC[C@H]1[C@H](C)CCCN1C(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC000443278215 1044154757 /nfs/dbraw/zinc/15/47/57/1044154757.db2.gz DGKQQDKKGKYNDA-RISCZKNCSA-N -1 1 325.836 4.095 20 0 EIADMM CC(C)[C@H]1CCCN(C(=O)c2cc(Br)ccc2[O-])CC1 ZINC000227003788 1044331895 /nfs/dbraw/zinc/33/18/95/1044331895.db2.gz HTFYRBPJEGKRKF-LBPRGKRZSA-N -1 1 340.261 4.053 20 0 EIADMM C[C@@H](Oc1ccc(Cl)c(Cl)c1)C(=O)Nc1c([O-])cccc1F ZINC000608365631 1044371691 /nfs/dbraw/zinc/37/16/91/1044371691.db2.gz OXHDZXQRUDSWKL-MRVPVSSYSA-N -1 1 344.169 4.244 20 0 EIADMM O=C(Nc1c([O-])cccc1F)c1ccc(Cl)cc1Br ZINC000675523311 1044374573 /nfs/dbraw/zinc/37/45/73/1044374573.db2.gz LKGAMAPTIDPGHN-UHFFFAOYSA-N -1 1 344.567 4.200 20 0 EIADMM Cc1ccc([C@H]2CCN(C(=O)c3ccc(C(F)(F)F)cc3[O-])C2)cc1 ZINC000543365015 1044423664 /nfs/dbraw/zinc/42/36/64/1044423664.db2.gz ATWJKXMWWMZIJM-AWEZNQCLSA-N -1 1 349.352 4.349 20 0 EIADMM CCCC[C@H](CC)CC(=O)N1CCC(C(=O)c2ccc([O-])cc2)CC1 ZINC000117411962 1044442135 /nfs/dbraw/zinc/44/21/35/1044442135.db2.gz WMHNUCULZGBYDS-INIZCTEOSA-N -1 1 345.483 4.420 20 0 EIADMM O=C(Cc1ccc(Br)s1)Nc1ccc([O-])c(Cl)c1 ZINC000114559745 1044826042 /nfs/dbraw/zinc/82/60/42/1044826042.db2.gz RYARUYACFLSVNQ-UHFFFAOYSA-N -1 1 346.633 4.051 20 0 EIADMM O=C([O-])C[C@@H](NCc1cc(Cl)sc1Cl)c1cccs1 ZINC000312582847 1044827687 /nfs/dbraw/zinc/82/76/87/1044827687.db2.gz NHVVDPQKDRICHZ-MRVPVSSYSA-N -1 1 336.265 4.422 20 0 EIADMM CC[C@]1(C(=O)[O-])CCCN(Cc2csc(C3CCCCC3)n2)C1 ZINC000923470251 1045119025 /nfs/dbraw/zinc/11/90/25/1045119025.db2.gz KDDMFZCIBPZZCE-SFHVURJKSA-N -1 1 336.501 4.268 20 0 EIADMM CC[C@@]1(C(=O)[O-])CCCN(Cc2ccc(Cl)c(C(F)(F)F)c2)C1 ZINC000923469101 1045125177 /nfs/dbraw/zinc/12/51/77/1045125177.db2.gz HDTSXVHSEKVYOM-OAHLLOKOSA-N -1 1 349.780 4.436 20 0 EIADMM C[C@H](Sc1nc2ccccc2s1)C(=O)Nc1ccc(F)cc1[O-] ZINC000763115339 1045508799 /nfs/dbraw/zinc/50/87/99/1045508799.db2.gz ACVXDPFDDJEZSG-VIFPVBQESA-N -1 1 348.424 4.260 20 0 EIADMM Cc1ccc(-c2nc(C(=O)[N-]c3nnc(C(C)(C)C)s3)cs2)o1 ZINC000055977143 1045770025 /nfs/dbraw/zinc/77/00/25/1045770025.db2.gz WWHFHCVFODQIAQ-UHFFFAOYSA-N -1 1 348.453 4.113 20 0 EIADMM Cc1ccc([C@H]2CCCCN2C(=O)c2nc3ccccc3c(=O)[n-]2)cc1 ZINC000075488587 1045829509 /nfs/dbraw/zinc/82/95/09/1045829509.db2.gz SJXOCTVVDRJANT-GOSISDBHSA-N -1 1 347.418 4.011 20 0 EIADMM O=C(OCc1nc(-c2ccccc2)cs1)c1ccc([O-])cc1F ZINC000768833050 1045848028 /nfs/dbraw/zinc/84/80/28/1045848028.db2.gz IEXVOLFVXVZMOD-UHFFFAOYSA-N -1 1 329.352 4.012 20 0 EIADMM Cc1nc2ccc([N-]S(=O)(=O)c3ccc(C(C)(C)C)cc3)cc2o1 ZINC000074838604 1046000925 /nfs/dbraw/zinc/00/09/25/1046000925.db2.gz JVRBZRHDJVRWNK-UHFFFAOYSA-N -1 1 344.436 4.235 20 0 EIADMM O=C(NCc1ccsc1C(F)(F)F)c1cc(Cl)ccc1[O-] ZINC001170309628 1046008066 /nfs/dbraw/zinc/00/80/66/1046008066.db2.gz AEBNWEZCIHXPMS-UHFFFAOYSA-N -1 1 335.734 4.056 20 0 EIADMM C[C@H](c1ccc(F)c(F)c1)N(C)C(=O)c1c([O-])cccc1Cl ZINC000769636763 1046029335 /nfs/dbraw/zinc/02/93/35/1046029335.db2.gz IPIRHUBAYLZGDJ-SECBINFHSA-N -1 1 325.742 4.157 20 0 EIADMM CCN(C(=O)c1c([O-])cccc1Cl)[C@H](C)Cc1ccc(OC)cc1 ZINC000769787658 1046071962 /nfs/dbraw/zinc/07/19/62/1046071962.db2.gz BPEFLCKYAADTJV-CYBMUJFWSA-N -1 1 347.842 4.148 20 0 EIADMM COc1cc(C(C)=O)c(Nc2c(Cl)ccc([O-])c2F)cc1F ZINC001214565011 1046117488 /nfs/dbraw/zinc/11/74/88/1046117488.db2.gz SHYJVNANHFHYFM-UHFFFAOYSA-N -1 1 327.714 4.279 20 0 EIADMM CCN(C(=O)c1ncccc1[O-])[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000124098079 1046216257 /nfs/dbraw/zinc/21/62/57/1046216257.db2.gz KECRNXUHODMNLF-LLVKDONJSA-N -1 1 338.329 4.029 20 0 EIADMM CCc1cc(=O)[n-]c(S[C@@H](C)C(=O)c2ccc(C(C)(C)C)cc2)n1 ZINC000428698452 1046563001 /nfs/dbraw/zinc/56/30/01/1046563001.db2.gz DZXJYTAIABRBLK-LBPRGKRZSA-N -1 1 344.480 4.406 20 0 EIADMM CCc1cc(=O)[nH]c(C[NH2+][C@@H](C)c2ccc(Oc3ccccc3)cc2)n1 ZINC000537060731 1046909717 /nfs/dbraw/zinc/90/97/17/1046909717.db2.gz PFQHKHPWILPJGW-HNNXBMFYSA-N -1 1 349.434 4.388 20 0 EIADMM O=c1[nH]c(-c2ccc([O-])c(F)c2)nc2ccc(-c3ccccc3)cc12 ZINC000128663169 1047012510 /nfs/dbraw/zinc/01/25/10/1047012510.db2.gz GQPVRFNJYQJLDQ-UHFFFAOYSA-N -1 1 332.334 4.102 20 0 EIADMM Cc1cccc(S(=O)(=O)[N-]c2cccc(Cl)c2F)c1Cl ZINC000537197959 1047020275 /nfs/dbraw/zinc/02/02/75/1047020275.db2.gz OOPIGFRCESVAOK-UHFFFAOYSA-N -1 1 334.199 4.242 20 0 EIADMM Cc1nc(C(C)C)[n-]c(=O)c1C(=O)N1CCCC2(CCCCC2)CC1 ZINC000787518082 1047025844 /nfs/dbraw/zinc/02/58/44/1047025844.db2.gz AKTHOHRKAUSFKS-UHFFFAOYSA-N -1 1 345.487 4.191 20 0 EIADMM Cc1nc(SCc2coc(-c3ccc(Cl)cc3)n2)[n-]c(=O)c1C ZINC000537413464 1047205048 /nfs/dbraw/zinc/20/50/48/1047205048.db2.gz NLACHQFKJRDBGR-UHFFFAOYSA-N -1 1 347.827 4.400 20 0 EIADMM O=S(=O)([N-]c1cccc2ccccc21)C1=Cc2ccccc2OC1 ZINC000788735785 1047299921 /nfs/dbraw/zinc/29/99/21/1047299921.db2.gz MTOSBYRNORITON-UHFFFAOYSA-N -1 1 337.400 4.015 20 0 EIADMM Cc1cc(C(=O)Nc2ccc([O-])c(Cl)c2)c(C)n1-c1nccs1 ZINC000129540643 1047422250 /nfs/dbraw/zinc/42/22/50/1047422250.db2.gz MUMKSLHJEKBGAC-UHFFFAOYSA-N -1 1 347.827 4.162 20 0 EIADMM Cc1nc(SCc2cnc(-c3ccccc3)o2)[n-]c(=O)c1C1CC1 ZINC000918464044 1047452890 /nfs/dbraw/zinc/45/28/90/1047452890.db2.gz WNMMQKJSVCDCKZ-UHFFFAOYSA-N -1 1 339.420 4.315 20 0 EIADMM CCC(=O)Nc1ccc(C)c(NC(=O)c2ccc3ccccc3c2[O-])c1 ZINC000129723276 1047494950 /nfs/dbraw/zinc/49/49/50/1047494950.db2.gz BVSSPIHLLBLHRK-UHFFFAOYSA-N -1 1 348.402 4.455 20 0 EIADMM COc1ccc(C(C)(C)CNC(=O)c2cc3ccccc3cc2[O-])cc1 ZINC001142531831 1047549110 /nfs/dbraw/zinc/54/91/10/1047549110.db2.gz MLHXGVWGEBYDTQ-UHFFFAOYSA-N -1 1 349.430 4.262 20 0 EIADMM C/C(=C/C(=O)Nc1c([O-])cc(Br)cc1Cl)C1CC1 ZINC000808113053 1047607568 /nfs/dbraw/zinc/60/75/68/1047607568.db2.gz VOJDSBUYAGYEDI-DAXSKMNVSA-N -1 1 330.609 4.103 20 0 EIADMM CC(C)[C@@H]1CCCN(C(=O)c2ccc(Br)cc2[O-])CC1 ZINC000071029353 1047707850 /nfs/dbraw/zinc/70/78/50/1047707850.db2.gz MTGCACAQROBKSP-GFCCVEGCSA-N -1 1 340.261 4.053 20 0 EIADMM C[C@@H]1c2ccc(Cl)n2CCN1C(=O)c1ccc2ccccc2c1[O-] ZINC000808254004 1047849323 /nfs/dbraw/zinc/84/93/23/1047849323.db2.gz ASZOFFQHUPKIGA-GFCCVEGCSA-N -1 1 340.810 4.217 20 0 EIADMM Cc1ccc(N2CCCC2)c(-c2nc(-c3ccc([O-])c(F)c3)no2)c1 ZINC000809470333 1048365246 /nfs/dbraw/zinc/36/52/46/1048365246.db2.gz BEJVTYDMWMDXHU-UHFFFAOYSA-N -1 1 339.370 4.157 20 0 EIADMM CCC[C@H](NC(=O)c1ccc(C(F)(F)F)cc1[O-])C1CCCC1 ZINC001299225600 1048651897 /nfs/dbraw/zinc/65/18/97/1048651897.db2.gz VDBPHAVZWVPJID-AWEZNQCLSA-N -1 1 329.362 4.500 20 0 EIADMM O=C(NCCCSc1ccc(F)cc1)c1c([O-])cccc1Cl ZINC000920428181 1048679148 /nfs/dbraw/zinc/67/91/48/1048679148.db2.gz CXTKDXMKADLINL-UHFFFAOYSA-N -1 1 339.819 4.097 20 0 EIADMM O=C(NCCc1cccc(Cl)c1)c1ccc(C(F)(F)F)c([O-])c1 ZINC001135443923 1048722239 /nfs/dbraw/zinc/72/22/39/1048722239.db2.gz DRKRMSRXTVPUTD-UHFFFAOYSA-N -1 1 343.732 4.037 20 0 EIADMM Cc1cccc(OC2CCN(Cc3c(F)cc([O-])cc3F)CC2)c1 ZINC001144559603 1048727386 /nfs/dbraw/zinc/72/73/86/1048727386.db2.gz OKGADCKSEBZZIN-UHFFFAOYSA-N -1 1 333.378 4.022 20 0 EIADMM CCC[C@H](C(=O)c1ccccc1)N(C)Cc1c(F)cc([O-])cc1F ZINC001144562088 1048731102 /nfs/dbraw/zinc/73/11/02/1048731102.db2.gz YFDMKJVVKSNVJO-GOSISDBHSA-N -1 1 333.378 4.154 20 0 EIADMM CCOc1ccc([C@H]2CCCN2Cc2cc(F)c([O-])cc2F)cc1 ZINC001144657913 1048777191 /nfs/dbraw/zinc/77/71/91/1048777191.db2.gz MWTRJAPLTTXEGY-GOSISDBHSA-N -1 1 333.378 4.406 20 0 EIADMM Cc1cc([C@@H]2CCCN2Cc2c3ccccc3sc2C(=O)[O-])no1 ZINC000846236606 1048845413 /nfs/dbraw/zinc/84/54/13/1048845413.db2.gz UXVLHIVJWSDXFZ-HNNXBMFYSA-N -1 1 342.420 4.233 20 0 EIADMM CCOc1ccc(NC(=O)c2ccc(C(F)(F)F)cc2[O-])cc1 ZINC001135674159 1048855790 /nfs/dbraw/zinc/85/57/90/1048855790.db2.gz MWZWUEGPVBMSCM-UHFFFAOYSA-N -1 1 325.286 4.062 20 0 EIADMM O=C(Nc1ccc(-n2cnc3ccccc32)cc1)c1cc(F)ccc1[O-] ZINC001135699814 1048863403 /nfs/dbraw/zinc/86/34/03/1048863403.db2.gz VGNOBQRZLJPLGK-UHFFFAOYSA-N -1 1 347.349 4.123 20 0 EIADMM CN(C(=O)c1ccc2ccc(O)cc2c1[O-])C(C)(C)c1ccccc1 ZINC001145054863 1048985230 /nfs/dbraw/zinc/98/52/30/1048985230.db2.gz KMCRAKWEQQJBML-UHFFFAOYSA-N -1 1 335.403 4.258 20 0 EIADMM CCN(CCCNC(=O)c1ccc2ccccc2c1[O-])c1ccccc1 ZINC001135948184 1049010443 /nfs/dbraw/zinc/01/04/43/1049010443.db2.gz IXMGVRKBPMDXJP-UHFFFAOYSA-N -1 1 348.446 4.192 20 0 EIADMM O=C(Nc1ccc(-c2cn3ccccc3n2)cc1)c1ccc([O-])cc1F ZINC001136007574 1049036543 /nfs/dbraw/zinc/03/65/43/1049036543.db2.gz GVZSOQKNZIZAHI-UHFFFAOYSA-N -1 1 347.349 4.098 20 0 EIADMM CC(C)(C)[C@H]1OCCC[C@@H]1CNC(=O)c1ccc2ccccc2c1[O-] ZINC001146821399 1049057255 /nfs/dbraw/zinc/05/72/55/1049057255.db2.gz CTIUQCIRQRPKRH-BEFAXECRSA-N -1 1 341.451 4.117 20 0 EIADMM O=C(N[C@H](c1cccs1)C1CC1)c1ccc(C(F)(F)F)cc1[O-] ZINC001136055622 1049059287 /nfs/dbraw/zinc/05/92/87/1049059287.db2.gz QJDDGXYQEQCFIC-AWEZNQCLSA-N -1 1 341.354 4.354 20 0 EIADMM Cc1ccc2c(c1)[C@@H](NC(=O)c1ccc3ccc(O)cc3c1[O-])[C@H](C)C2 ZINC001147341949 1049130405 /nfs/dbraw/zinc/13/04/05/1049130405.db2.gz YBRXQWJWALOMFA-XCLFUZPHSA-N -1 1 347.414 4.223 20 0 EIADMM CC[C@@H](C)c1ccc([C@H](NC(=O)c2cncc([O-])c2)C(C)C)cc1 ZINC001136136768 1049146579 /nfs/dbraw/zinc/14/65/79/1049146579.db2.gz UAWGWEUJWDELMZ-AUUYWEPGSA-N -1 1 326.440 4.428 20 0 EIADMM O=C(N[C@H](c1ccccc1)C1CC1)c1ccc2ccc(O)cc2c1[O-] ZINC001136149589 1049179364 /nfs/dbraw/zinc/17/93/64/1049179364.db2.gz QMKUPNCBAHREHF-LJQANCHMSA-N -1 1 333.387 4.132 20 0 EIADMM CC(=O)c1ccc(OCCCC(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000135907099 1049291382 /nfs/dbraw/zinc/29/13/82/1049291382.db2.gz SSQREOPIDULGJZ-UHFFFAOYSA-N -1 1 347.798 4.046 20 0 EIADMM CC1(C)C[C@]1(CNC(=O)Cc1ccc([O-])c(Cl)c1)c1ccccc1 ZINC001148588943 1049341737 /nfs/dbraw/zinc/34/17/37/1049341737.db2.gz ZPDXLWLXIVCWFE-FQEVSTJZSA-N -1 1 343.854 4.072 20 0 EIADMM CCN(CC)c1ccc(NC(=O)c2cc3ccccc3cc2[O-])cn1 ZINC001136255418 1049358690 /nfs/dbraw/zinc/35/86/90/1049358690.db2.gz SSIDNDJYUMDTMU-UHFFFAOYSA-N -1 1 335.407 4.039 20 0 EIADMM O=C(NCc1cnc(-c2ccccc2)s1)c1ccc(Cl)cc1[O-] ZINC001148793793 1049381244 /nfs/dbraw/zinc/38/12/44/1049381244.db2.gz TVCIRPIJLNTMNT-UHFFFAOYSA-N -1 1 344.823 4.099 20 0 EIADMM CCOc1ccc(C)cc1NC(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC001148800272 1049382919 /nfs/dbraw/zinc/38/29/19/1049382919.db2.gz CESWORRAHAPALW-UHFFFAOYSA-N -1 1 339.313 4.370 20 0 EIADMM COC(C)(C)[C@@H]1CCCN1C(=O)c1cccc(-c2ccccc2)c1[O-] ZINC001148866701 1049389801 /nfs/dbraw/zinc/38/98/01/1049389801.db2.gz NJBTYMLPWDLDLM-SFHVURJKSA-N -1 1 339.435 4.089 20 0 EIADMM O=C(c1cccc(-c2ccccc2)c1[O-])N1CCC[C@@H]1c1ccccn1 ZINC001148866891 1049391199 /nfs/dbraw/zinc/39/11/99/1049391199.db2.gz RAZWFHDFZGAGOY-HXUWFJFHSA-N -1 1 344.414 4.432 20 0 EIADMM C[C@H](CCCC(C)(C)O)NC(=O)c1cccc(-c2ccccc2)c1[O-] ZINC001148873316 1049393560 /nfs/dbraw/zinc/39/35/60/1049393560.db2.gz SNKFHBRGVBQZDT-OAHLLOKOSA-N -1 1 341.451 4.119 20 0 EIADMM Cc1cc(C(=O)Nc2ccc(-c3cc(=O)[nH][n-]3)cc2)c(Cl)cc1F ZINC000348200087 1049491217 /nfs/dbraw/zinc/49/12/17/1049491217.db2.gz JQNDYTWSTXVAFA-UHFFFAOYSA-N -1 1 345.761 4.136 20 0 EIADMM CC(C)c1ccc(C(=O)Nc2nnc(-c3ccccc3)s2)c([O-])c1 ZINC001136359031 1049529912 /nfs/dbraw/zinc/52/99/12/1049529912.db2.gz OWQHTCULNXZIEY-UHFFFAOYSA-N -1 1 339.420 4.286 20 0 EIADMM O=C(Nc1ccc(Oc2ccncc2)c(Cl)c1)c1ccccc1[O-] ZINC001136569887 1049752328 /nfs/dbraw/zinc/75/23/28/1049752328.db2.gz MCDZMFJLFAGOSW-UHFFFAOYSA-N -1 1 340.766 4.485 20 0 EIADMM CC(C)(CNC(=O)c1cc(Cl)ccc1[O-])c1ccccc1Cl ZINC001136587829 1049768734 /nfs/dbraw/zinc/76/87/34/1049768734.db2.gz GQZFMTSILGXIME-UHFFFAOYSA-N -1 1 338.234 4.407 20 0 EIADMM CC(C)[C@H]1CCC[C@H](NC(=O)c2cc(Br)ccc2[O-])C1 ZINC001136701877 1049839367 /nfs/dbraw/zinc/83/93/67/1049839367.db2.gz OSSOVKOVCRFPSX-AAEUAGOBSA-N -1 1 340.261 4.099 20 0 EIADMM CC[C@H](C)[C@H](C)N(C(=O)c1ccc2ccc(O)cc2c1[O-])C1CC1 ZINC001136714625 1049844296 /nfs/dbraw/zinc/84/42/96/1049844296.db2.gz RMYPVGXZOVBJNR-STQMWFEESA-N -1 1 327.424 4.290 20 0 EIADMM CC(NC(=O)c1cc(F)ccc1[O-])(c1ccccc1)c1ccccc1 ZINC001136718805 1049848466 /nfs/dbraw/zinc/84/84/66/1049848466.db2.gz GMMVUOQUAWLJQF-UHFFFAOYSA-N -1 1 335.378 4.225 20 0 EIADMM CC(C)CCc1nnc([N-]C(=O)c2coc(C3CCCC3)n2)s1 ZINC000617095124 1049949662 /nfs/dbraw/zinc/94/96/62/1049949662.db2.gz BFOXDKZYLVFYGL-UHFFFAOYSA-N -1 1 334.445 4.025 20 0 EIADMM CSc1cc(Cl)ccc1[N-]C(=O)c1nnc(C(C)C)s1 ZINC000617253351 1049968873 /nfs/dbraw/zinc/96/88/73/1049968873.db2.gz NYQVZJLFEDDQLS-UHFFFAOYSA-N -1 1 327.862 4.289 20 0 EIADMM C[C@@H](C#N)Oc1ccccc1NCc1cccc(Br)c1[O-] ZINC000181118784 1049992892 /nfs/dbraw/zinc/99/28/92/1049992892.db2.gz LMBMXXNAXRDFSC-NSHDSACASA-N -1 1 347.212 4.058 20 0 EIADMM CC(C)Oc1ccc(F)c(Nc2cc3ccc([O-])cc3oc2=O)c1 ZINC001212310634 1050020437 /nfs/dbraw/zinc/02/04/37/1050020437.db2.gz PHQSYTRYEXWAKI-UHFFFAOYSA-N -1 1 329.327 4.169 20 0 EIADMM CC[C@@H](C)C[C@@H](C)[N-]S(=O)(=O)c1ccc(Cl)c(F)c1Cl ZINC001187372835 1050529857 /nfs/dbraw/zinc/52/98/57/1050529857.db2.gz FENTVBVCVRDLSV-RKDXNWHRSA-N -1 1 342.263 4.236 20 0 EIADMM COc1ccccc1[C@H](C)C(=O)Nc1cccc(C(F)(F)F)c1[O-] ZINC001187686982 1050594634 /nfs/dbraw/zinc/59/46/34/1050594634.db2.gz JSSRHXORZDJSHP-JTQLQIEISA-N -1 1 339.313 4.162 20 0 EIADMM [O-]c1c(Br)cc(NC2=CCCC2)cc1Br ZINC001173999479 1050671395 /nfs/dbraw/zinc/67/13/95/1050671395.db2.gz PRBODNQGZSCCEX-UHFFFAOYSA-N -1 1 333.023 4.397 20 0 EIADMM COc1ccc(C(=O)Nc2cc(F)c([O-])cc2Cl)cc1C1CC1 ZINC001179660363 1050740409 /nfs/dbraw/zinc/74/04/09/1050740409.db2.gz RBMZWWFHELVUFQ-UHFFFAOYSA-N -1 1 335.762 4.323 20 0 EIADMM O=C(Nc1cc(C2CCCC2)no1)c1ccc([O-])c(C(F)(F)F)c1 ZINC001188564086 1050793344 /nfs/dbraw/zinc/79/33/44/1050793344.db2.gz QPOJFSATQBSCPG-UHFFFAOYSA-N -1 1 340.301 4.309 20 0 EIADMM CC1CCN(C(=O)c2ccc(Nc3c([O-])cc(F)cc3F)cc2)CC1 ZINC001174162132 1050802049 /nfs/dbraw/zinc/80/20/49/1050802049.db2.gz SLHRGGWOGKKCLI-UHFFFAOYSA-N -1 1 346.377 4.286 20 0 EIADMM CC(=O)NCc1ccc(Nc2cc(Cl)c(C)c(Cl)c2[O-])cc1 ZINC001174233807 1050858955 /nfs/dbraw/zinc/85/89/55/1050858955.db2.gz XGXIRENNTQOUCF-UHFFFAOYSA-N -1 1 339.222 4.387 20 0 EIADMM CC(=O)NCc1ccc(Nc2c(Cl)ccc([O-])c2Cl)cc1 ZINC001174234739 1050858990 /nfs/dbraw/zinc/85/89/90/1050858990.db2.gz YHQZMTRPFGPMQS-UHFFFAOYSA-N -1 1 325.195 4.079 20 0 EIADMM CC(C)(C)c1cccc(C(=O)Nc2cc(=O)n(-c3ccccc3)[n-]2)c1 ZINC001188971664 1050877007 /nfs/dbraw/zinc/87/70/07/1050877007.db2.gz WOOYPPOZBSMPIS-UHFFFAOYSA-N -1 1 335.407 4.128 20 0 EIADMM Cc1c(=O)[n-]c(S[C@H](C)C(=O)c2ccco2)nc1-c1ccccc1 ZINC001189102875 1050909300 /nfs/dbraw/zinc/90/93/00/1050909300.db2.gz FBEFCURXXGBISK-GFCCVEGCSA-N -1 1 340.404 4.114 20 0 EIADMM [O-]c1c(Cl)cc(Br)cc1Nc1cnc2[nH]ccc2c1 ZINC001174401133 1050919430 /nfs/dbraw/zinc/91/94/30/1050919430.db2.gz UFCGFODODMHXFA-UHFFFAOYSA-N -1 1 338.592 4.380 20 0 EIADMM CC(=O)c1cccc(S(=O)(=O)[N-]c2cc(C(C)C)ccc2C)c1 ZINC001189233037 1050932034 /nfs/dbraw/zinc/93/20/34/1050932034.db2.gz YEIFMPLCQZNRQB-UHFFFAOYSA-N -1 1 331.437 4.122 20 0 EIADMM CCOc1cc(C(=O)N2CCC[C@H](C3CCC3)C2)cc(Cl)c1[O-] ZINC000620218872 1051069174 /nfs/dbraw/zinc/06/91/74/1051069174.db2.gz YFCWZWKRTBZRIX-ZDUSSCGKSA-N -1 1 337.847 4.097 20 0 EIADMM COc1cc(Nc2c([O-])c(Br)ccc2Cl)ccc1O ZINC001174546004 1051077326 /nfs/dbraw/zinc/07/73/26/1051077326.db2.gz VQCYLKDHCNSQSE-UHFFFAOYSA-N -1 1 344.592 4.266 20 0 EIADMM Cc1cccc([N-]S(=O)(=O)c2cc(F)cc(C(F)(F)F)c2)c1C ZINC001189948486 1051088086 /nfs/dbraw/zinc/08/80/86/1051088086.db2.gz CTHRNACGQKHIET-UHFFFAOYSA-N -1 1 347.333 4.262 20 0 EIADMM CN(CCSc1nc(-c2ccccc2)cc(=O)[n-]1)c1ccccc1 ZINC001190200955 1051137123 /nfs/dbraw/zinc/13/71/23/1051137123.db2.gz FIZGTPVWOPYSMS-UHFFFAOYSA-N -1 1 337.448 4.078 20 0 EIADMM [O-]c1c(Nc2ccc3c(c2)CCCO3)ccc(F)c1Br ZINC001174722832 1051151638 /nfs/dbraw/zinc/15/16/38/1051151638.db2.gz UYYGVNGEIJQUNI-UHFFFAOYSA-N -1 1 338.176 4.362 20 0 EIADMM CCOc1cc(C(=O)N(CCC2CC2)CC2CC2)cc(Cl)c1[O-] ZINC000620625770 1051178882 /nfs/dbraw/zinc/17/88/82/1051178882.db2.gz HSRIAHMUZYRXOD-UHFFFAOYSA-N -1 1 337.847 4.097 20 0 EIADMM CCC(C)(C)c1ccc(S(=O)(=O)[N-]c2cnc(F)c(C)c2)cc1 ZINC001190423650 1051180086 /nfs/dbraw/zinc/18/00/86/1051180086.db2.gz MFXFIZBIPZSWHM-UHFFFAOYSA-N -1 1 336.432 4.018 20 0 EIADMM Cc1cccc(Cl)c1[N-]S(=O)(=O)c1c(F)cccc1Cl ZINC000153692764 1051215118 /nfs/dbraw/zinc/21/51/18/1051215118.db2.gz XFCUWQHESIBHPP-UHFFFAOYSA-N -1 1 334.199 4.242 20 0 EIADMM O=C(Cc1cccc2[nH]ccc21)Nc1cccc(C(F)(F)F)c1[O-] ZINC001181722186 1051285652 /nfs/dbraw/zinc/28/56/52/1051285652.db2.gz QVKPTIFYUJGGNV-UHFFFAOYSA-N -1 1 334.297 4.074 20 0 EIADMM CCCCCc1ccc(Nc2cc(S(C)(=O)=O)ccc2[O-])cc1 ZINC001175013176 1051294853 /nfs/dbraw/zinc/29/48/53/1051294853.db2.gz KMBLYCKDMVKDPF-UHFFFAOYSA-N -1 1 333.453 4.272 20 0 EIADMM COc1ccc(Nc2ccc(F)c(Br)c2[O-])c(F)c1F ZINC001175026953 1051321031 /nfs/dbraw/zinc/32/10/31/1051321031.db2.gz HGZIFVMWTJPWGF-UHFFFAOYSA-N -1 1 348.118 4.324 20 0 EIADMM COc1c(C)cc(C(=O)Nc2cccc(C(F)(F)F)c2[O-])cc1C ZINC001191070827 1051338604 /nfs/dbraw/zinc/33/86/04/1051338604.db2.gz MMWYSWPCIOWYKT-UHFFFAOYSA-N -1 1 339.313 4.289 20 0 EIADMM COc1cc(C(=O)Nc2cc3scnc3c(C)c2)cc(Cl)c1[O-] ZINC001191148986 1051364736 /nfs/dbraw/zinc/36/47/36/1051364736.db2.gz YQALCMITCLFNCG-UHFFFAOYSA-N -1 1 348.811 4.225 20 0 EIADMM C[C@]1([N-]S(=O)(=O)c2sc3ccccc3c2Cl)CC=CCC1 ZINC001191220327 1051397498 /nfs/dbraw/zinc/39/74/98/1051397498.db2.gz HZIBJMHZZDNREM-HNNXBMFYSA-N -1 1 341.885 4.332 20 0 EIADMM COc1ccc(C(C)C)cc1S(=O)(=O)[N-]c1cccc(C)c1F ZINC001191697340 1051523131 /nfs/dbraw/zinc/52/31/31/1051523131.db2.gz PAXMWDHHXXEBBT-UHFFFAOYSA-N -1 1 337.416 4.067 20 0 EIADMM COc1ccc(C(C)C)cc1S(=O)(=O)[N-]c1c(C)cccc1F ZINC001191696904 1051523825 /nfs/dbraw/zinc/52/38/25/1051523825.db2.gz KGJCTIPORRFULO-UHFFFAOYSA-N -1 1 337.416 4.067 20 0 EIADMM O=C([N-]c1nc(-c2ccccc2)no1)c1cnc(-c2ccccc2)s1 ZINC001182540403 1051633064 /nfs/dbraw/zinc/63/30/64/1051633064.db2.gz ABQDLDDMIACAOY-UHFFFAOYSA-N -1 1 348.387 4.112 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1CC2(CCC2)[C@@H]1c1ccncc1 ZINC000621164699 1051707267 /nfs/dbraw/zinc/70/72/67/1051707267.db2.gz GBGXUBGEORHGRE-FQEVSTJZSA-N -1 1 344.414 4.308 20 0 EIADMM CCCO[C@@H](C(=O)Nc1ccc(F)cc1[O-])c1ccc(F)cc1C ZINC001183054420 1051779277 /nfs/dbraw/zinc/77/92/77/1051779277.db2.gz LNLDNCDBOMQSDU-QGZVFWFLSA-N -1 1 335.350 4.085 20 0 EIADMM O=C(Nc1ccc2sc(Cl)nc2c1)c1cc([O-])cc(F)c1F ZINC001192665777 1051798012 /nfs/dbraw/zinc/79/80/12/1051798012.db2.gz WBSAZUZUKHJXPF-UHFFFAOYSA-N -1 1 340.738 4.186 20 0 EIADMM [O-]c1cc(Cl)c(Nc2cccc(N3CCOCC3)c2)cc1Cl ZINC001176018308 1051876693 /nfs/dbraw/zinc/87/66/93/1051876693.db2.gz RBDHLBPEWWIWEL-UHFFFAOYSA-N -1 1 339.222 4.279 20 0 EIADMM Cc1ccc2ccc(F)c(Nc3cc4ccc([O-])cc4oc3=O)c2n1 ZINC001176113781 1051917820 /nfs/dbraw/zinc/91/78/20/1051917820.db2.gz HBQKBWUDTXRMAY-UHFFFAOYSA-N -1 1 336.322 4.238 20 0 EIADMM [O-]c1cc(F)c(Nc2cccc3c2cnn3[C@H]2CCCCO2)cc1F ZINC001176324901 1051991178 /nfs/dbraw/zinc/99/11/78/1051991178.db2.gz YEHBJNMALLLDQL-GOSISDBHSA-N -1 1 345.349 4.463 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc(F)c(F)c2)c2ccccc12 ZINC001193824104 1052004585 /nfs/dbraw/zinc/00/45/85/1052004585.db2.gz CFRNWBGSVFNGHM-UHFFFAOYSA-N -1 1 333.359 4.227 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc3cnccc3c2)c2ccccc12 ZINC001193824122 1052004832 /nfs/dbraw/zinc/00/48/32/1052004832.db2.gz CLUOOOCWHAMXBP-UHFFFAOYSA-N -1 1 348.427 4.497 20 0 EIADMM [O-]c1c(Cl)nccc1Nc1cccc2c1cnn2[C@@H]1CCCCO1 ZINC001176315143 1052019066 /nfs/dbraw/zinc/01/90/66/1052019066.db2.gz REZPHFBXRONRID-HNNXBMFYSA-N -1 1 344.802 4.233 20 0 EIADMM [O-]c1c(Br)ccc(Cl)c1Nc1csc(CO)c1 ZINC001176376631 1052048339 /nfs/dbraw/zinc/04/83/39/1052048339.db2.gz XOVAKLVOEZVRME-UHFFFAOYSA-N -1 1 334.622 4.106 20 0 EIADMM CC(C)CCCCCC(=O)N1CCC(C(=O)c2ccc([O-])cc2)CC1 ZINC000081458130 1052100214 /nfs/dbraw/zinc/10/02/14/1052100214.db2.gz MFPHPHXOAOFLHR-UHFFFAOYSA-N -1 1 345.483 4.420 20 0 EIADMM COc1ccc(O)cc1Nc1cc(Br)cc(Cl)c1[O-] ZINC001176581230 1052119100 /nfs/dbraw/zinc/11/91/00/1052119100.db2.gz CCQJAOQQDQBTTQ-UHFFFAOYSA-N -1 1 344.592 4.266 20 0 EIADMM COc1cc(Nc2c(F)cc(F)c([O-])c2F)c(OC)cc1Cl ZINC001176669164 1052157428 /nfs/dbraw/zinc/15/74/28/1052157428.db2.gz FJLVRSCUEBXMEK-UHFFFAOYSA-N -1 1 333.693 4.224 20 0 EIADMM Cc1cc(Nc2c(F)cc(F)c([O-])c2F)cc(Br)n1 ZINC001176664608 1052157560 /nfs/dbraw/zinc/15/75/60/1052157560.db2.gz RYHGBDHZCVGGES-UHFFFAOYSA-N -1 1 333.107 4.019 20 0 EIADMM Cc1ccccc1-c1cc(Nc2c(F)cc(F)c([O-])c2F)n(C)n1 ZINC001176670109 1052157898 /nfs/dbraw/zinc/15/78/98/1052157898.db2.gz RMSWHUJMLWZDMU-UHFFFAOYSA-N -1 1 333.313 4.262 20 0 EIADMM [O-]c1c(F)cc(F)c(Nc2ccc(O)cc2Br)c1F ZINC001176671393 1052159353 /nfs/dbraw/zinc/15/93/53/1052159353.db2.gz XWFMMRPVUSHXGK-UHFFFAOYSA-N -1 1 334.091 4.021 20 0 EIADMM C=Cc1ccccc1[N-]S(=O)(=O)c1cccc2c(Cl)nccc21 ZINC001194498475 1052160399 /nfs/dbraw/zinc/16/03/99/1052160399.db2.gz KWGOYXAUBYIGOI-UHFFFAOYSA-N -1 1 344.823 4.332 20 0 EIADMM Cc1cc(Nc2c(F)cc(F)c([O-])c2F)n(-c2cccc(F)c2)n1 ZINC001176662953 1052172998 /nfs/dbraw/zinc/17/29/98/1052172998.db2.gz DXSKLLFCJWFPKN-UHFFFAOYSA-N -1 1 337.276 4.186 20 0 EIADMM Cc1nc2ccc([N-]S(=O)(=O)c3c(C)cccc3C)cc2s1 ZINC001194633656 1052181577 /nfs/dbraw/zinc/18/15/77/1052181577.db2.gz CXWXCTPBIANWMU-UHFFFAOYSA-N -1 1 332.450 4.022 20 0 EIADMM CCc1cccc(C)c1[N-]S(=O)(=O)c1ccc(-c2cnco2)cc1 ZINC001185227933 1052198020 /nfs/dbraw/zinc/19/80/20/1052198020.db2.gz WMEWKONUSPQWMS-UHFFFAOYSA-N -1 1 342.420 4.013 20 0 EIADMM Cc1ccc(SCCC(=O)NCc2ccc([O-])c(Cl)c2)cc1C ZINC001176989169 1052211642 /nfs/dbraw/zinc/21/16/42/1052211642.db2.gz ZQCYMCZIYWZHNR-UHFFFAOYSA-N -1 1 349.883 4.461 20 0 EIADMM CCCCN(C)c1ccc(C(=O)NCc2ccc([O-])c(Cl)c2)cc1 ZINC001176989115 1052214338 /nfs/dbraw/zinc/21/43/38/1052214338.db2.gz YLOICUONVHITEV-UHFFFAOYSA-N -1 1 346.858 4.212 20 0 EIADMM O=C(Nc1cccc(C(F)(F)F)c1[O-])c1cc(C2CCC2)ccn1 ZINC001185315450 1052217321 /nfs/dbraw/zinc/21/73/21/1052217321.db2.gz AZMDVWCOYWHSGT-UHFFFAOYSA-N -1 1 336.313 4.326 20 0 EIADMM C[C@@H](Cc1cccc(C(F)(F)F)c1)C(=O)[N-]Oc1ccccc1F ZINC001177109605 1052231939 /nfs/dbraw/zinc/23/19/39/1052231939.db2.gz LFGBUZDXILRHET-NSHDSACASA-N -1 1 341.304 4.133 20 0 EIADMM O=S(=O)([N-]c1ccc(F)cc1Cl)c1cc2ccccc2s1 ZINC001185454069 1052243685 /nfs/dbraw/zinc/24/36/85/1052243685.db2.gz JKNYIJMFWKPDNF-UHFFFAOYSA-N -1 1 341.816 4.495 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2ccc(C(=O)C3CC3)cc2)ccc1Cl ZINC001185532790 1052259194 /nfs/dbraw/zinc/25/91/94/1052259194.db2.gz RWAQYFOPJOYNAH-UHFFFAOYSA-N -1 1 349.839 4.042 20 0 EIADMM O=C(Nc1ccc(F)cc1[O-])Nc1cc(C(F)(F)F)ccc1F ZINC001185615832 1052271089 /nfs/dbraw/zinc/27/10/89/1052271089.db2.gz CTQWSEXTBTUONB-UHFFFAOYSA-N -1 1 332.228 4.333 20 0 EIADMM O=C(Nc1ccccc1OCCF)c1ccc(C(F)(F)F)cc1[O-] ZINC000622629639 1052359369 /nfs/dbraw/zinc/35/93/69/1052359369.db2.gz XGKHSDIIJMVIDG-UHFFFAOYSA-N -1 1 343.276 4.012 20 0 EIADMM O=C(c1ccc(C(F)(F)F)cc1[O-])N1CC[C@H](C2CCCCC2)C1 ZINC000622750837 1052429415 /nfs/dbraw/zinc/42/94/15/1052429415.db2.gz RTTQIYKOXBJQRG-ZDUSSCGKSA-N -1 1 341.373 4.453 20 0 EIADMM CCOc1cc(C(=O)N(C)C2CCC(C)CC2)cc(Cl)c1[O-] ZINC000192782313 1052639736 /nfs/dbraw/zinc/63/97/36/1052639736.db2.gz RXCSWMRSCLRIKA-UHFFFAOYSA-N -1 1 325.836 4.095 20 0 EIADMM O=C([N-]c1c(F)cc(Cl)cc1F)c1ccc(Br)o1 ZINC000180353561 1052795789 /nfs/dbraw/zinc/79/57/89/1052795789.db2.gz JTFBTWZQQJBGKE-UHFFFAOYSA-N -1 1 336.519 4.226 20 0 EIADMM O=C([N-]c1cnoc1)c1csc(-c2ccc(Cl)c(Cl)c2)n1 ZINC000623939000 1052839613 /nfs/dbraw/zinc/83/96/13/1052839613.db2.gz ZWJAOVIDJNPTHB-UHFFFAOYSA-N -1 1 340.191 4.357 20 0 EIADMM C[C@H](C(=O)[N-]OC1CCCC1)c1cccc(C(=O)c2ccccc2)c1 ZINC000775605465 1053089521 /nfs/dbraw/zinc/08/95/21/1053089521.db2.gz ZWKAADYEDDEXEI-HNNXBMFYSA-N -1 1 337.419 4.012 20 0 EIADMM C[C@@H](C(=O)[N-]OC1CCCC1)c1cccc(C(=O)c2ccccc2)c1 ZINC000775605466 1053090242 /nfs/dbraw/zinc/09/02/42/1053090242.db2.gz ZWKAADYEDDEXEI-OAHLLOKOSA-N -1 1 337.419 4.012 20 0 EIADMM COc1ccc(Cl)cc1[N-]S(=O)(=O)/C=C/c1ccc(C)cc1 ZINC000864255943 1053225853 /nfs/dbraw/zinc/22/58/53/1053225853.db2.gz KGBYIALHRGDIJA-MDZDMXLPSA-N -1 1 337.828 4.070 20 0 EIADMM CCC(=O)c1ccc([N-]S(=O)(=O)c2cccc(C(C)C)c2)cc1 ZINC001195159387 1053310380 /nfs/dbraw/zinc/31/03/80/1053310380.db2.gz PJLWOIYVPHSLQA-UHFFFAOYSA-N -1 1 331.437 4.204 20 0 EIADMM CCOC(=O)NC(=S)[N-]c1ccccc1Oc1ccc(C)cc1 ZINC001195484567 1053419478 /nfs/dbraw/zinc/41/94/78/1053419478.db2.gz OKIAQOFWTOTFJR-UHFFFAOYSA-N -1 1 330.409 4.230 20 0 EIADMM CCOC(=O)NC(=S)[N-]c1ccc(Oc2ccccc2C)cc1 ZINC001195490416 1053421533 /nfs/dbraw/zinc/42/15/33/1053421533.db2.gz GPBGCSYWVFVOBD-UHFFFAOYSA-N -1 1 330.409 4.230 20 0 EIADMM CCOC(=O)NC(=S)[N-]c1cc(SC(F)(F)F)ccc1C ZINC001195487637 1053421951 /nfs/dbraw/zinc/42/19/51/1053421951.db2.gz WXDQMGKLAUKWRV-UHFFFAOYSA-N -1 1 338.376 4.050 20 0 EIADMM COc1ccc(NC(=S)Nc2cccc(C(F)(F)F)c2[O-])cc1 ZINC001195712968 1053468374 /nfs/dbraw/zinc/46/83/74/1053468374.db2.gz HEFIQBPGPJFOBU-UHFFFAOYSA-N -1 1 342.342 4.229 20 0 EIADMM CCOc1ccc(NC(=O)c2ccc3ccccc3c2[O-])cc1OC ZINC000011871055 1053618174 /nfs/dbraw/zinc/61/81/74/1053618174.db2.gz IFMLSVAVHFIILH-UHFFFAOYSA-N -1 1 337.375 4.205 20 0 EIADMM O=C(NCc1ccccc1OC(F)F)c1ccc2ccccc2c1[O-] ZINC000012826683 1053632791 /nfs/dbraw/zinc/63/27/91/1053632791.db2.gz GBNZHOPLJAAAQT-UHFFFAOYSA-N -1 1 343.329 4.077 20 0 EIADMM CC(C)(C)OC(=O)Nc1cccc(OC(=O)c2ccc([O-])c(F)c2)c1 ZINC001152266069 1053652932 /nfs/dbraw/zinc/65/29/32/1053652932.db2.gz RQKMHJBIHSANJY-UHFFFAOYSA-N -1 1 347.342 4.098 20 0 EIADMM CC(C)(C)c1ncc(C(=O)Nc2cc(F)c([O-])cc2Cl)s1 ZINC000885674128 1053781126 /nfs/dbraw/zinc/78/11/26/1053781126.db2.gz HYKPGUZUOHTBQL-UHFFFAOYSA-N -1 1 328.796 4.191 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2cccc(OC(F)(F)F)c2)c(C)c1 ZINC000024222612 1053798516 /nfs/dbraw/zinc/79/85/16/1053798516.db2.gz BRMCPGWRMYEERK-UHFFFAOYSA-N -1 1 345.342 4.003 20 0 EIADMM O=C(Nc1cc(F)c([O-])cc1Cl)[C@@H]1CC[C@H](C(F)(F)F)C1 ZINC000885678841 1053809592 /nfs/dbraw/zinc/80/95/92/1053809592.db2.gz WRMLKJWERCPTEQ-RQJHMYQMSA-N -1 1 325.689 4.102 20 0 EIADMM O=C(Nc1cc(F)c([O-])cc1Cl)[C@H]1CC[C@H](C(F)(F)F)C1 ZINC000885678836 1053809600 /nfs/dbraw/zinc/80/96/00/1053809600.db2.gz WRMLKJWERCPTEQ-BQBZGAKWSA-N -1 1 325.689 4.102 20 0 EIADMM [O-]c1c(F)cccc1NC(=S)Nc1cccc(Br)c1 ZINC001197005486 1053822491 /nfs/dbraw/zinc/82/24/91/1053822491.db2.gz KNSUSSJLZSHUAM-UHFFFAOYSA-N -1 1 341.205 4.103 20 0 EIADMM O=C([N-]c1nnc(C(F)(F)F)s1)c1occc1-c1ccccc1 ZINC000029289659 1054000435 /nfs/dbraw/zinc/00/04/35/1054000435.db2.gz HJORHNSZJPPIAF-UHFFFAOYSA-N -1 1 339.298 4.069 20 0 EIADMM Cc1nc(C(C)C)[n-]c(=O)c1C(=O)Nc1cccc(OC(C)(C)C)c1 ZINC000888559696 1054173534 /nfs/dbraw/zinc/17/35/34/1054173534.db2.gz ZABNECSBHUHYAO-UHFFFAOYSA-N -1 1 343.427 4.044 20 0 EIADMM Cc1c(=O)[n-]c(SC[C@@H]2C[C@@H]3CCC[C@H]3O2)nc1-c1ccccc1 ZINC000871666987 1054242273 /nfs/dbraw/zinc/24/22/73/1054242273.db2.gz BCTIQCGGCCPBNI-HRCADAONSA-N -1 1 342.464 4.207 20 0 EIADMM O=S(=O)([N-]c1cccc(C(F)(F)F)c1)c1ccc2occc2c1 ZINC001198816154 1054271488 /nfs/dbraw/zinc/27/14/88/1054271488.db2.gz GCOUPMXSRZVRNR-UHFFFAOYSA-N -1 1 341.310 4.252 20 0 EIADMM O=C(Nc1ccc(OCC(F)(F)F)c(Cl)c1)c1ccccc1[O-] ZINC000857501893 1054283954 /nfs/dbraw/zinc/28/39/54/1054283954.db2.gz OCLHQWYIHOSKEB-UHFFFAOYSA-N -1 1 345.704 4.239 20 0 EIADMM Cc1cc(Br)c([O-])c(NC(=O)C2C[C@@H](C)C[C@H](C)C2)c1 ZINC001152518511 1054316169 /nfs/dbraw/zinc/31/61/69/1054316169.db2.gz SJIZJBXJLNZSKV-UWVGGRQHSA-N -1 1 340.261 4.474 20 0 EIADMM CCCCC[C@H](NC(=O)Cn1c(CCC)n[n-]c1=S)C(C)(C)C ZINC000115446505 1054350692 /nfs/dbraw/zinc/35/06/92/1054350692.db2.gz CGFRWQURHIAJDR-ZDUSSCGKSA-N -1 1 340.537 4.004 20 0 EIADMM Cc1oc(-c2ccccc2F)nc1C(=O)[N-]c1nc(C(C)C)ns1 ZINC000874696005 1054719104 /nfs/dbraw/zinc/71/91/04/1054719104.db2.gz YHLUEEKGBACPCB-UHFFFAOYSA-N -1 1 346.387 4.016 20 0 EIADMM Cc1onc(-c2ccc(F)cc2)c1C(=O)[N-]c1nnc(C(C)C)s1 ZINC000028980803 1054788407 /nfs/dbraw/zinc/78/84/07/1054788407.db2.gz GQCNSEWZPKSOFV-UHFFFAOYSA-N -1 1 346.387 4.016 20 0 EIADMM CC(C)CCOc1cccc([N-]S(=O)(=O)c2cccc(F)c2)c1 ZINC000064374065 1054855241 /nfs/dbraw/zinc/85/52/41/1054855241.db2.gz AOTKEBHMHZHNRK-UHFFFAOYSA-N -1 1 337.416 4.051 20 0 EIADMM Cc1ccc([C@H](C)N(C)C(=O)NCc2ccc([O-])c(Cl)c2)cc1 ZINC000876392634 1054892455 /nfs/dbraw/zinc/89/24/55/1054892455.db2.gz ACMCFYIUQTVWLK-ZDUSSCGKSA-N -1 1 332.831 4.257 20 0 EIADMM O=C(NCc1ccc([O-])c(Cl)c1)N1CCC[C@@H]1c1ccsc1 ZINC000876393273 1054894366 /nfs/dbraw/zinc/89/43/66/1054894366.db2.gz KHUFGQFZWXOOHL-CQSZACIVSA-N -1 1 336.844 4.154 20 0 EIADMM O=C(Nc1ccc(Cl)cc1Cl)Nc1cc(Cl)ncc1[O-] ZINC001202075620 1055037921 /nfs/dbraw/zinc/03/79/21/1055037921.db2.gz VNPBPMREMXBBEX-UHFFFAOYSA-N -1 1 332.574 4.391 20 0 EIADMM O=c1nc(CN2CCCC3(C2)CCCCCC3)[n-]c2ccsc21 ZINC000072801091 1055150244 /nfs/dbraw/zinc/15/02/44/1055150244.db2.gz SNRNXFKJFBJHFW-UHFFFAOYSA-N -1 1 331.485 4.333 20 0 EIADMM Cc1ccc(C[N@H+](Cc2nnc(-c3ccccc3O)o2)C2CC2)cc1C ZINC000878126121 1055191896 /nfs/dbraw/zinc/19/18/96/1055191896.db2.gz OUXLOZTZHJDWTB-UHFFFAOYSA-N -1 1 349.434 4.224 20 0 EIADMM COc1ccc(CCC(=O)Nc2ccc([O-])c(Cl)c2)cc1Cl ZINC000111668250 1055225250 /nfs/dbraw/zinc/22/52/50/1055225250.db2.gz KOHFENHCIMYNSL-UHFFFAOYSA-N -1 1 340.206 4.279 20 0 EIADMM O=C(CCCCC(=O)c1ccccc1)Nc1ccc([O-])c(Cl)c1 ZINC000111666090 1055225330 /nfs/dbraw/zinc/22/53/30/1055225330.db2.gz HJLWYOPSVUNHCI-UHFFFAOYSA-N -1 1 331.799 4.427 20 0 EIADMM CC(=O)c1cc(-c2nc(-c3cccc(Oc4ccccc4)c3)no2)[nH]n1 ZINC001212429992 1055934299 /nfs/dbraw/zinc/93/42/99/1055934299.db2.gz UESIKEGEMMEFTK-UHFFFAOYSA-N -1 1 346.346 4.122 20 0 EIADMM CC(=O)c1cc(-c2nc(-c3cccc(Oc4ccccc4)c3)no2)n[n-]1 ZINC001212429992 1055934308 /nfs/dbraw/zinc/93/43/08/1055934308.db2.gz UESIKEGEMMEFTK-UHFFFAOYSA-N -1 1 346.346 4.122 20 0 EIADMM CC(=O)c1cc(-c2nc(-c3cccc(Oc4ccccc4)c3)no2)[n-]n1 ZINC001212429992 1055934317 /nfs/dbraw/zinc/93/43/17/1055934317.db2.gz UESIKEGEMMEFTK-UHFFFAOYSA-N -1 1 346.346 4.122 20 0 EIADMM Cc1cc2cn[nH]c2c(C(=O)Nc2cc(Cl)c([O-])c(Cl)c2)c1 ZINC000765862691 1056025131 /nfs/dbraw/zinc/02/51/31/1056025131.db2.gz JDPIPSQVFHKXGB-UHFFFAOYSA-N -1 1 336.178 4.136 20 0 EIADMM CCOC(=O)c1cc(Cl)cnc1Nc1cc(F)c([O-])c(Cl)c1 ZINC001214482730 1056755798 /nfs/dbraw/zinc/75/57/98/1056755798.db2.gz KXIBDIRVNLARTF-UHFFFAOYSA-N -1 1 345.157 4.153 20 0 EIADMM C[C@@H]1CN(C(=O)c2c([O-])cccc2Cl)CC[C@@H]1c1ccccc1 ZINC000743703801 1059079868 /nfs/dbraw/zinc/07/98/68/1059079868.db2.gz YPTIHBFEYRRCET-HIFRSBDPSA-N -1 1 329.827 4.311 20 0 EIADMM CCOc1cc(C(=O)Nc2ccc(C)cc2OC)cc(Cl)c1[O-] ZINC000186664537 1060110879 /nfs/dbraw/zinc/11/08/79/1060110879.db2.gz OBUZDLWZORWYPO-UHFFFAOYSA-N -1 1 335.787 4.014 20 0 EIADMM CC[C@@H](C)c1ccc(S(=O)(=O)[N-]c2ccc(COC)cc2)cc1 ZINC000766585615 1060643574 /nfs/dbraw/zinc/64/35/74/1060643574.db2.gz QAZYKAQVKSDWJR-CQSZACIVSA-N -1 1 333.453 4.147 20 0 EIADMM O=c1cc(C2CC2)nc(SCc2nc(Cl)ccc2Cl)[n-]1 ZINC000767081338 1061100221 /nfs/dbraw/zinc/10/02/21/1061100221.db2.gz FGZSYJVTKTYPEC-UHFFFAOYSA-N -1 1 328.224 4.054 20 0 EIADMM O=C(Nc1ccccc1Cl)c1cc(Br)ccc1[O-] ZINC000011639333 211227424 /nfs/dbraw/zinc/22/74/24/211227424.db2.gz UCSKEDNFOZYRBC-UHFFFAOYSA-N -1 1 326.577 4.060 20 0 EIADMM [O-]c1ccc(F)cc1-c1nc(Cc2cccc(C(F)(F)F)c2)no1 ZINC000325364558 1032231694 /nfs/dbraw/zinc/23/16/94/1032231694.db2.gz AKAGOYXPQAHBPT-UHFFFAOYSA-N -1 1 338.260 4.191 20 0 EIADMM CCOC(=O)c1ccc(OC)c(Nc2cc([O-])c(Cl)cc2F)c1 ZINC001211979224 1032366775 /nfs/dbraw/zinc/36/67/75/1032366775.db2.gz QWBNUNAXRLWTQY-UHFFFAOYSA-N -1 1 339.750 4.114 20 0 EIADMM CC[C@@H]1C[C@H](C(=O)Nc2cc(Cl)c([O-])c3ccccc23)CCO1 ZINC000529538819 1032428417 /nfs/dbraw/zinc/42/84/17/1032428417.db2.gz KRPMQNDJAFXDRL-VXGBXAGGSA-N -1 1 333.815 4.343 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1csc(-c2cccs2)n1 ZINC000533081887 1032480830 /nfs/dbraw/zinc/48/08/30/1032480830.db2.gz RVTWDIDCXSHOFO-UHFFFAOYSA-N -1 1 336.825 4.483 20 0 EIADMM O=C(Nc1ccc2nc(C(F)F)[nH]c2c1)c1ccc([O-])c(Cl)c1 ZINC000089882190 1018743116 /nfs/dbraw/zinc/74/31/16/1018743116.db2.gz HURTZLJSOZXGIE-UHFFFAOYSA-N -1 1 337.713 4.112 20 0 EIADMM O=C([O-])[C@@H](NCc1ccc2ccccc2c1)c1cc(F)ccc1F ZINC000683172631 1019093430 /nfs/dbraw/zinc/09/34/30/1019093430.db2.gz FJVMNGXBSDFILS-SFHVURJKSA-N -1 1 327.330 4.034 20 0 EIADMM CC(C)(C)c1ccc(CN[C@@H](C(=O)[O-])c2cc(F)ccc2F)cc1 ZINC000683172352 1019093666 /nfs/dbraw/zinc/09/36/66/1019093666.db2.gz DIVGUCSFXKLJKN-QGZVFWFLSA-N -1 1 333.378 4.178 20 0 EIADMM CCOc1cc(C(=O)N(C)Cc2cc(C)ccc2C)cc(Cl)c1[O-] ZINC000430196002 1019184906 /nfs/dbraw/zinc/18/49/06/1019184906.db2.gz KMFPIXUCYNWODR-UHFFFAOYSA-N -1 1 347.842 4.333 20 0 EIADMM O=C(Nc1cccc(CSC2CCCC2)c1)c1cncc([O-])c1 ZINC000339902235 1020066960 /nfs/dbraw/zinc/06/69/60/1020066960.db2.gz UQESFAMLSPEHHQ-UHFFFAOYSA-N -1 1 328.437 4.215 20 0 EIADMM O=C(Nc1ccc(COC2CCCC2)cc1)c1ccc([O-])cc1F ZINC000154917491 1020112422 /nfs/dbraw/zinc/11/24/22/1020112422.db2.gz BHHCWRMKMPQRDA-UHFFFAOYSA-N -1 1 329.371 4.243 20 0 EIADMM [O-]c1ccc(-c2noc(-c3noc4c3CCCCC4)n2)c(Cl)c1 ZINC000579889707 1020483786 /nfs/dbraw/zinc/48/37/86/1020483786.db2.gz JIJAWXHEARKKKS-UHFFFAOYSA-N -1 1 331.759 4.020 20 0 EIADMM CC(C)n1ccc(Nc2c(Cl)ccc(Br)c2[O-])n1 ZINC001210348043 1021037039 /nfs/dbraw/zinc/03/70/39/1021037039.db2.gz RCLZTLHETZZTCJ-UHFFFAOYSA-N -1 1 330.613 4.329 20 0 EIADMM O=C(C[C@H](c1ccc(O)cc1)C1CC1)Nc1ccc([O-])c(Cl)c1 ZINC000612760158 1021349341 /nfs/dbraw/zinc/34/93/41/1021349341.db2.gz SNCPQTMZNRNPRE-HNNXBMFYSA-N -1 1 331.799 4.274 20 0 EIADMM Cc1cc(C)cc([N-]S(=O)(=O)c2cccc(OC(F)(F)F)c2)c1 ZINC000024243732 1021591212 /nfs/dbraw/zinc/59/12/12/1021591212.db2.gz GJMBSQMOSDIDLJ-UHFFFAOYSA-N -1 1 345.342 4.003 20 0 EIADMM COc1ccc2c(c1)CCCCN2C(=O)c1cc(SC)ccc1[O-] ZINC000613158740 1021773629 /nfs/dbraw/zinc/77/36/29/1021773629.db2.gz GSVIZYYELIQOLQ-UHFFFAOYSA-N -1 1 343.448 4.106 20 0 EIADMM CC(=Nc1ccc(I)cc1[O-])c1ccccc1 ZINC001210990565 1021899423 /nfs/dbraw/zinc/89/94/23/1021899423.db2.gz IXAHCVJKEQRVGA-UHFFFAOYSA-N -1 1 337.160 4.080 20 0 EIADMM CCc1ccc(CN[C@@H](CC(=O)[O-])c2cccc(C(F)(F)F)c2)o1 ZINC000340680689 1021936742 /nfs/dbraw/zinc/93/67/42/1021936742.db2.gz PAUCIPUDJFBSHG-HNNXBMFYSA-N -1 1 341.329 4.166 20 0 EIADMM Cc1c(CO)cccc1Nc1cc(Br)cc(Cl)c1[O-] ZINC001211169653 1022178423 /nfs/dbraw/zinc/17/84/23/1022178423.db2.gz QMQYWBZTJNIYRK-UHFFFAOYSA-N -1 1 342.620 4.352 20 0 EIADMM O=C(Nc1cc([O-])c(F)cc1F)C1(c2ccccc2F)CCCC1 ZINC001625894495 1022354517 /nfs/dbraw/zinc/35/45/17/1022354517.db2.gz ZPNQJRBCFYROMH-UHFFFAOYSA-N -1 1 335.325 4.260 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1CCS[C@@H]2CCCC[C@@H]21 ZINC000175404417 1022355468 /nfs/dbraw/zinc/35/54/68/1022355468.db2.gz SULBZELOPPAWMO-DLBZAZTESA-N -1 1 327.449 4.046 20 0 EIADMM CCOc1cc(C(=O)Nc2ccc3ccn(C)c3c2)cc(Cl)c1[O-] ZINC000186684818 1022730649 /nfs/dbraw/zinc/73/06/49/1022730649.db2.gz FJTMZXAXVPWJGM-UHFFFAOYSA-N -1 1 344.798 4.188 20 0 EIADMM CCOc1cc(C(=O)Nc2cccc3[nH]ccc32)cc(Cl)c1[O-] ZINC000186759137 1022742426 /nfs/dbraw/zinc/74/24/26/1022742426.db2.gz JXCBMOVDQWKYBJ-UHFFFAOYSA-N -1 1 330.771 4.178 20 0 EIADMM O=C(Nc1cc(Cl)c([O-])c2ccccc12)c1cc(C2CC2)[nH]n1 ZINC001167440364 1022747551 /nfs/dbraw/zinc/74/75/51/1022747551.db2.gz TYNHHLFGCUXLQI-UHFFFAOYSA-N -1 1 327.771 4.052 20 0 EIADMM CCOc1cc(C(=O)Nc2cccc(C(=O)CC)c2)cc(Cl)c1[O-] ZINC000186884493 1022793578 /nfs/dbraw/zinc/79/35/78/1022793578.db2.gz ONKKEWITNPBTBL-UHFFFAOYSA-N -1 1 347.798 4.289 20 0 EIADMM Cc1ccc(F)c(N)c1C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC001167444772 1022820076 /nfs/dbraw/zinc/82/00/76/1022820076.db2.gz NGONAIOINMIDLK-UHFFFAOYSA-N -1 1 344.773 4.481 20 0 EIADMM Cc1c(=O)[n-]c(SCC(=O)CCC(C)C)nc1-c1ccccc1 ZINC000467205807 1023075887 /nfs/dbraw/zinc/07/58/87/1023075887.db2.gz ICTJFRABIXOGJQ-UHFFFAOYSA-N -1 1 330.453 4.255 20 0 EIADMM O=C(N[C@H](Cc1ccccc1)c1cccs1)c1ccc([O-])cc1F ZINC000181223418 1023234918 /nfs/dbraw/zinc/23/49/18/1023234918.db2.gz VJPHGRCMNRASBH-QGZVFWFLSA-N -1 1 341.407 4.307 20 0 EIADMM COc1cc(C(=O)N[C@@H](C)c2ccccc2Cl)cc(Cl)c1[O-] ZINC000584799539 1023331110 /nfs/dbraw/zinc/33/11/10/1023331110.db2.gz MHPYLLDIALJKBO-VIFPVBQESA-N -1 1 340.206 4.199 20 0 EIADMM COc1cc(C(=O)N2CCCCC[C@@H]2c2ccco2)cc(Cl)c1[O-] ZINC000153858654 1023354507 /nfs/dbraw/zinc/35/45/07/1023354507.db2.gz BSKODUPAADWJHU-CQSZACIVSA-N -1 1 349.814 4.405 20 0 EIADMM Cc1oc([C@H](C)N2CC[C@H](C(F)(F)F)C(C)(C)C2)cc1C(=O)[O-] ZINC000581553829 1023356345 /nfs/dbraw/zinc/35/63/45/1023356345.db2.gz HRSKIOCDVKRFNF-ZANVPECISA-N -1 1 333.350 4.258 20 0 EIADMM O=C(Nc1ccc(F)cc1[O-])c1ccc(Cl)c(Br)c1 ZINC000511637404 1023366111 /nfs/dbraw/zinc/36/61/11/1023366111.db2.gz UOCXXBDPRPDPJU-UHFFFAOYSA-N -1 1 344.567 4.200 20 0 EIADMM CC(C)(CCc1ccccc1)NC(=O)c1ncc2ccccc2c1[O-] ZINC001143492047 1023466052 /nfs/dbraw/zinc/46/60/52/1023466052.db2.gz WAJDPHWCBMBBEQ-UHFFFAOYSA-N -1 1 334.419 4.082 20 0 EIADMM CCCCc1ccc(C(=O)Nc2ccc(-c3cc(=O)[nH][n-]3)cc2)cc1 ZINC000613667177 1023481620 /nfs/dbraw/zinc/48/16/20/1023481620.db2.gz KTXGHYTVXYJFNS-UHFFFAOYSA-N -1 1 335.407 4.377 20 0 EIADMM COc1ccc(C(C)C)cc1CN1CC[C@H](C(=O)[O-])[C@H]2CCCC[C@H]21 ZINC000656768005 1023512650 /nfs/dbraw/zinc/51/26/50/1023512650.db2.gz UCYHGTMSBJBPKF-CEXWTWQISA-N -1 1 345.483 4.284 20 0 EIADMM O=C(CC1CCCCCC1)N1CCC(C(=O)c2ccc([O-])cc2)CC1 ZINC000364236945 1023514835 /nfs/dbraw/zinc/51/48/35/1023514835.db2.gz IQAZLCXJIKOIGN-UHFFFAOYSA-N -1 1 343.467 4.174 20 0 EIADMM CCc1nc(SCc2coc(-c3cccs3)n2)[n-]c(=O)c1C ZINC000581677633 1023583293 /nfs/dbraw/zinc/58/32/93/1023583293.db2.gz HZVJKDOLELAYDJ-UHFFFAOYSA-N -1 1 333.438 4.062 20 0 EIADMM CC(C)Oc1ccccc1[C@H](C)NCc1nc(=O)c2sccc2[n-]1 ZINC000581870668 1023784816 /nfs/dbraw/zinc/78/48/16/1023784816.db2.gz XZUUGPXMDBTQQB-LBPRGKRZSA-N -1 1 343.452 4.035 20 0 EIADMM CC(C)OCc1ccc([N-]S(=O)(=O)c2ccc(Cl)cc2)cc1 ZINC000511695588 1023829557 /nfs/dbraw/zinc/82/95/57/1023829557.db2.gz OEKURQCQOJSDJW-UHFFFAOYSA-N -1 1 339.844 4.066 20 0 EIADMM CC[C@H](C)Oc1cccc([N-]S(=O)(=O)c2cc(F)ccc2C)c1 ZINC000511726308 1023839556 /nfs/dbraw/zinc/83/95/56/1023839556.db2.gz HSUGTMZSKOAWNW-ZDUSSCGKSA-N -1 1 337.416 4.112 20 0 EIADMM Cc1cc(F)ccc1S(=O)(=O)[N-]c1cccc(-c2nccs2)c1 ZINC000047417345 1023891859 /nfs/dbraw/zinc/89/18/59/1023891859.db2.gz PWPOBYPRLXRHQH-UHFFFAOYSA-N -1 1 348.424 4.058 20 0 EIADMM CCCOc1ccc(Nc2cc3ccc([O-])cc3oc2=O)cc1F ZINC001211668117 1024099380 /nfs/dbraw/zinc/09/93/80/1024099380.db2.gz PDCBSSAEEYNRHH-UHFFFAOYSA-N -1 1 329.327 4.170 20 0 EIADMM O=S(=O)([N-]c1ccc2ncsc2c1)c1ccc2ccccc2c1 ZINC000107295680 1024336697 /nfs/dbraw/zinc/33/66/97/1024336697.db2.gz QNFRBTSWYJAJEW-UHFFFAOYSA-N -1 1 340.429 4.250 20 0 EIADMM O=S(=O)([N-]c1cccc(F)c1F)c1cccc(Cl)c1Cl ZINC000049375368 1024569142 /nfs/dbraw/zinc/56/91/42/1024569142.db2.gz CJJFNUDVKWVAFG-UHFFFAOYSA-N -1 1 338.162 4.072 20 0 EIADMM O=C(N[C@H](c1cccs1)c1ccc(F)cc1)c1c([O-])cccc1F ZINC000548445045 1024585948 /nfs/dbraw/zinc/58/59/48/1024585948.db2.gz KQOPNIPHUFGSFF-KRWDZBQOSA-N -1 1 345.370 4.251 20 0 EIADMM Cc1ccc(F)cc1S(=O)(=O)[N-]c1ccc(Cl)c(Cl)c1 ZINC000048652382 1024672308 /nfs/dbraw/zinc/67/23/08/1024672308.db2.gz JZAAWHKLQVAKRD-UHFFFAOYSA-N -1 1 334.199 4.242 20 0 EIADMM C[C@H]1CCN(C(=O)c2ccc3ccccc3c2[O-])c2c(O)cccc21 ZINC000186256048 1025026179 /nfs/dbraw/zinc/02/61/79/1025026179.db2.gz JYAUNCMJUDJQRX-ZDUSSCGKSA-N -1 1 333.387 4.405 20 0 EIADMM CSc1ccc([N-]S(=O)(=O)c2ccc(F)c(Cl)c2)cc1 ZINC000007745823 1025451696 /nfs/dbraw/zinc/45/16/96/1025451696.db2.gz ZBPOTXHLOSPJLO-UHFFFAOYSA-N -1 1 331.821 4.002 20 0 EIADMM CC(C)Oc1cccc(CN[C@@H](CC(=O)[O-])c2ccc(F)cc2F)c1 ZINC000277387021 1025852223 /nfs/dbraw/zinc/85/22/23/1025852223.db2.gz RBXCOOAOXAWGQE-SFHVURJKSA-N -1 1 349.377 4.058 20 0 EIADMM CSc1cc(Cl)ccc1[N-]C(=O)c1snnc1C(C)(C)C ZINC000622904547 1025973500 /nfs/dbraw/zinc/97/35/00/1025973500.db2.gz DKHRXSXGQUMXTM-UHFFFAOYSA-N -1 1 341.889 4.463 20 0 EIADMM O=C([N-]c1nnc(C(F)F)s1)c1cc(Cl)sc1Cl ZINC000049043666 1026108117 /nfs/dbraw/zinc/10/81/17/1026108117.db2.gz ZFVBJZWOLSMVJG-UHFFFAOYSA-N -1 1 330.168 4.096 20 0 EIADMM Cc1onc(-c2ccc(Cl)cc2Cl)c1C(=O)[N-]c1cnoc1 ZINC000684765828 1026224544 /nfs/dbraw/zinc/22/45/44/1026224544.db2.gz MEWITBNFBWKEMH-UHFFFAOYSA-N -1 1 338.150 4.197 20 0 EIADMM CC(C)OCc1cccc([N-]S(=O)(=O)c2ccc(Cl)cc2)c1 ZINC000063849346 1026296665 /nfs/dbraw/zinc/29/66/65/1026296665.db2.gz QSTDPMYHQBRJAZ-UHFFFAOYSA-N -1 1 339.844 4.066 20 0 EIADMM O=C(CCC(=O)c1ccc2c(c1)CCC2)Nc1ccc([O-])c(Cl)c1 ZINC000111667645 1026315386 /nfs/dbraw/zinc/31/53/86/1026315386.db2.gz YECHIPNBLHWASK-UHFFFAOYSA-N -1 1 343.810 4.136 20 0 EIADMM CSc1nc2ccccc2c(C)c1[N-]C(=O)c1cc(C2CC2)no1 ZINC000622968310 1026345065 /nfs/dbraw/zinc/34/50/65/1026345065.db2.gz KGJHSBXNTPWFBW-UHFFFAOYSA-N -1 1 339.420 4.383 20 0 EIADMM O=C(Nc1cccc(F)c1[O-])c1ccc(Cl)c(Br)c1 ZINC000707972672 1026466047 /nfs/dbraw/zinc/46/60/47/1026466047.db2.gz ZNLPQUOPHQDPMM-UHFFFAOYSA-N -1 1 344.567 4.200 20 0 EIADMM CO[C@H](c1ccccc1Cl)[C@@H](C)[NH2+]Cc1c(F)ccc(O)c1F ZINC000512216081 1026489691 /nfs/dbraw/zinc/48/96/91/1026489691.db2.gz ADUDVOGXVIOVFR-QGHHPUGFSA-N -1 1 341.785 4.190 20 0 EIADMM O=C([O-])c1coc(CNCc2ccc(-c3ccc(F)cc3)s2)c1 ZINC000426716777 1026498771 /nfs/dbraw/zinc/49/87/71/1026498771.db2.gz YEPGLMMTKSKEPG-UHFFFAOYSA-N -1 1 331.368 4.135 20 0 EIADMM Cc1cccc([C@H](NCc2csc3ccccc23)C(=O)[O-])c1C ZINC000426723781 1026502621 /nfs/dbraw/zinc/50/26/21/1026502621.db2.gz NTZBCPXZFAMRSP-SFHVURJKSA-N -1 1 325.433 4.434 20 0 EIADMM CCc1ccc(CN[C@@H](CC(=O)[O-])c2cc(Cl)cc(Cl)c2)o1 ZINC000426751999 1026534462 /nfs/dbraw/zinc/53/44/62/1026534462.db2.gz AEBXODJBWQQUNR-HNNXBMFYSA-N -1 1 342.222 4.454 20 0 EIADMM CCCSC[C@@H](NCc1ccc(-c2ccccc2)s1)C(=O)[O-] ZINC000426763217 1026547638 /nfs/dbraw/zinc/54/76/38/1026547638.db2.gz RCONLWWNUFBDGC-OAHLLOKOSA-N -1 1 335.494 4.101 20 0 EIADMM O=C([O-])[C@H](NCc1cc(Cl)cc(Cl)c1)c1ccccc1F ZINC000426774875 1026552701 /nfs/dbraw/zinc/55/27/01/1026552701.db2.gz QHQKVOMIWIRHET-CQSZACIVSA-N -1 1 328.170 4.048 20 0 EIADMM O=C([O-])[C@H](NCc1cc(C(F)(F)F)ccc1Cl)c1cccs1 ZINC000426798225 1026568474 /nfs/dbraw/zinc/56/84/74/1026568474.db2.gz DGSJRIFJXKKPNL-GFCCVEGCSA-N -1 1 349.761 4.336 20 0 EIADMM O=C([O-])[C@@H](NCc1cccc(Cl)c1Cl)c1cccc(F)c1 ZINC000426804887 1026570876 /nfs/dbraw/zinc/57/08/76/1026570876.db2.gz WZENMADCEYJRDM-AWEZNQCLSA-N -1 1 328.170 4.048 20 0 EIADMM Cc1cc([C@H](NCc2ccc(F)cc2Cl)C(=O)[O-])ccc1Cl ZINC000426803310 1026570914 /nfs/dbraw/zinc/57/09/14/1026570914.db2.gz LPPKQCJAFVIVLF-HNNXBMFYSA-N -1 1 342.197 4.356 20 0 EIADMM O=C(c1ccc(C(F)(F)F)c([O-])c1)N1CCC[C@@H]1c1ccccc1 ZINC000684871082 1026635437 /nfs/dbraw/zinc/63/54/37/1026635437.db2.gz SOUIXBZBMYHHBT-OAHLLOKOSA-N -1 1 335.325 4.388 20 0 EIADMM Cc1cc(Cl)c(C(=O)N=c2cc(-c3cccs3)[n-][nH]2)cc1C ZINC000512309014 1026671604 /nfs/dbraw/zinc/67/16/04/1026671604.db2.gz MVONKEYJDIAASR-UHFFFAOYSA-N -1 1 331.828 4.083 20 0 EIADMM Cc1cc(Br)c([O-])c(NC(=O)c2csc(Cl)c2)c1 ZINC000469818378 1027275465 /nfs/dbraw/zinc/27/54/65/1027275465.db2.gz SIPREYHLBKLHLO-UHFFFAOYSA-N -1 1 346.633 4.430 20 0 EIADMM Cc1nc(-c2ccc(N[C@H]3CCC[C@H](C)CC3)nc2)[n-]c(=O)c1C ZINC000302662122 1027354149 /nfs/dbraw/zinc/35/41/49/1027354149.db2.gz LWWLHYQZHHSLBX-LRDDRELGSA-N -1 1 326.444 4.242 20 0 EIADMM Cc1nc(-c2ccc(N[C@@H]3CCCC(C)(C)C3)nc2)[n-]c(=O)c1C ZINC000302663376 1027355636 /nfs/dbraw/zinc/35/56/36/1027355636.db2.gz MCNSFEGADJKWCE-OAHLLOKOSA-N -1 1 326.444 4.242 20 0 EIADMM COc1cc(C(=O)N2CCC[C@H]2c2cccc(F)c2)cc(Cl)c1[O-] ZINC000153628274 1027794288 /nfs/dbraw/zinc/79/42/88/1027794288.db2.gz ZJJSNPHUNSJJJI-HNNXBMFYSA-N -1 1 349.789 4.171 20 0 EIADMM Cc1ccccc1[C@@H](CC(F)(F)F)NC(=O)c1ccc([O-])cc1F ZINC000444629891 1027906603 /nfs/dbraw/zinc/90/66/03/1027906603.db2.gz XVIYQPBRTDTKGC-OAHLLOKOSA-N -1 1 341.304 4.263 20 0 EIADMM COCOc1ccccc1Nc1ccc(F)c(Br)c1[O-] ZINC001211566844 1028028896 /nfs/dbraw/zinc/02/88/96/1028028896.db2.gz UJNVKSHPOZVMTM-UHFFFAOYSA-N -1 1 342.164 4.020 20 0 EIADMM CO[C@H]1CCOc2c(NC(=O)Nc3ccc([O-])c(Cl)c3)cccc21 ZINC000448049924 1028455170 /nfs/dbraw/zinc/45/51/70/1028455170.db2.gz RIGNENHYNJNTPL-HNNXBMFYSA-N -1 1 348.786 4.160 20 0 EIADMM O=C(Nc1c([O-])cccc1F)c1[nH]c2ccccc2c1Br ZINC000092551565 1028514770 /nfs/dbraw/zinc/51/47/70/1028514770.db2.gz JOKIPOAOKPDDBE-UHFFFAOYSA-N -1 1 349.159 4.027 20 0 EIADMM CCC[C@@H](NC(=O)c1cncc([O-])c1)c1cccc(C(F)(F)F)c1 ZINC000346579740 1028525136 /nfs/dbraw/zinc/52/51/36/1028525136.db2.gz TUILWTNXBUWSBV-OAHLLOKOSA-N -1 1 338.329 4.077 20 0 EIADMM CCOc1cc(-c2noc(Cc3cccc(F)c3)n2)cc(Cl)c1[O-] ZINC000445431982 1028529611 /nfs/dbraw/zinc/52/96/11/1028529611.db2.gz RZBQJBCUTSTLID-UHFFFAOYSA-N -1 1 348.761 4.224 20 0 EIADMM CCOc1cc(-c2noc(-c3ccccc3F)n2)cc(Cl)c1[O-] ZINC000445430003 1028529937 /nfs/dbraw/zinc/52/99/37/1028529937.db2.gz HCUAHDFALZINCS-UHFFFAOYSA-N -1 1 334.734 4.300 20 0 EIADMM [O-]c1ccc(-c2noc(Cc3cccc4cccnc43)n2)c(Cl)c1 ZINC000445448704 1028535145 /nfs/dbraw/zinc/53/51/45/1028535145.db2.gz LWGPTOIPQUEQBC-UHFFFAOYSA-N -1 1 337.766 4.235 20 0 EIADMM [O-]c1ccc(-c2noc(COc3cccc(Cl)c3)n2)c(Cl)c1 ZINC000445449864 1028537279 /nfs/dbraw/zinc/53/72/79/1028537279.db2.gz QCJVHALDJNTWCY-UHFFFAOYSA-N -1 1 337.162 4.328 20 0 EIADMM [O-]c1ccc(-c2noc(CCc3nc4ccccc4o3)n2)c(Cl)c1 ZINC000445448132 1028537818 /nfs/dbraw/zinc/53/78/18/1028537818.db2.gz QQEASPRAYHEYOL-UHFFFAOYSA-N -1 1 341.754 4.022 20 0 EIADMM COc1cccc([C@H](C)c2nc(-c3ccc([O-])cc3Cl)no2)c1 ZINC000445450308 1028542124 /nfs/dbraw/zinc/54/21/24/1028542124.db2.gz RXRWWUFXBVMEST-JTQLQIEISA-N -1 1 330.771 4.256 20 0 EIADMM Cc1c(-c2nc(-c3ccc([O-])cc3Cl)no2)oc2c1C(=O)CCC2 ZINC000445450974 1028545934 /nfs/dbraw/zinc/54/59/34/1028545934.db2.gz ZBZPDEVDAHDRNH-UHFFFAOYSA-N -1 1 344.754 4.183 20 0 EIADMM CCOc1cc(C(=O)N(C)C2CCC(CC)CC2)cc(Cl)c1[O-] ZINC000546584797 1028549376 /nfs/dbraw/zinc/54/93/76/1028549376.db2.gz SVPQPKAMWHPLLA-UHFFFAOYSA-N -1 1 339.863 4.485 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cc(F)cc4cccnc43)n2)c(Cl)c1 ZINC000445444405 1028574845 /nfs/dbraw/zinc/57/48/45/1028574845.db2.gz FOUNVOWIZDDFKX-UHFFFAOYSA-N -1 1 341.729 4.450 20 0 EIADMM [O-]c1ccc(-c2noc(CCCOc3ccc(Cl)cc3)n2)c(F)c1 ZINC000445453255 1028604096 /nfs/dbraw/zinc/60/40/96/1028604096.db2.gz BDRKOURKMFQOKQ-UHFFFAOYSA-N -1 1 348.761 4.246 20 0 EIADMM [O-]c1ccc(-c2noc(COc3ccc4ccccc4c3)n2)c(F)c1 ZINC000445460223 1028617918 /nfs/dbraw/zinc/61/79/18/1028617918.db2.gz OUIWKJILVHWWSD-UHFFFAOYSA-N -1 1 336.322 4.314 20 0 EIADMM COc1cc(CCc2nc(-c3ccc([O-])cc3F)no2)ccc1Cl ZINC000445460067 1028619599 /nfs/dbraw/zinc/61/95/99/1028619599.db2.gz MMEZVBYBIRNUJU-UHFFFAOYSA-N -1 1 348.761 4.029 20 0 EIADMM COc1cc(-c2nc(-c3cc(C)c(O)c(C)c3)no2)cc(Cl)c1[O-] ZINC000445462038 1028621241 /nfs/dbraw/zinc/62/12/41/1028621241.db2.gz BYCCIUAFFRKZAG-UHFFFAOYSA-N -1 1 346.770 4.094 20 0 EIADMM CC(C)c1ccc(OCc2nc(-c3ccc([O-])c(F)c3)no2)cc1 ZINC000445478979 1028627326 /nfs/dbraw/zinc/62/73/26/1028627326.db2.gz ILQCRMSIZOHBCH-UHFFFAOYSA-N -1 1 328.343 4.284 20 0 EIADMM CCOc1ccc(/C=C/c2nc(-c3ccc([O-])c(F)c3)no2)cc1 ZINC000445482491 1028630161 /nfs/dbraw/zinc/63/01/61/1028630161.db2.gz QDQKJHUIJDJRGX-BJMVGYQFSA-N -1 1 326.327 4.150 20 0 EIADMM Cc1cccc2c(CCc3nc(-c4ccc([O-])c(F)c4)no3)c[nH]c21 ZINC000445484390 1028633543 /nfs/dbraw/zinc/63/35/43/1028633543.db2.gz ZCBCXAJSPCQCAE-UHFFFAOYSA-N -1 1 337.354 4.156 20 0 EIADMM [O-]c1ccc(-c2noc([C@H]3C[C@@H]3c3c(F)cccc3F)n2)cc1F ZINC000445474182 1028645505 /nfs/dbraw/zinc/64/55/05/1028645505.db2.gz XIIZUXQRNSYOIC-UWVGGRQHSA-N -1 1 332.281 4.131 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cc(Br)cs3)n2)cc1F ZINC000445476899 1028647696 /nfs/dbraw/zinc/64/76/96/1028647696.db2.gz JPVJZDASUQSULL-UHFFFAOYSA-N -1 1 341.161 4.072 20 0 EIADMM COc1cc(F)cc(Br)c1Nc1cc(F)c([O-])c(F)c1 ZINC001213386632 1028776850 /nfs/dbraw/zinc/77/68/50/1028776850.db2.gz MTFNPFCDWQAMLO-UHFFFAOYSA-N -1 1 348.118 4.324 20 0 EIADMM C[C@@H](C(=O)[N-][C@@H](c1ccc(Cl)cc1)C(F)(F)F)C(F)(F)F ZINC000080440464 1028782830 /nfs/dbraw/zinc/78/28/30/1028782830.db2.gz CVBFUWGTKNNSOI-RCOVLWMOSA-N -1 1 333.659 4.258 20 0 EIADMM C[C@@H](C(=O)N=c1cc(-c2ccc(Cl)s2)[n-][nH]1)c1ccsc1 ZINC000536045635 1028804255 /nfs/dbraw/zinc/80/42/55/1028804255.db2.gz MGWHLTYCSLOLAG-MRVPVSSYSA-N -1 1 337.857 4.017 20 0 EIADMM O=C(CCCCC(=O)c1ccc(F)cc1)Nc1ccc(F)cc1[O-] ZINC000427658335 1028809784 /nfs/dbraw/zinc/80/97/84/1028809784.db2.gz XKWQAMLJKYYMPE-UHFFFAOYSA-N -1 1 333.334 4.052 20 0 EIADMM COCCCNc1cccc(F)c1Nc1cc(F)c([O-])c(F)c1 ZINC001213389035 1028851985 /nfs/dbraw/zinc/85/19/85/1028851985.db2.gz YPYCFHIVNJQNBM-UHFFFAOYSA-N -1 1 326.318 4.002 20 0 EIADMM C[C@@H](C(=O)N=c1cc(-c2ccc(Cl)s2)[n-][nH]1)c1cccs1 ZINC000536076662 1028887762 /nfs/dbraw/zinc/88/77/62/1028887762.db2.gz KWNHBHHYHVXZOK-MRVPVSSYSA-N -1 1 337.857 4.017 20 0 EIADMM CCCc1c(C(=O)Nc2ccc([O-])c(Cl)c2)[nH]c(C)c1C(C)=O ZINC000129594457 1029059881 /nfs/dbraw/zinc/05/98/81/1029059881.db2.gz DHUUSRJLFLTXIA-UHFFFAOYSA-N -1 1 334.803 4.090 20 0 EIADMM Cc1ccc(-c2nsc([N-]C(=O)c3cnc(C4CC4)s3)n2)s1 ZINC000524596095 1029100874 /nfs/dbraw/zinc/10/08/74/1029100874.db2.gz IICMBKSQBRPJDC-UHFFFAOYSA-N -1 1 348.478 4.161 20 0 EIADMM O=S(=O)([N-]c1ccc(CC(F)(F)F)cc1)c1cccc(Cl)c1 ZINC000525011952 1029400927 /nfs/dbraw/zinc/40/09/27/1029400927.db2.gz TVMXGVOQWYBGKM-UHFFFAOYSA-N -1 1 349.761 4.246 20 0 EIADMM CSc1ccc([O-])c(-c2nc([C@H]3CCOC4(CCCC4)C3)no2)c1 ZINC000897178783 1029509023 /nfs/dbraw/zinc/50/90/23/1029509023.db2.gz GGDJUZGRDYYNSI-LBPRGKRZSA-N -1 1 346.452 4.371 20 0 EIADMM CC(C)[C@H](CC1CCCCC1)C(=O)Nc1n[n-]c(C(F)(F)F)n1 ZINC000525235675 1029537116 /nfs/dbraw/zinc/53/71/16/1029537116.db2.gz UACJQZMQIPHGHV-NSHDSACASA-N -1 1 332.370 4.005 20 0 EIADMM CCSCc1cccc([N-]S(=O)(=O)c2cc(C)ccc2C)c1 ZINC000525527139 1029665411 /nfs/dbraw/zinc/66/54/11/1029665411.db2.gz OVZARLNLPVWFON-UHFFFAOYSA-N -1 1 335.494 4.357 20 0 EIADMM Cc1nc(-c2ccc(NC[C@@H]3CCC[C@H](C)C3)nc2)[n-]c(=O)c1C ZINC000301348393 1029713896 /nfs/dbraw/zinc/71/38/96/1029713896.db2.gz HXWIFTSQVPCEFA-SWLSCSKDSA-N -1 1 326.444 4.099 20 0 EIADMM Cc1nc(-c2ccc(N[C@H](C)[C@@H](C)c3ccccc3)nc2)[n-]c(=O)c1C ZINC000080687967 1029714222 /nfs/dbraw/zinc/71/42/22/1029714222.db2.gz NAGVUZJILRKFKO-UKRRQHHQSA-N -1 1 348.450 4.053 20 0 EIADMM Cc1ccc(CCNc2ccc(-c3nc(C)c(C)c(=O)[n-]3)cn2)c(C)c1 ZINC000301389071 1029722874 /nfs/dbraw/zinc/72/28/74/1029722874.db2.gz ZAXIRWFDGUDVKX-UHFFFAOYSA-N -1 1 348.450 4.132 20 0 EIADMM Cc1nc(-c2ccc(N[C@@H]3CC[C@@H](C)C[C@@H]3C)nc2)[n-]c(=O)c1C ZINC000301412071 1029727336 /nfs/dbraw/zinc/72/73/36/1029727336.db2.gz YSOBLBIEDZJTKU-BFQNTYOBSA-N -1 1 326.444 4.098 20 0 EIADMM COc1cc(C)cc([N-]S(=O)(=O)c2ccc3ccccc3c2)c1C ZINC000447272515 1029955476 /nfs/dbraw/zinc/95/54/76/1029955476.db2.gz RTXBVAMMOKAURH-UHFFFAOYSA-N -1 1 341.432 4.266 20 0 EIADMM O=S(=O)([N-]c1ccc(-c2ccco2)cc1F)c1ccccc1F ZINC000447269900 1029957357 /nfs/dbraw/zinc/95/73/57/1029957357.db2.gz GWFNIAJZHFYNPD-UHFFFAOYSA-N -1 1 335.331 4.026 20 0 EIADMM O=C(Cc1ccccc1OC1CCCC1)Nc1cccc(F)c1[O-] ZINC000530006447 1030028017 /nfs/dbraw/zinc/02/80/17/1030028017.db2.gz SFDNCBNIYMIQNR-UHFFFAOYSA-N -1 1 329.371 4.034 20 0 EIADMM O=S(=O)([N-]c1ccc2[nH]ccc2c1)c1ccc(Cl)c(Cl)c1 ZINC000107470274 1030030674 /nfs/dbraw/zinc/03/06/74/1030030674.db2.gz IFXPBHRDMZYWIB-UHFFFAOYSA-N -1 1 341.219 4.276 20 0 EIADMM CC(F)(F)c1ccccc1[N-]S(=O)(=O)c1ccc2c(c1)CCC2 ZINC000451079491 1030221818 /nfs/dbraw/zinc/22/18/18/1030221818.db2.gz AOXDODYYWORGHX-UHFFFAOYSA-N -1 1 337.391 4.088 20 0 EIADMM [O-]c1ccc(-c2noc(-c3ccccc3Oc3cccnc3)n2)c(F)c1 ZINC000685365543 1030240438 /nfs/dbraw/zinc/24/04/38/1030240438.db2.gz XZBAYQQNPPMDHX-UHFFFAOYSA-N -1 1 349.321 4.436 20 0 EIADMM CCOc1cc(C(=O)N([C@@H](C)c2ccco2)C2CC2)cc(Cl)c1[O-] ZINC000186683655 1030298805 /nfs/dbraw/zinc/29/88/05/1030298805.db2.gz JLCDRCJCZMKAHJ-NSHDSACASA-N -1 1 349.814 4.403 20 0 EIADMM O=S(=O)([N-][C@H]1CCc2c1cccc2Cl)c1cc2ccccc2o1 ZINC000530770617 1030699987 /nfs/dbraw/zinc/69/99/87/1030699987.db2.gz MZHVVSMAQDZWLI-HNNXBMFYSA-N -1 1 347.823 4.052 20 0 EIADMM O=C([O-])[C@@H]1CCCN(Cc2c(Cl)cccc2Oc2ccccc2)C1 ZINC000263450076 1030873155 /nfs/dbraw/zinc/87/31/55/1030873155.db2.gz ZFGYUQFNOLOMMD-CQSZACIVSA-N -1 1 345.826 4.429 20 0 EIADMM Cc1cc(C)c(C(=O)Nc2ccc([O-])c(Cl)c2)c(OC2CCC2)n1 ZINC000472402879 1031249062 /nfs/dbraw/zinc/24/90/62/1031249062.db2.gz JZEHJUJHZZIPLK-UHFFFAOYSA-N -1 1 346.814 4.241 20 0 EIADMM O=C(Nc1ccc(F)cc1[O-])c1cc2cc(Br)ccc2[nH]1 ZINC000532620967 1031433679 /nfs/dbraw/zinc/43/36/79/1031433679.db2.gz RCNYMNHJGBKHLS-UHFFFAOYSA-N -1 1 349.159 4.027 20 0 EIADMM COc1cc(C(=O)N2CCC[C@]2(C)CC(C)C)cc(Cl)c1[O-] ZINC000452985489 1031470633 /nfs/dbraw/zinc/47/06/33/1031470633.db2.gz ALIRVNUWCXABHK-QGZVFWFLSA-N -1 1 325.836 4.095 20 0 EIADMM C[C@H](Oc1ccc2ccccc2c1)C(=O)Nc1ccc(F)cc1[O-] ZINC000472438523 1031618369 /nfs/dbraw/zinc/61/83/69/1031618369.db2.gz HPWTUSSMEHHKHB-LBPRGKRZSA-N -1 1 325.339 4.091 20 0 EIADMM CCOc1cc(-c2noc(C(C)(C)OC(C)C)n2)cc(Cl)c1[O-] ZINC000453165372 1031670654 /nfs/dbraw/zinc/67/06/54/1031670654.db2.gz OYIYGXPJEUDFTN-UHFFFAOYSA-N -1 1 340.807 4.154 20 0 EIADMM O=C(CCc1ccccn1)Nc1cc(Cl)c([O-])c2ccccc12 ZINC001301158035 1031946957 /nfs/dbraw/zinc/94/69/57/1031946957.db2.gz YKQTVBURPPERAO-UHFFFAOYSA-N -1 1 326.783 4.165 20 0 EIADMM Cc1ccc(-c2ncco2)cc1[N-]S(=O)(=O)c1cccc(Cl)c1 ZINC000134678047 1032009176 /nfs/dbraw/zinc/00/91/76/1032009176.db2.gz HPSSLSRNGBAXOP-UHFFFAOYSA-N -1 1 348.811 4.104 20 0 EIADMM CCNC(=O)Nc1ccc(C)c(NCc2cccc([O-])c2Cl)c1 ZINC000645177341 1033988313 /nfs/dbraw/zinc/98/83/13/1033988313.db2.gz XUKQOIRZHOOLDU-UHFFFAOYSA-N -1 1 333.819 4.108 20 0 EIADMM CC[C@H](C)c1ccc(S(=O)(=O)[N-]c2cc(C(C)(C)C)n[nH]2)cc1 ZINC000322437243 1034661558 /nfs/dbraw/zinc/66/15/58/1034661558.db2.gz ZJHKXQLPFKEHIU-LBPRGKRZSA-N -1 1 335.473 4.022 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2ccc(Cl)cc2)cc1OC(F)F ZINC000513371868 1034899355 /nfs/dbraw/zinc/89/93/55/1034899355.db2.gz MLXPYCNAWGXLLZ-UHFFFAOYSA-N -1 1 347.770 4.051 20 0 EIADMM Cc1oc2ccccc2c1CC(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC000345262110 1035181448 /nfs/dbraw/zinc/18/14/48/1035181448.db2.gz MOOICTBJXAGJOS-UHFFFAOYSA-N -1 1 347.374 4.018 20 0 EIADMM CCOc1cc(-c2noc([C@@H](CC(C)C)OC)n2)cc(Cl)c1[O-] ZINC000420491380 1035640543 /nfs/dbraw/zinc/64/05/43/1035640543.db2.gz GXLBXQWTSACFIM-CYBMUJFWSA-N -1 1 340.807 4.228 20 0 EIADMM COc1ccc(-c2nc(-c3ccc(C(F)(F)F)s3)no2)c([O-])c1 ZINC000904972889 1035689862 /nfs/dbraw/zinc/68/98/62/1035689862.db2.gz ODIWVTUIZMDMSL-UHFFFAOYSA-N -1 1 342.298 4.198 20 0 EIADMM C[C@@H](CN(C)C(=O)c1ccc(Br)c([O-])c1)c1ccccc1 ZINC000485843502 1036310747 /nfs/dbraw/zinc/31/07/47/1036310747.db2.gz HUKPHNMXTMRIQY-LBPRGKRZSA-N -1 1 348.240 4.030 20 0 EIADMM COc1c(Cl)cccc1NC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000486119910 1036495111 /nfs/dbraw/zinc/49/51/11/1036495111.db2.gz XDNUMBAPGXPPGO-UHFFFAOYSA-N -1 1 327.167 4.352 20 0 EIADMM Cc1ccccc1S(=O)(=O)[N-]c1ccc2nc(C3CC3)sc2c1 ZINC000589434487 1036798498 /nfs/dbraw/zinc/79/84/98/1036798498.db2.gz FAJDOYVWPVHQFW-UHFFFAOYSA-N -1 1 344.461 4.283 20 0 EIADMM CC(C)(C(=O)Nc1cccc([O-])c1Br)C1CCCC1 ZINC000908708821 1036920244 /nfs/dbraw/zinc/92/02/44/1036920244.db2.gz CCATUFQFMXRVCQ-UHFFFAOYSA-N -1 1 326.234 4.310 20 0 EIADMM CCC[C@@H](C(=O)Nc1cccc([O-])c1Br)c1ccccn1 ZINC000908707987 1036922136 /nfs/dbraw/zinc/92/21/36/1036922136.db2.gz MBUUTQKBDCJMJN-LLVKDONJSA-N -1 1 349.228 4.072 20 0 EIADMM Cc1cccc2nc(-c3cc(F)ccc3Br)[n-]c(=O)c12 ZINC000476984572 1037135931 /nfs/dbraw/zinc/13/59/31/1037135931.db2.gz AQFJBHOFRKPNOA-UHFFFAOYSA-N -1 1 333.160 4.212 20 0 EIADMM CCc1ccccc1S(=O)(=O)[N-]c1ccc2oc(C3CC3)nc2c1 ZINC000488247999 1037452710 /nfs/dbraw/zinc/45/27/10/1037452710.db2.gz WXDWAFRPOYORGG-UHFFFAOYSA-N -1 1 342.420 4.068 20 0 EIADMM C[C@@H](Oc1cccc(Cl)c1Cl)C(=O)Nc1c([O-])cccc1F ZINC000605440139 1037788170 /nfs/dbraw/zinc/78/81/70/1037788170.db2.gz LFVILYOBLJWJTJ-MRVPVSSYSA-N -1 1 344.169 4.244 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1CC2(CCC2)[C@@H]1c1cccnc1 ZINC000912040763 1037875649 /nfs/dbraw/zinc/87/56/49/1037875649.db2.gz IYDUZXOPUPGFMF-FQEVSTJZSA-N -1 1 344.414 4.308 20 0 EIADMM C[C@@H]1c2ccc(F)cc2CCN1C(=O)c1cc2ccccc2cc1[O-] ZINC000606317031 1038001595 /nfs/dbraw/zinc/00/15/95/1038001595.db2.gz FHRVXOYEOPQDGJ-CYBMUJFWSA-N -1 1 335.378 4.444 20 0 EIADMM CCc1nc(SC[C@H](OC)c2ccc(Cl)cc2)[n-]c(=O)c1C ZINC000574703966 1038328836 /nfs/dbraw/zinc/32/88/36/1038328836.db2.gz JQDBRXWNZJHFHT-AWEZNQCLSA-N -1 1 338.860 4.186 20 0 EIADMM CC(C)C[C@H]1CCCCN1C(=O)c1ccc(Br)c([O-])c1 ZINC000490427593 1038623374 /nfs/dbraw/zinc/62/33/74/1038623374.db2.gz AHRDACVRUSATCK-CYBMUJFWSA-N -1 1 340.261 4.196 20 0 EIADMM CCOc1cc(C(=O)N(C)Cc2cc(C)cc(C)c2)cc(Cl)c1[O-] ZINC000434340653 1039377737 /nfs/dbraw/zinc/37/77/37/1039377737.db2.gz GJJWPMXPXOKFMM-UHFFFAOYSA-N -1 1 347.842 4.333 20 0 EIADMM CCc1c(C(=O)Nc2ccc([O-])c(F)c2F)cnn1C(CC)CC ZINC000456786828 1039604983 /nfs/dbraw/zinc/60/49/83/1039604983.db2.gz OUZXEFDDZCVIJZ-UHFFFAOYSA-N -1 1 337.370 4.043 20 0 EIADMM Cc1cc(OCC(=O)Nc2ccc([O-])c(F)c2F)ccc1C(C)C ZINC000456795149 1039610600 /nfs/dbraw/zinc/61/06/00/1039610600.db2.gz UAVBJJCKWBPHOW-UHFFFAOYSA-N -1 1 335.350 4.120 20 0 EIADMM COc1cc([N-]S(=O)(=O)c2cccc3ccccc32)c(C)cc1C ZINC000478676171 1039858131 /nfs/dbraw/zinc/85/81/31/1039858131.db2.gz OBCXZPCRXJZSSC-UHFFFAOYSA-N -1 1 341.432 4.266 20 0 EIADMM Cc1ccc(F)c(S(=O)(=O)[N-]c2cccc(Cl)c2Cl)c1 ZINC000534942711 1039863468 /nfs/dbraw/zinc/86/34/68/1039863468.db2.gz XUNXZNSACFCBIP-UHFFFAOYSA-N -1 1 334.199 4.242 20 0 EIADMM Cc1cccc(S(=O)(=O)[N-]c2ccc3oc(C(C)(C)C)nc3c2)c1 ZINC000482132605 1040027675 /nfs/dbraw/zinc/02/76/75/1040027675.db2.gz QUYVBBDGSOOSHV-UHFFFAOYSA-N -1 1 344.436 4.235 20 0 EIADMM Cc1cc(C)cc(-c2nnc([N-]C(=O)c3sccc3F)s2)c1 ZINC000551194257 1040055947 /nfs/dbraw/zinc/05/59/47/1040055947.db2.gz POSBDIMLVYGFQL-UHFFFAOYSA-N -1 1 333.413 4.275 20 0 EIADMM Cc1oc([C@H](C)[N@H+]2CC[C@H](C(F)(F)F)C3(CCC3)C2)cc1C(=O)[O-] ZINC000518201341 1040084472 /nfs/dbraw/zinc/08/44/72/1040084472.db2.gz WNZILTIDIOPEED-HZMBPMFUSA-N -1 1 345.361 4.402 20 0 EIADMM Cc1oc([C@H](C)N2CC[C@H](C(F)(F)F)C3(CCC3)C2)cc1C(=O)[O-] ZINC000518201341 1040084487 /nfs/dbraw/zinc/08/44/87/1040084487.db2.gz WNZILTIDIOPEED-HZMBPMFUSA-N -1 1 345.361 4.402 20 0 EIADMM O=c1cc(C(F)(F)F)nc(SCc2ccc3ncccc3c2)[n-]1 ZINC000547434957 1040245472 /nfs/dbraw/zinc/24/54/72/1040245472.db2.gz JWSOIDKWVCHPNP-UHFFFAOYSA-N -1 1 337.326 4.042 20 0 EIADMM CCN(Cc1ccccc1C)C(=O)c1ccc(Br)c([O-])c1 ZINC000482440161 1040248306 /nfs/dbraw/zinc/24/83/06/1040248306.db2.gz VMTBHEIYRUCNKR-UHFFFAOYSA-N -1 1 348.240 4.125 20 0 EIADMM Cc1ccc(C(=O)Nc2cc(C)cc(Br)c2[O-])c(C)c1 ZINC000482672355 1040423996 /nfs/dbraw/zinc/42/39/96/1040423996.db2.gz KIMANFPPIDFUTA-UHFFFAOYSA-N -1 1 334.213 4.332 20 0 EIADMM Cc1cc(Br)c([O-])c(NC(=O)c2ccc(C(C)C)nc2)c1 ZINC000482706822 1040433688 /nfs/dbraw/zinc/43/36/88/1040433688.db2.gz JQBKJCCZWNKDJM-UHFFFAOYSA-N -1 1 349.228 4.234 20 0 EIADMM COc1cc(C(=O)Nc2nc(C(C)(C)C)cs2)cc(Cl)c1[O-] ZINC000553887144 1040617088 /nfs/dbraw/zinc/61/70/88/1040617088.db2.gz PHABNDJKZWDMLJ-UHFFFAOYSA-N -1 1 340.832 4.061 20 0 EIADMM Cc1c(Br)cccc1C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000088441706 1040685255 /nfs/dbraw/zinc/68/52/55/1040685255.db2.gz OQONQYQJTCAHMT-UHFFFAOYSA-N -1 1 340.604 4.369 20 0 EIADMM Cc1ccc2[nH]cc(CCc3nc(-c4ccc([O-])cc4F)no3)c2c1 ZINC000445459181 1040820358 /nfs/dbraw/zinc/82/03/58/1040820358.db2.gz YJHDJZLNGIOKEJ-UHFFFAOYSA-N -1 1 337.354 4.156 20 0 EIADMM COc1ccc(C2(c3nc(-c4ccc([O-])cc4F)no3)CCC2)cc1 ZINC000445462984 1040891930 /nfs/dbraw/zinc/89/19/30/1040891930.db2.gz NCODHIWAUQFBGX-UHFFFAOYSA-N -1 1 340.354 4.060 20 0 EIADMM CCc1cc(=O)[n-]c(S[C@H](C)c2ccc(OC(F)F)cc2)n1 ZINC000436190245 1040931031 /nfs/dbraw/zinc/93/10/31/1040931031.db2.gz TVMVLEZXWFPELE-SECBINFHSA-N -1 1 326.368 4.199 20 0 EIADMM CCOCc1cccc([N-]S(=O)(=O)c2cccc(C(C)C)c2)c1 ZINC000460821768 1040954834 /nfs/dbraw/zinc/95/48/34/1040954834.db2.gz WVLOQUZNIYMYCZ-UHFFFAOYSA-N -1 1 333.453 4.147 20 0 EIADMM CCc1cc(=O)[n-]c(S[C@@H](C)C(=O)c2ccc(C(C)C)cc2)n1 ZINC000436197104 1040968080 /nfs/dbraw/zinc/96/80/80/1040968080.db2.gz KURXTTXQDFTENT-LBPRGKRZSA-N -1 1 330.453 4.232 20 0 EIADMM Cc1coc(-c2ccc(C)c([N-]S(=O)(=O)c3ccc(C)cc3)c2)n1 ZINC000161083175 1040981955 /nfs/dbraw/zinc/98/19/55/1040981955.db2.gz HDVUQQILGDBMHE-UHFFFAOYSA-N -1 1 342.420 4.068 20 0 EIADMM Cc1cc(C)cc([N-]S(=O)(=O)c2ccc(CC(F)(F)F)cc2)c1 ZINC000480189074 1041064303 /nfs/dbraw/zinc/06/43/03/1041064303.db2.gz BGSMMQWWWQZWOE-UHFFFAOYSA-N -1 1 343.370 4.209 20 0 EIADMM Cc1cnc(Cl)c(CN[C@H](CC(=O)[O-])c2cccc(Cl)c2)c1 ZINC000903998241 1041245445 /nfs/dbraw/zinc/24/54/45/1041245445.db2.gz JDALJIPRHVCNIU-CQSZACIVSA-N -1 1 339.222 4.002 20 0 EIADMM CC(C)c1ccc([C@@H](CC(=O)[O-])NCc2ccc(Cl)cn2)cc1 ZINC000904002275 1041250306 /nfs/dbraw/zinc/25/03/06/1041250306.db2.gz RGKRZNOSLVCKBA-QGZVFWFLSA-N -1 1 332.831 4.164 20 0 EIADMM COc1cc(NC(=O)c2ccc3ccccc3c2[O-])c(C)c(OC)c1 ZINC000436488984 1041290171 /nfs/dbraw/zinc/29/01/71/1041290171.db2.gz FXPUYJCIVOZLAC-UHFFFAOYSA-N -1 1 337.375 4.123 20 0 EIADMM O=C([O-])C[C@H](NCc1csc(C(F)(F)F)c1)c1ccccc1F ZINC000904044524 1041297777 /nfs/dbraw/zinc/29/77/77/1041297777.db2.gz CBXYNAHPMVKRBW-LBPRGKRZSA-N -1 1 347.333 4.212 20 0 EIADMM COC(=O)c1ccc([O-])c(NC(=O)[C@@H](C)c2ccc3ccccc3c2)c1 ZINC000436515673 1041299755 /nfs/dbraw/zinc/29/97/55/1041299755.db2.gz SOINAFDVFNOUQN-ZDUSSCGKSA-N -1 1 349.386 4.074 20 0 EIADMM [O-]c1ccc(-c2noc(Cc3c[nH]c4cccc(Cl)c34)n2)cc1F ZINC000436522222 1041303856 /nfs/dbraw/zinc/30/38/56/1041303856.db2.gz SAZRVGRIALGMEG-UHFFFAOYSA-N -1 1 343.745 4.307 20 0 EIADMM CCCC1(CNC(=O)c2cc(Cl)c([O-])c(OCC)c2)CCC1 ZINC000436521182 1041306076 /nfs/dbraw/zinc/30/60/76/1041306076.db2.gz CJFNPVREYKGXSY-UHFFFAOYSA-N -1 1 325.836 4.145 20 0 EIADMM CSc1ccc(NC(=O)c2c(F)ccc([O-])c2F)cc1Cl ZINC000538388018 1041306680 /nfs/dbraw/zinc/30/66/80/1041306680.db2.gz YHABZNLFAGODKX-UHFFFAOYSA-N -1 1 329.755 4.298 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1CCc2c([nH]c3ccccc32)C1 ZINC000436528007 1041312105 /nfs/dbraw/zinc/31/21/05/1041312105.db2.gz VQVBLNYWGKIUDJ-UHFFFAOYSA-N -1 1 342.398 4.225 20 0 EIADMM Cc1ccccc1[C@H]1C[C@@H](C)N(C(=O)c2cc(Cl)ccc2[O-])C1 ZINC000436528920 1041313630 /nfs/dbraw/zinc/31/36/30/1041313630.db2.gz MYDXWDVEWPKZAJ-KGLIPLIRSA-N -1 1 329.827 4.372 20 0 EIADMM C[C@@H](NC(=O)c1cc(Cl)ccc1[O-])c1ncc(-c2ccccc2)o1 ZINC000436534872 1041317049 /nfs/dbraw/zinc/31/70/49/1041317049.db2.gz YNCVOZODYACREN-LLVKDONJSA-N -1 1 342.782 4.192 20 0 EIADMM COC(=O)c1cnc(S[C@@H](c2ccccc2)c2ccccc2C)[n-]1 ZINC000484552806 1041323561 /nfs/dbraw/zinc/32/35/61/1041323561.db2.gz ABMYHLLJTFCTNG-KRWDZBQOSA-N -1 1 338.432 4.386 20 0 EIADMM COC(=O)c1c[n-]c(S[C@@H](c2ccccc2)c2ccccc2C)n1 ZINC000484552806 1041323574 /nfs/dbraw/zinc/32/35/74/1041323574.db2.gz ABMYHLLJTFCTNG-KRWDZBQOSA-N -1 1 338.432 4.386 20 0 EIADMM CCN1CCN(C(=O)c2ccc3ccccc3c2[O-])c2ccccc21 ZINC000436554592 1041329147 /nfs/dbraw/zinc/32/91/47/1041329147.db2.gz GDQHTSHSLIMJKU-UHFFFAOYSA-N -1 1 332.403 4.032 20 0 EIADMM C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1cc2ccccc2cc1[O-] ZINC000436545141 1041338731 /nfs/dbraw/zinc/33/87/31/1041338731.db2.gz MQXOOWKGMWMRJK-ABAIWWIYSA-N -1 1 337.341 4.348 20 0 EIADMM C[C@@H]1[C@@H](Cc2ccccc2)CCN1C(=O)c1ccc(Cl)cc1[O-] ZINC000436576274 1041340497 /nfs/dbraw/zinc/34/04/97/1041340497.db2.gz PBFUWOACWFWKHO-UKRRQHHQSA-N -1 1 329.827 4.139 20 0 EIADMM CC(C)[C@@H](Cc1ccc(F)cc1)N(C)C(=O)c1cc(F)ccc1[O-] ZINC000436576801 1041341865 /nfs/dbraw/zinc/34/18/65/1041341865.db2.gz RGYMHZZOHBRPHY-QGZVFWFLSA-N -1 1 333.378 4.010 20 0 EIADMM CC(C)c1ccc(C(=O)N2CCCN(C)c3ccc(F)cc32)c([O-])c1 ZINC000436563352 1041344775 /nfs/dbraw/zinc/34/47/75/1041344775.db2.gz LLWQEMRXVYYGPB-UHFFFAOYSA-N -1 1 342.414 4.141 20 0 EIADMM CC(C)c1ccc(C(=O)N2C[C@@H](C)Oc3cc(F)ccc32)c([O-])c1 ZINC000436592752 1041351347 /nfs/dbraw/zinc/35/13/47/1041351347.db2.gz YKRPWIZFXHQPAG-GFCCVEGCSA-N -1 1 329.371 4.082 20 0 EIADMM COc1ccc(C(=O)N2CCc3cc(-c4ccccc4)ccc32)c([O-])c1 ZINC000436594684 1041353754 /nfs/dbraw/zinc/35/37/54/1041353754.db2.gz JONQHDUUQLZGGJ-UHFFFAOYSA-N -1 1 345.398 4.271 20 0 EIADMM CCc1c(NC(=O)c2ccccc2[O-])cnn1-c1ccc(Cl)cc1 ZINC000436597765 1041355478 /nfs/dbraw/zinc/35/54/78/1041355478.db2.gz WUNQEBWEECXOOU-UHFFFAOYSA-N -1 1 341.798 4.046 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N(Cc1ccc(O)cc1)CC1CC1 ZINC000436599997 1041356770 /nfs/dbraw/zinc/35/67/70/1041356770.db2.gz GEVRHKIATHYAPK-UHFFFAOYSA-N -1 1 347.414 4.303 20 0 EIADMM O=C(C[C@@H]1CCCN1C(=O)c1cc2ccccc2cc1[O-])c1ccco1 ZINC000436584118 1041359761 /nfs/dbraw/zinc/35/97/61/1041359761.db2.gz LMKKLTJAZCVWMN-INIZCTEOSA-N -1 1 349.386 4.016 20 0 EIADMM COc1ccc(C(=O)Nc2cccc(CCC(F)(F)F)c2)c([O-])c1 ZINC000436581381 1041359904 /nfs/dbraw/zinc/35/99/04/1041359904.db2.gz AWKVXAOJTWSTFJ-UHFFFAOYSA-N -1 1 339.313 4.148 20 0 EIADMM COc1ccc(N(C)C(=O)c2ccc(C(C)C)cc2[O-])cc1Cl ZINC000436585457 1041361403 /nfs/dbraw/zinc/36/14/03/1041361403.db2.gz MEAMLVBTCVENNM-UHFFFAOYSA-N -1 1 333.815 4.454 20 0 EIADMM C[C@H]1CN(C(=O)c2ccc3ccccc3c2[O-])c2ccc(F)cc2O1 ZINC000436586238 1041362397 /nfs/dbraw/zinc/36/23/97/1041362397.db2.gz AXJLCIPJGGQWOJ-LBPRGKRZSA-N -1 1 337.350 4.112 20 0 EIADMM CC[C@H]1CN(C(=O)c2cc(F)ccc2[O-])CC[C@@H]1c1ccccc1 ZINC000436587173 1041362666 /nfs/dbraw/zinc/36/26/66/1041362666.db2.gz ODIMUCOCEKTUOM-YOEHRIQHSA-N -1 1 327.399 4.187 20 0 EIADMM O=C(NC[C@H]1CCO[C@H]1c1ccccc1)c1ccc2ccccc2c1[O-] ZINC000436587428 1041363860 /nfs/dbraw/zinc/36/38/60/1041363860.db2.gz FDSRUZRGHKCZLC-UTKZUKDTSA-N -1 1 347.414 4.053 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1CCc2c(F)ccc(F)c2C1 ZINC000436591832 1041366012 /nfs/dbraw/zinc/36/60/12/1041366012.db2.gz YFKFDBNDGTTZOU-UHFFFAOYSA-N -1 1 339.341 4.022 20 0 EIADMM CCCN(Cc1ccccc1)C(=O)c1cc(Cl)c([O-])c(OCC)c1 ZINC000436601202 1041368375 /nfs/dbraw/zinc/36/83/75/1041368375.db2.gz BZXMRVJBCNQPIR-UHFFFAOYSA-N -1 1 347.842 4.497 20 0 EIADMM CCCC1CCC(N(C)C(=O)c2cc(Cl)c([O-])c(OC)c2)CC1 ZINC000436601105 1041369179 /nfs/dbraw/zinc/36/91/79/1041369179.db2.gz BKALKFWHEDPDEJ-UHFFFAOYSA-N -1 1 339.863 4.485 20 0 EIADMM C[C@@H]([C@@H]1Cc2ccccc2O1)N(C)C(=O)c1ccc2ccccc2c1[O-] ZINC000436609845 1041371151 /nfs/dbraw/zinc/37/11/51/1041371151.db2.gz WPDCLCYPRZIVIH-XOBRGWDASA-N -1 1 347.414 4.010 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1CCC[C@H](Nc2ccccc2)C1 ZINC000436611124 1041373579 /nfs/dbraw/zinc/37/35/79/1041373579.db2.gz YNRQCYSDTZRMSW-IBGZPJMESA-N -1 1 346.430 4.262 20 0 EIADMM Cc1oc(-c2ccsc2)nc1CSc1nc(C)c(C)c(=O)[n-]1 ZINC000538516566 1041402474 /nfs/dbraw/zinc/40/24/74/1041402474.db2.gz HLSUZHNDOXSMBJ-UHFFFAOYSA-N -1 1 333.438 4.116 20 0 EIADMM O=C(Nc1csc(-c2ccncc2)n1)c1cc2ccccc2cc1[O-] ZINC000436672669 1041411448 /nfs/dbraw/zinc/41/14/48/1041411448.db2.gz NCEDLPIYZDUCHF-UHFFFAOYSA-N -1 1 347.399 4.316 20 0 EIADMM CC(=O)Nc1ccc([O-])c(-c2nc([C@@H]3CCCC(C)(C)C3)no2)c1 ZINC000436686867 1041421152 /nfs/dbraw/zinc/42/11/52/1041421152.db2.gz GQXBWWDDZXNBKV-GFCCVEGCSA-N -1 1 329.400 4.084 20 0 EIADMM O=C(c1ccc([O-])cc1F)N1C[C@H](c2ccccc2)[C@@H]2CCCC[C@@H]21 ZINC000436683239 1041421548 /nfs/dbraw/zinc/42/15/48/1041421548.db2.gz ZBBAGZGALKPBNZ-HQRMLTQVSA-N -1 1 339.410 4.330 20 0 EIADMM [O-]c1ccc(-c2nc(-c3cccc(-c4cscn4)c3)no2)c(F)c1 ZINC000436687738 1041423560 /nfs/dbraw/zinc/42/35/60/1041423560.db2.gz IWXWPNSLITUOPI-UHFFFAOYSA-N -1 1 339.351 4.372 20 0 EIADMM COc1cccc([C@H]2CCCN2C(=O)c2ccc(Cl)cc2[O-])c1 ZINC000436722876 1041444393 /nfs/dbraw/zinc/44/43/93/1041444393.db2.gz QCHVHEQFJYKABS-MRXNPFEDSA-N -1 1 331.799 4.032 20 0 EIADMM CCN(C(=O)c1ccc(Cl)cc1[O-])[C@H](C)c1cccc(OC)c1 ZINC000436721501 1041444780 /nfs/dbraw/zinc/44/47/80/1041444780.db2.gz INJZYZMRFPZNEO-GFCCVEGCSA-N -1 1 333.815 4.278 20 0 EIADMM CC(C)c1nc(CCNC(=O)c2ccc3ccccc3c2[O-])cs1 ZINC000436723401 1041444797 /nfs/dbraw/zinc/44/47/97/1041444797.db2.gz LKQVXDIDZOFBHX-UHFFFAOYSA-N -1 1 340.448 4.098 20 0 EIADMM Cc1ccc(Cl)c2sc(NC(=O)c3ccc([O-])cc3F)nc21 ZINC000436730955 1041454051 /nfs/dbraw/zinc/45/40/51/1041454051.db2.gz ZBUSNYAFFOWHRL-UHFFFAOYSA-N -1 1 336.775 4.355 20 0 EIADMM C[C@@H](c1cc(F)ccc1F)N(C)C(=O)c1ccc(Cl)cc1[O-] ZINC000436759885 1041457791 /nfs/dbraw/zinc/45/77/91/1041457791.db2.gz HVLJKHARSJCMME-VIFPVBQESA-N -1 1 325.742 4.157 20 0 EIADMM CCSCC[C@@H](C)N(C)C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436750029 1041462044 /nfs/dbraw/zinc/46/20/44/1041462044.db2.gz DOJZKWVWCBRTOL-SNVBAGLBSA-N -1 1 335.391 4.015 20 0 EIADMM CCC[C@@H](NC(=O)c1cc(Cl)c([O-])c(OC)c1)c1ccccc1 ZINC000436747783 1041462079 /nfs/dbraw/zinc/46/20/79/1041462079.db2.gz CLGMKZFQGRNHEN-OAHLLOKOSA-N -1 1 333.815 4.325 20 0 EIADMM O=C(N[C@H](c1ccccc1)[C@H]1CCOC1)c1ccc2ccccc2c1[O-] ZINC000436750973 1041463585 /nfs/dbraw/zinc/46/35/85/1041463585.db2.gz PZYWOMZMYLJHKW-FXAWDEMLSA-N -1 1 347.414 4.053 20 0 EIADMM C[C@@H]1[C@H](c2ccccc2)CCN1C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436751754 1041463676 /nfs/dbraw/zinc/46/36/76/1041463676.db2.gz NQYLHULBDOOYOP-IUODEOHRSA-N -1 1 349.352 4.429 20 0 EIADMM C[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436752411 1041464974 /nfs/dbraw/zinc/46/49/74/1041464974.db2.gz RJJZWEMMSGEYMS-JTNHKYCSSA-N -1 1 327.346 4.204 20 0 EIADMM C[C@@H]1CN(C(=O)c2ccc(C(F)(F)F)cc2[O-])[C@@H]1c1ccccc1 ZINC000436754336 1041467073 /nfs/dbraw/zinc/46/70/73/1041467073.db2.gz YHFMAIIVQXHULH-BZNIZROVSA-N -1 1 335.325 4.244 20 0 EIADMM CC[C@@]1(C(=O)[O-])CCCN(Cc2cc(Cl)cc(C(F)(F)F)c2)C1 ZINC000904399797 1041467203 /nfs/dbraw/zinc/46/72/03/1041467203.db2.gz BRGNGZRCGRRNNH-OAHLLOKOSA-N -1 1 349.780 4.436 20 0 EIADMM CC(C)(C)C1=CCN(C(=O)c2ccc(C(F)(F)F)cc2[O-])CC1 ZINC000436764458 1041474123 /nfs/dbraw/zinc/47/41/23/1041474123.db2.gz QUTSNEALQUDPKE-UHFFFAOYSA-N -1 1 327.346 4.229 20 0 EIADMM O=C(c1ccc(C(F)(F)F)cc1[O-])N(Cc1cccs1)C1CC1 ZINC000436764314 1041474337 /nfs/dbraw/zinc/47/43/37/1041474337.db2.gz QFWKXJKLYHKJMM-UHFFFAOYSA-N -1 1 341.354 4.277 20 0 EIADMM Cc1ccccc1OCCCN(C)C(=O)c1cc2ccccc2cc1[O-] ZINC000436807723 1041491354 /nfs/dbraw/zinc/49/13/54/1041491354.db2.gz LRCMUCZSSFQNGO-UHFFFAOYSA-N -1 1 349.430 4.395 20 0 EIADMM C[C@H](NC(=O)c1cc2ccccc2cc1[O-])c1ccc(Cl)cn1 ZINC000436844467 1041512073 /nfs/dbraw/zinc/51/20/73/1041512073.db2.gz NPRLRHFGBFYOBT-NSHDSACASA-N -1 1 326.783 4.085 20 0 EIADMM CC[C@H](c1cccc(OC)c1)N(C)C(=O)c1ccc(Cl)cc1[O-] ZINC000436845601 1041513698 /nfs/dbraw/zinc/51/36/98/1041513698.db2.gz KKQCGRNBMZARCD-MRXNPFEDSA-N -1 1 333.815 4.278 20 0 EIADMM C[C@@H](NC(=O)c1ccc([O-])cc1F)C(c1ccccc1)c1ccccc1 ZINC000436862144 1041521083 /nfs/dbraw/zinc/52/10/83/1041521083.db2.gz MZMNMQWMDJLKSD-OAHLLOKOSA-N -1 1 349.405 4.482 20 0 EIADMM O=C(c1ccc([O-])cc1F)N1CCC(CCc2ccccc2)CC1 ZINC000436860134 1041521116 /nfs/dbraw/zinc/52/11/16/1041521116.db2.gz DYBKOXGLVVMERK-UHFFFAOYSA-N -1 1 327.399 4.016 20 0 EIADMM CCc1c(-c2nc(-c3ccc([O-])cc3F)no2)cnn1CCC(C)C ZINC000436877033 1041528382 /nfs/dbraw/zinc/52/83/82/1041528382.db2.gz CVZLNSOAJAGSRB-UHFFFAOYSA-N -1 1 344.390 4.053 20 0 EIADMM C[C@@H](NC(=O)c1cc(F)ccc1[O-])c1ccc(-c2ccncc2)cc1 ZINC000436871412 1041529814 /nfs/dbraw/zinc/52/98/14/1041529814.db2.gz SMUPKRGFZXHQSJ-CYBMUJFWSA-N -1 1 336.366 4.084 20 0 EIADMM COc1ccc(C(=O)Nc2ccc(-c3ccncc3)c(C)c2)c([O-])c1 ZINC000436871176 1041530168 /nfs/dbraw/zinc/53/01/68/1041530168.db2.gz PYXHAMLMFAPEFB-UHFFFAOYSA-N -1 1 334.375 4.024 20 0 EIADMM C[C@H](NC(=O)c1cc(F)ccc1[O-])c1ccc(-c2cccnc2)cc1 ZINC000436870901 1041530486 /nfs/dbraw/zinc/53/04/86/1041530486.db2.gz RDCGIEGDBOKVSS-ZDUSSCGKSA-N -1 1 336.366 4.084 20 0 EIADMM CC(C)[C@@H](c1nc(-c2ccc([O-])cc2Cl)no1)c1cccnc1 ZINC000436874298 1041531053 /nfs/dbraw/zinc/53/10/53/1041531053.db2.gz SOJYJFQLGALABA-OAHLLOKOSA-N -1 1 329.787 4.279 20 0 EIADMM [O-]c1ccc(-c2noc([C@H]3C[C@H]3c3ccc(F)cc3F)n2)c(F)c1 ZINC000436875245 1041531687 /nfs/dbraw/zinc/53/16/87/1041531687.db2.gz UEHWAVIIJKWJGC-STQMWFEESA-N -1 1 332.281 4.131 20 0 EIADMM [O-]c1ccc(-c2noc(-c3ccccc3OCC3CC3)n2)c(F)c1 ZINC000436874460 1041532765 /nfs/dbraw/zinc/53/27/65/1041532765.db2.gz QQYJRXVDTFSOMV-UHFFFAOYSA-N -1 1 326.327 4.037 20 0 EIADMM [O-]c1ccc(-c2noc(-c3ccc(-c4cc[nH]n4)s3)n2)c(Cl)c1 ZINC000436875485 1041534962 /nfs/dbraw/zinc/53/49/62/1041534962.db2.gz XODRFZKWDBACPQ-UHFFFAOYSA-N -1 1 344.783 4.214 20 0 EIADMM [O-]c1ccc(-c2noc(-c3ccccc3OCC3CC3)n2)cc1F ZINC000436881217 1041537291 /nfs/dbraw/zinc/53/72/91/1041537291.db2.gz WKSJVMYOMDNJQD-UHFFFAOYSA-N -1 1 326.327 4.037 20 0 EIADMM CCOc1cc(Cl)ccc1-c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000436880256 1041537435 /nfs/dbraw/zinc/53/74/35/1041537435.db2.gz QLRJUKNHGQWSLE-UHFFFAOYSA-N -1 1 334.734 4.300 20 0 EIADMM Cc1nc(-c2ccccc2NC(=O)c2ccc([O-])cc2F)cs1 ZINC000436905689 1041547280 /nfs/dbraw/zinc/54/72/80/1041547280.db2.gz ILRSYTWBVBNJNK-UHFFFAOYSA-N -1 1 328.368 4.216 20 0 EIADMM [O-]c1ccc(F)cc1-c1nc(-c2ccc(Oc3cccnc3)cc2)no1 ZINC000436919746 1041557553 /nfs/dbraw/zinc/55/75/53/1041557553.db2.gz OQLQXJHGZDVHBS-UHFFFAOYSA-N -1 1 349.321 4.436 20 0 EIADMM O=C(Nc1csc(-c2ccncc2)n1)c1ccc2ccccc2c1[O-] ZINC000436917444 1041557606 /nfs/dbraw/zinc/55/76/06/1041557606.db2.gz DQOAJOJDYHSQPL-UHFFFAOYSA-N -1 1 347.399 4.316 20 0 EIADMM C[C@@H]1C[C@H](c2ccccc2)[C@H](C)N1C(=O)c1ccc(Cl)cc1[O-] ZINC000436927844 1041562484 /nfs/dbraw/zinc/56/24/84/1041562484.db2.gz AAWQBWMIUQFTKN-IGCXYCKISA-N -1 1 329.827 4.452 20 0 EIADMM C[C@@H]1C[C@H](c2ccccc2)[C@H](C)N1C(=O)c1cc(Cl)ccc1[O-] ZINC000436939556 1041566601 /nfs/dbraw/zinc/56/66/01/1041566601.db2.gz OTBNVFXIASVBLV-WWGRRREGSA-N -1 1 329.827 4.452 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cc4cc(Cl)sc4[nH]3)n2)cc1F ZINC000436957229 1041574397 /nfs/dbraw/zinc/57/43/97/1041574397.db2.gz WWGAJASRVFQIBJ-UHFFFAOYSA-N -1 1 335.747 4.445 20 0 EIADMM C[C@H](NC(=O)c1c([O-])cccc1F)c1nc(-c2ccccc2)cs1 ZINC000436958110 1041574711 /nfs/dbraw/zinc/57/47/11/1041574711.db2.gz ZIGQUEBKAKCYMW-NSHDSACASA-N -1 1 342.395 4.146 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N1CC[C@H](c2cccc(Cl)c2)C1 ZINC000436980993 1041580479 /nfs/dbraw/zinc/58/04/79/1041580479.db2.gz BCACCHNVIADYNV-LBPRGKRZSA-N -1 1 336.218 4.329 20 0 EIADMM O=C(CCCOc1ccc(Cl)cc1)Nc1ccc([O-])c(Cl)c1 ZINC000541888023 1042157362 /nfs/dbraw/zinc/15/73/62/1042157362.db2.gz WYHUTEQLQCSKSW-UHFFFAOYSA-N -1 1 340.206 4.497 20 0 EIADMM O=C(NCc1cccc2cccnc21)c1cc2ccccc2cc1[O-] ZINC000303022890 1042252419 /nfs/dbraw/zinc/25/24/19/1042252419.db2.gz UVMOYGXHFPFARG-UHFFFAOYSA-N -1 1 328.371 4.024 20 0 EIADMM O=c1nc(-c2cncs2)[n-]c2scc(-c3ccc(F)cc3)c21 ZINC000426091861 1042293876 /nfs/dbraw/zinc/29/38/76/1042293876.db2.gz YPQWGJZTJLODMB-UHFFFAOYSA-N -1 1 329.381 4.327 20 0 EIADMM CCOCc1ccc([N-]S(=O)(=O)c2ccc3ccccc3c2)cc1 ZINC000438719952 1042324655 /nfs/dbraw/zinc/32/46/55/1042324655.db2.gz FBPYKJFZAAPDCK-UHFFFAOYSA-N -1 1 341.432 4.177 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc3scnc3c2)cc1Cl ZINC000509585489 1042393529 /nfs/dbraw/zinc/39/35/29/1042393529.db2.gz NVNYEHNSSOXWAI-UHFFFAOYSA-N -1 1 338.841 4.059 20 0 EIADMM CC(C)c1cccc(S(=O)(=O)[N-]c2ccc(-c3cnco3)cc2)c1 ZINC000172886868 1042508706 /nfs/dbraw/zinc/50/87/06/1042508706.db2.gz GYMDYODBTQIXPT-UHFFFAOYSA-N -1 1 342.420 4.266 20 0 EIADMM CCC[C@@H](C)[C@H]1CCCN1C(=O)c1ccc(Br)c([O-])c1 ZINC000492031904 1042538184 /nfs/dbraw/zinc/53/81/84/1042538184.db2.gz DMZIKZWOEBNQAU-BXUZGUMPSA-N -1 1 340.261 4.196 20 0 EIADMM O=C(Nc1ccccc1-c1cn[nH]c1)c1cc2ccccc2cc1[O-] ZINC000439742332 1042757410 /nfs/dbraw/zinc/75/74/10/1042757410.db2.gz UBCBADQNAMCBHC-UHFFFAOYSA-N -1 1 329.359 4.188 20 0 EIADMM CCSc1ccc(Cl)cc1[N-]S(=O)(=O)c1ccc(F)cc1 ZINC000520624575 1042948524 /nfs/dbraw/zinc/94/85/24/1042948524.db2.gz NTIRSLOAPPQCGA-UHFFFAOYSA-N -1 1 345.848 4.392 20 0 EIADMM CCn1c2ccccc2c2cc(CN=c3[n-]nc(C)n3C3CC3)ccc21 ZINC000340699734 1043066788 /nfs/dbraw/zinc/06/67/88/1043066788.db2.gz FHYOOBOLXHRZPM-UHFFFAOYSA-N -1 1 345.450 4.083 20 0 EIADMM Cc1cc(C(=O)[N-]c2cccc(Cl)c2SCC(F)F)on1 ZINC000076473942 1043097844 /nfs/dbraw/zinc/09/78/44/1043097844.db2.gz DBJCCXZYDFIXKS-UHFFFAOYSA-N -1 1 332.759 4.246 20 0 EIADMM CCCc1cc(=O)[n-]c(SCc2cscc2Br)n1 ZINC001164552272 1043144520 /nfs/dbraw/zinc/14/45/20/1043144520.db2.gz UMTGDBZSOKPWBU-UHFFFAOYSA-N -1 1 345.287 4.251 20 0 EIADMM CCOc1cc(-c2nc([C@@H]3CCCS3)no2)cc(Cl)c1[O-] ZINC000276984842 1043149853 /nfs/dbraw/zinc/14/98/53/1043149853.db2.gz WMTAFUVFVKSDKQ-NSHDSACASA-N -1 1 326.805 4.062 20 0 EIADMM C[C@@H](C(=O)Nc1ccc([O-])c(Cl)c1)c1cn(C)c2ccccc12 ZINC000185403080 1043180520 /nfs/dbraw/zinc/18/05/20/1043180520.db2.gz IXINQKGTDCWRQN-LLVKDONJSA-N -1 1 328.799 4.280 20 0 EIADMM Cc1cc(Br)c([O-])c(NC(=O)c2ccoc2C2CC2)c1 ZINC000282469636 1043182658 /nfs/dbraw/zinc/18/26/58/1043182658.db2.gz USRGRRKUYWPJGH-UHFFFAOYSA-N -1 1 336.185 4.186 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2cccc(SC(F)F)c2)cc1F ZINC000727363042 1043205628 /nfs/dbraw/zinc/20/56/28/1043205628.db2.gz LCZJHRPLSFBNGV-UHFFFAOYSA-N -1 1 347.383 4.250 20 0 EIADMM COc1cc(C(=O)NC(C)(C)c2ccccc2C)cc(Cl)c1[O-] ZINC000508006078 1043227179 /nfs/dbraw/zinc/22/71/79/1043227179.db2.gz OOBZYXOQPCJJLW-UHFFFAOYSA-N -1 1 333.815 4.028 20 0 EIADMM CC(C)[C@@H](NCc1ccc(-c2cccc(C(F)(F)F)c2)o1)C(=O)[O-] ZINC000113404712 1043280965 /nfs/dbraw/zinc/28/09/65/1043280965.db2.gz AOJZIRGOQLSCON-OAHLLOKOSA-N -1 1 341.329 4.164 20 0 EIADMM [O-]c1cccnc1-c1nc(-c2ccccc2Oc2ccccc2)no1 ZINC001212480685 1043438693 /nfs/dbraw/zinc/43/86/93/1043438693.db2.gz CLSIHDQVRCLQDT-UHFFFAOYSA-N -1 1 331.331 4.297 20 0 EIADMM O=C(OC[C@H]1CC1(Cl)Cl)c1ccc(Cl)c(Cl)c1[O-] ZINC000730360615 1043502671 /nfs/dbraw/zinc/50/26/71/1043502671.db2.gz ZDNXJAVPLBASOH-RXMQYKEDSA-N -1 1 329.994 4.050 20 0 EIADMM O=S(=O)([N-]c1cccc(F)c1Cl)c1cccc(Cl)c1F ZINC000521105085 1043539763 /nfs/dbraw/zinc/53/97/63/1043539763.db2.gz BUWKNZWYDMJVRI-UHFFFAOYSA-N -1 1 338.162 4.072 20 0 EIADMM CC1(C)[C@@H](CNC(=O)c2ccc(Cl)cc2[O-])[C@@H]1c1ccccc1 ZINC001626099906 1043720709 /nfs/dbraw/zinc/72/07/09/1043720709.db2.gz CIGWTTCQPMYBFC-RDJZCZTQSA-N -1 1 329.827 4.215 20 0 EIADMM CC(C)C(=O)Nc1cccc(NC(=O)Nc2ccc([O-])c(Cl)c2)c1 ZINC000190931154 1043750839 /nfs/dbraw/zinc/75/08/39/1043750839.db2.gz FQZKMFNZMMYUMA-UHFFFAOYSA-N -1 1 347.802 4.284 20 0 EIADMM COc1cc(C(=O)N2CC[C@H](C)c3ccccc32)cc(Cl)c1[O-] ZINC000442735417 1043820400 /nfs/dbraw/zinc/82/04/00/1043820400.db2.gz YDSDTBKNWWRFTB-NSHDSACASA-N -1 1 331.799 4.208 20 0 EIADMM Cc1ccccc1S(=O)(=O)[N-]c1ccc(COC(C)(C)C)cc1 ZINC000674646890 1043825043 /nfs/dbraw/zinc/82/50/43/1043825043.db2.gz QJXDPEHPOWEJQW-UHFFFAOYSA-N -1 1 333.453 4.111 20 0 EIADMM COc1cc(C(=O)Nc2cc3[nH]ccc3cc2C)cc(Cl)c1[O-] ZINC000442803161 1043846556 /nfs/dbraw/zinc/84/65/56/1043846556.db2.gz UAMDITUIYOCKGX-UHFFFAOYSA-N -1 1 330.771 4.096 20 0 EIADMM Cc1cccc(CC2CN(C(=O)c3ccc4ccccc4c3[O-])C2)c1 ZINC000674746086 1043859796 /nfs/dbraw/zinc/85/97/96/1043859796.db2.gz BQZSXVSVLAIRNW-UHFFFAOYSA-N -1 1 331.415 4.169 20 0 EIADMM C[C@@H]1CO[C@H](c2ccccc2)[C@H](C)N1C(=O)c1ccc(Cl)cc1[O-] ZINC000732019435 1043869921 /nfs/dbraw/zinc/86/99/21/1043869921.db2.gz IMWLWCUTGKPJAJ-VBHSOAQHSA-N -1 1 345.826 4.036 20 0 EIADMM CCCCOc1ccc(C(=O)Nc2ccc([O-])c(Cl)c2)cc1OC ZINC000732306708 1043895722 /nfs/dbraw/zinc/89/57/22/1043895722.db2.gz PFPKDFHRXJPRTF-UHFFFAOYSA-N -1 1 349.814 4.485 20 0 EIADMM COc1cc(C(=O)N[C@@H](c2ccccc2C)C(C)C)cc(Cl)c1[O-] ZINC000442974109 1043935192 /nfs/dbraw/zinc/93/51/92/1043935192.db2.gz PABQKNVLWRDOJH-QGZVFWFLSA-N -1 1 347.842 4.490 20 0 EIADMM COc1cc(C(=O)N2C[C@H](c3ccccc3)C[C@@H]2C)cc(Cl)c1[O-] ZINC000442981947 1043946513 /nfs/dbraw/zinc/94/65/13/1043946513.db2.gz WKQAKNHWOQWYKT-SWLSCSKDSA-N -1 1 345.826 4.072 20 0 EIADMM COc1cc(-c2nc(-c3ccc(F)c(F)c3)no2)cc(Cl)c1[O-] ZINC000443087565 1043996418 /nfs/dbraw/zinc/99/64/18/1043996418.db2.gz RXESMBAUWLGDEJ-UHFFFAOYSA-N -1 1 338.697 4.049 20 0 EIADMM COc1cc(-c2nc(-c3ccc(F)c(C)c3)no2)cc(Cl)c1[O-] ZINC000443101153 1044017039 /nfs/dbraw/zinc/01/70/39/1044017039.db2.gz ZCTIKBSMFQSQKI-UHFFFAOYSA-N -1 1 334.734 4.219 20 0 EIADMM CCOc1cc(-c2nc(CCc3ccccc3)no2)cc(Cl)c1[O-] ZINC000443107875 1044021574 /nfs/dbraw/zinc/02/15/74/1044021574.db2.gz ULGRAYGFLCNJST-UHFFFAOYSA-N -1 1 344.798 4.280 20 0 EIADMM CC[C@@H]1Cc2ccccc2CN1C(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC000443132075 1044032167 /nfs/dbraw/zinc/03/21/67/1044032167.db2.gz RVVQSYQZESNBTK-OAHLLOKOSA-N -1 1 345.826 4.031 20 0 EIADMM COc1cc(C(=O)NCc2c(C)oc3ccccc32)cc(Cl)c1[O-] ZINC000443123247 1044035252 /nfs/dbraw/zinc/03/52/52/1044035252.db2.gz YWSBCZRORGHMAQ-UHFFFAOYSA-N -1 1 345.782 4.039 20 0 EIADMM O=C(Nc1c([O-])cccc1F)c1cncc(-c2ccc(Cl)cc2)c1 ZINC000675143844 1044046019 /nfs/dbraw/zinc/04/60/19/1044046019.db2.gz RDGWNXWYVLVZSA-UHFFFAOYSA-N -1 1 342.757 4.499 20 0 EIADMM COc1cc(-c2nc(C[C@@H](C)c3ccccc3)no2)cc(Cl)c1[O-] ZINC000443212051 1044084597 /nfs/dbraw/zinc/08/45/97/1044084597.db2.gz GLZLPCAFDWYAKG-LLVKDONJSA-N -1 1 344.798 4.450 20 0 EIADMM Cc1nc2c(s1)[C@@H]([N@@H+](C)Cc1cc(C(=O)[O-])sc1C)CCC2 ZINC000522007585 1044152107 /nfs/dbraw/zinc/15/21/07/1044152107.db2.gz GCGITVREPYPXRG-ZDUSSCGKSA-N -1 1 336.482 4.029 20 0 EIADMM C[C@@H](NC(=O)c1ccc([O-])c(F)c1)c1ccc(F)c2ccccc21 ZINC000673408296 1044204888 /nfs/dbraw/zinc/20/48/88/1044204888.db2.gz ZRXLTLMAPTZSGZ-LLVKDONJSA-N -1 1 327.330 4.315 20 0 EIADMM COc1cc(CSc2nc(C)c(C3CC3)c(=O)[n-]2)ccc1Cl ZINC000631022836 1044269879 /nfs/dbraw/zinc/26/98/79/1044269879.db2.gz AEZPWJNIVNYRIS-UHFFFAOYSA-N -1 1 336.844 4.322 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2cc(Cl)c(C)cc2Cl)s1 ZINC000443459932 1044317802 /nfs/dbraw/zinc/31/78/02/1044317802.db2.gz IGVNFHVTWWKEPM-UHFFFAOYSA-N -1 1 336.265 4.473 20 0 EIADMM Cc1cnc(C(=O)N2CC=C(c3cccc4ccccc43)CC2)c([O-])c1 ZINC000494838367 1044428427 /nfs/dbraw/zinc/42/84/27/1044428427.db2.gz ZSJKPOUPLRVAMF-UHFFFAOYSA-N -1 1 344.414 4.178 20 0 EIADMM CC(C)CN(C(=O)c1ccc(Br)cc1[O-])C1CCCC1 ZINC000094848795 1044645727 /nfs/dbraw/zinc/64/57/27/1044645727.db2.gz SAMAUCLCTIMRRU-UHFFFAOYSA-N -1 1 340.261 4.196 20 0 EIADMM CC(C)n1ncc2cc(NC(=O)c3ccc4ccccc4c3[O-])cnc21 ZINC000648751486 1044757529 /nfs/dbraw/zinc/75/75/29/1044757529.db2.gz IFMGCPIKHXGSKH-UHFFFAOYSA-N -1 1 346.390 4.123 20 0 EIADMM O=C(Nc1c([O-])cccc1F)c1ccc(Cl)c(C(F)(F)F)c1 ZINC000676624820 1044811599 /nfs/dbraw/zinc/81/15/99/1044811599.db2.gz MEUVHIPKYAIOJL-UHFFFAOYSA-N -1 1 333.668 4.456 20 0 EIADMM Cc1cc(Br)ccc1-c1noc(-c2cc(F)ccc2[O-])n1 ZINC000231698471 1044860722 /nfs/dbraw/zinc/86/07/22/1044860722.db2.gz HESZQEAPRHFVRW-UHFFFAOYSA-N -1 1 349.159 4.319 20 0 EIADMM O=C(Nc1ncc(-c2ccc(F)cc2)s1)c1ccc([O-])cc1F ZINC000191724595 1044966675 /nfs/dbraw/zinc/96/66/75/1044966675.db2.gz KDZAGCDWUKASIS-UHFFFAOYSA-N -1 1 332.331 4.046 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@@H](c1ccncc1)C1CCCC1 ZINC000901162313 1045808990 /nfs/dbraw/zinc/80/89/90/1045808990.db2.gz IESOHDRJELDZJO-QGZVFWFLSA-N -1 1 330.815 4.353 20 0 EIADMM C[C@H](c1nc2ccccc2s1)N(C)C(=O)c1c([O-])cccc1Cl ZINC000769617895 1046036278 /nfs/dbraw/zinc/03/62/78/1046036278.db2.gz RKMVVQIMRCBAJQ-SNVBAGLBSA-N -1 1 346.839 4.489 20 0 EIADMM O=C(N[C@H](c1ccccc1)C(F)(F)F)c1c([O-])cccc1Cl ZINC000769716743 1046054162 /nfs/dbraw/zinc/05/41/62/1046054162.db2.gz MRCWDOSVCIZDAN-CYBMUJFWSA-N -1 1 329.705 4.079 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1cccc(Br)c1 ZINC000067738917 1046055149 /nfs/dbraw/zinc/05/51/49/1046055149.db2.gz SNCUYPDVHLFDNC-UHFFFAOYSA-N -1 1 326.577 4.060 20 0 EIADMM Cc1ccccc1C[C@@H]1CCCN1C(=O)c1c([O-])cccc1Cl ZINC000769859015 1046083331 /nfs/dbraw/zinc/08/33/31/1046083331.db2.gz KDHUTDCXIJRVMV-HNNXBMFYSA-N -1 1 329.827 4.201 20 0 EIADMM CC(C)c1ccc(-c2nc(CN(C)C[C@@H](C)C(=O)[O-])cs2)cc1 ZINC000263300779 1046270560 /nfs/dbraw/zinc/27/05/60/1046270560.db2.gz GNNYXSOIYTXZKI-CYBMUJFWSA-N -1 1 332.469 4.086 20 0 EIADMM Cc1c(=O)[n-]c(SC[C@@H]2CC[C@H](C3CC3)O2)nc1-c1ccccc1 ZINC000917467630 1046911308 /nfs/dbraw/zinc/91/13/08/1046911308.db2.gz FWWOSRXHMYOTDA-JKSUJKDBSA-N -1 1 342.464 4.207 20 0 EIADMM CC1([N-]S(=O)(=O)c2cc(Cl)sc2Cl)CCCCC1 ZINC000497772839 1047070418 /nfs/dbraw/zinc/07/04/18/1047070418.db2.gz QLHAWEFPTGYYLT-UHFFFAOYSA-N -1 1 328.286 4.056 20 0 EIADMM Cc1nc(C)c(CSc2nc(-c3ccccc3)c(C)c(=O)[n-]2)o1 ZINC000788105976 1047102155 /nfs/dbraw/zinc/10/21/55/1047102155.db2.gz VZDSKHJCKJKUDI-UHFFFAOYSA-N -1 1 327.409 4.055 20 0 EIADMM COc1cc(C(=O)N[C@H](C)Cc2ccc(C)cc2C)cc(Cl)c1[O-] ZINC000460210217 1047190332 /nfs/dbraw/zinc/19/03/32/1047190332.db2.gz HTOFXGKTBPFQHJ-CYBMUJFWSA-N -1 1 347.842 4.032 20 0 EIADMM CCOc1cc(-c2noc(CCc3ccccc3)n2)cc(Cl)c1[O-] ZINC000445430134 1047215924 /nfs/dbraw/zinc/21/59/24/1047215924.db2.gz FILILWSWKVQXCU-UHFFFAOYSA-N -1 1 344.798 4.280 20 0 EIADMM O=S(=O)([N-]c1ccc2oc(C3CC3)nc2c1)c1ccc(Cl)cc1 ZINC000032097170 1047304309 /nfs/dbraw/zinc/30/43/09/1047304309.db2.gz QSCCKKXTKWAIHC-UHFFFAOYSA-N -1 1 348.811 4.159 20 0 EIADMM COc1cc(C(=O)Nc2ccc3ccccc3c2)cc(Cl)c1[O-] ZINC000788972127 1047338248 /nfs/dbraw/zinc/33/82/48/1047338248.db2.gz VXBRNSWEPGWLIU-UHFFFAOYSA-N -1 1 327.767 4.460 20 0 EIADMM Cc1cc(F)cc(S(=O)(=O)[N-]c2ccc(-c3nccs3)cc2)c1 ZINC000476273407 1047441887 /nfs/dbraw/zinc/44/18/87/1047441887.db2.gz GYOXBFQWXOKORO-UHFFFAOYSA-N -1 1 348.424 4.058 20 0 EIADMM CCCOC(=O)c1ccc(NC(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000789834190 1047478169 /nfs/dbraw/zinc/47/81/69/1047478169.db2.gz DOIBOAYNENOVDT-UHFFFAOYSA-N -1 1 348.786 4.256 20 0 EIADMM O=C(Nc1nc(Cl)ccc1[O-])c1sccc1-c1ccccc1 ZINC000789930135 1047486194 /nfs/dbraw/zinc/48/61/94/1047486194.db2.gz AIBQROUFJFNNRG-UHFFFAOYSA-N -1 1 330.796 4.421 20 0 EIADMM CSCc1c2ccccc2oc1C(=O)Nc1nc(Cl)ccc1[O-] ZINC000790048127 1047510473 /nfs/dbraw/zinc/51/04/73/1047510473.db2.gz QTRMGQYAHCAZIF-UHFFFAOYSA-N -1 1 348.811 4.302 20 0 EIADMM C[C@@H](CC(=O)Nc1nc(Cl)ccc1[O-])c1c[nH]c2ccccc21 ZINC000790048372 1047510820 /nfs/dbraw/zinc/51/08/20/1047510820.db2.gz UAFWVANPGLVQSF-JTQLQIEISA-N -1 1 329.787 4.054 20 0 EIADMM O=C(CC1CCC(C(F)(F)F)CC1)Nc1nc(Cl)ccc1[O-] ZINC000790064297 1047512969 /nfs/dbraw/zinc/51/29/69/1047512969.db2.gz WGAPHOPIDWCXOI-UHFFFAOYSA-N -1 1 336.741 4.138 20 0 EIADMM O=S(=O)([N-]c1ccc(Cl)cc1F)c1cc(Cl)ccc1F ZINC000556346274 1047687725 /nfs/dbraw/zinc/68/77/25/1047687725.db2.gz CGRXEIYWJJAMIW-UHFFFAOYSA-N -1 1 338.162 4.072 20 0 EIADMM CC[C@@H](NC(=O)c1c([O-])cccc1Cl)c1ccc(F)cc1F ZINC001136848646 1047851789 /nfs/dbraw/zinc/85/17/89/1047851789.db2.gz LPPCYMPLEGFZSE-CYBMUJFWSA-N -1 1 325.742 4.205 20 0 EIADMM CC[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)c1ccc(F)c([O-])c1 ZINC001137007915 1048056066 /nfs/dbraw/zinc/05/60/66/1048056066.db2.gz UMRNEPALRITMEG-WMZOPIPTSA-N -1 1 327.399 4.330 20 0 EIADMM Cc1ccccc1O[C@H](C)CNC(=O)c1ccc2ccccc2c1[O-] ZINC001137015306 1048064587 /nfs/dbraw/zinc/06/45/87/1048064587.db2.gz WBIPEPQAXJLLCT-OAHLLOKOSA-N -1 1 335.403 4.051 20 0 EIADMM CC(C(=O)Nc1c([O-])cc(Br)cc1Cl)=C1CCC1 ZINC000843886855 1048137608 /nfs/dbraw/zinc/13/76/08/1048137608.db2.gz QHAZGQFSYPTVNK-UHFFFAOYSA-N -1 1 330.609 4.247 20 0 EIADMM COCCOc1ccc(NCc2cccc([O-])c2Cl)cc1Cl ZINC000815117990 1048333068 /nfs/dbraw/zinc/33/30/68/1048333068.db2.gz KIBPUEGZDZCUNM-UHFFFAOYSA-N -1 1 342.222 4.336 20 0 EIADMM C[C@H]1CN(c2ccc(NCc3cccc([O-])c3Cl)cc2)C[C@H](C)O1 ZINC000815130388 1048342190 /nfs/dbraw/zinc/34/21/90/1048342190.db2.gz FGXDOUPZLWJWJY-KBPBESRZSA-N -1 1 346.858 4.271 20 0 EIADMM Cc1ccc(-c2csc(NC(=O)c3cccc([O-])c3F)n2)cc1 ZINC001144055425 1048400151 /nfs/dbraw/zinc/40/01/51/1048400151.db2.gz LZAALSZYEWKTJM-UHFFFAOYSA-N -1 1 328.368 4.216 20 0 EIADMM Cc1nc(NC(=O)c2c(F)ccc([O-])c2F)sc1-c1ccccc1 ZINC000809601661 1048435643 /nfs/dbraw/zinc/43/56/43/1048435643.db2.gz IJBKYINAPNJHMT-UHFFFAOYSA-N -1 1 346.358 4.355 20 0 EIADMM CCCCN(C)c1ccc(NC(=O)c2c(F)ccc([O-])c2F)cc1 ZINC000809669839 1048469447 /nfs/dbraw/zinc/46/94/47/1048469447.db2.gz FUKAMVXDNAWZSV-UHFFFAOYSA-N -1 1 334.366 4.159 20 0 EIADMM Cc1nc(-c2ccccc2)sc1[C@@H](C)[N-]C(=O)C(F)(F)C(F)F ZINC000749355055 1048686049 /nfs/dbraw/zinc/68/60/49/1048686049.db2.gz HDTCGFWBXYLJBF-SECBINFHSA-N -1 1 346.349 4.196 20 0 EIADMM CCOc1ccc([C@@H]2CCCN2Cc2c(F)cc([O-])cc2F)cc1 ZINC001144554794 1048723683 /nfs/dbraw/zinc/72/36/83/1048723683.db2.gz HUOYEIQDWFCLER-IBGZPJMESA-N -1 1 333.378 4.406 20 0 EIADMM CN(Cc1ccccc1C(F)(F)F)Cc1c(F)cc([O-])cc1F ZINC001144554810 1048724417 /nfs/dbraw/zinc/72/44/17/1048724417.db2.gz ILJJANQABPEKLT-UHFFFAOYSA-N -1 1 331.284 4.321 20 0 EIADMM [O-]c1cc(F)c(CN2CCC[C@H]2c2c(F)cccc2F)c(F)c1 ZINC001144560955 1048727797 /nfs/dbraw/zinc/72/77/97/1048727797.db2.gz DGYLHDJETQCHMT-INIZCTEOSA-N -1 1 325.305 4.286 20 0 EIADMM [O-]c1cc(F)c(CN2CCC[C@@H]2c2c(F)cccc2F)c(F)c1 ZINC001144560956 1048728442 /nfs/dbraw/zinc/72/84/42/1048728442.db2.gz DGYLHDJETQCHMT-MRXNPFEDSA-N -1 1 325.305 4.286 20 0 EIADMM C[C@@H](NC(=O)c1cc(F)ccc1[O-])c1cccc(C(F)(F)F)c1 ZINC001135478940 1048755817 /nfs/dbraw/zinc/75/58/17/1048755817.db2.gz VAABTOXNAZFSGE-SECBINFHSA-N -1 1 327.277 4.041 20 0 EIADMM O=C(Oc1ccc2cncnc2c1)c1cc2cc(Cl)sc2[n-]1 ZINC000810653114 1048834134 /nfs/dbraw/zinc/83/41/34/1048834134.db2.gz TWHYZKPHJQXBGR-UHFFFAOYSA-N -1 1 329.768 4.045 20 0 EIADMM O=C([N-][C@H]1CCC(F)(F)C1)C(F)(F)c1cc(Cl)ccc1Cl ZINC000817439613 1048974383 /nfs/dbraw/zinc/97/43/83/1048974383.db2.gz AFWVPIVGTADXGN-QMMMGPOBSA-N -1 1 344.135 4.389 20 0 EIADMM Cc1ccc([C@H](NC(=O)c2ncc3ccccc3c2[O-])C2CC2)cc1 ZINC001135984439 1049028046 /nfs/dbraw/zinc/02/80/46/1049028046.db2.gz AJQFVHJRVAMEIJ-SFHVURJKSA-N -1 1 332.403 4.130 20 0 EIADMM COc1ccc([C@H](NC(=O)c2cc(Cl)ccc2[O-])C(C)C)cc1 ZINC001135978577 1049031144 /nfs/dbraw/zinc/03/11/44/1049031144.db2.gz RMBMIAVPUFGSGC-QGZVFWFLSA-N -1 1 333.815 4.181 20 0 EIADMM O=C(c1cc(F)ccc1[O-])N(CCc1ccccc1)Cc1ccccc1 ZINC001136018462 1049046134 /nfs/dbraw/zinc/04/61/34/1049046134.db2.gz VGCSXEOJTSXZLG-UHFFFAOYSA-N -1 1 349.405 4.416 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1CCSC[C@@H]1c1ccccc1 ZINC001146848299 1049065948 /nfs/dbraw/zinc/06/59/48/1049065948.db2.gz SFRPSABMRYSFCI-LJQANCHMSA-N -1 1 349.455 4.476 20 0 EIADMM CCOc1cc(C(=O)N[C@](C)(CC)c2ccccc2)cc(Cl)c1[O-] ZINC001146926546 1049072304 /nfs/dbraw/zinc/07/23/04/1049072304.db2.gz NCBRREPXYATTAZ-LJQANCHMSA-N -1 1 347.842 4.500 20 0 EIADMM COc1cc(C(=O)Nc2ccccc2CSC)cc(Cl)c1[O-] ZINC000135275374 1049098321 /nfs/dbraw/zinc/09/83/21/1049098321.db2.gz DKAREKNGSNJNNC-UHFFFAOYSA-N -1 1 337.828 4.170 20 0 EIADMM CC(C)(C)C[C@@H](NC(=O)c1cncc([O-])c1)c1ccc(Cl)cc1 ZINC001147496125 1049164648 /nfs/dbraw/zinc/16/46/48/1049164648.db2.gz WVGMGRUYMJXMSR-MRXNPFEDSA-N -1 1 332.831 4.348 20 0 EIADMM Cc1ccc([C@H](C)N(C)C(=O)c2ncc3ccccc3c2[O-])c(C)c1 ZINC001136186477 1049247662 /nfs/dbraw/zinc/24/76/62/1049247662.db2.gz NLGQKDUEJOYVNQ-HNNXBMFYSA-N -1 1 334.419 4.390 20 0 EIADMM O=C(Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)[C@@H]1CCC[C@@H]2CCCC[C@@H]12 ZINC001136190947 1049269398 /nfs/dbraw/zinc/26/93/98/1049269398.db2.gz UMGWVPYWNCWPOM-IAOVAPTHSA-N -1 1 339.439 4.327 20 0 EIADMM Cn1cc(C(=O)Nc2cccc(C(F)(F)F)c2[O-])c2ccccc21 ZINC001148190870 1049276508 /nfs/dbraw/zinc/27/65/08/1049276508.db2.gz GYJHESIRDNHTGM-UHFFFAOYSA-N -1 1 334.297 4.155 20 0 EIADMM Cc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)Cc2ccc([O-])c(Cl)c2)o1 ZINC001148223360 1049283195 /nfs/dbraw/zinc/28/31/95/1049283195.db2.gz DBJGGPXDJFBDNM-LRDDRELGSA-N -1 1 347.842 4.489 20 0 EIADMM CCO[C@H]1C[C@@H](NC(=O)c2cc3ccccc3cc2[O-])C1(CC)CC ZINC001148354792 1049303932 /nfs/dbraw/zinc/30/39/32/1049303932.db2.gz JQPBETNWPCGGES-MOPGFXCFSA-N -1 1 341.451 4.259 20 0 EIADMM C[C@]1(Cc2cccc3ccccc32)CCCN1C(=O)c1cncc([O-])c1 ZINC001148559762 1049333060 /nfs/dbraw/zinc/33/30/60/1049333060.db2.gz ZBVNSWMULRUYOO-JOCHJYFZSA-N -1 1 346.430 4.178 20 0 EIADMM O=C(NCc1cccc(C(F)F)c1)c1ccc(C(F)(F)F)cc1[O-] ZINC001148799590 1049383362 /nfs/dbraw/zinc/38/33/62/1049383362.db2.gz QDCVMGLTCYMSAH-UHFFFAOYSA-N -1 1 345.267 4.279 20 0 EIADMM Nc1ccc2c(c1)CCCN2C(=O)c1cccc(-c2ccccc2)c1[O-] ZINC001148868866 1049390091 /nfs/dbraw/zinc/39/00/91/1049390091.db2.gz DKXJERLHZHNLQF-UHFFFAOYSA-N -1 1 344.414 4.234 20 0 EIADMM O=C(c1cccc(-c2ccccc2)c1[O-])N1CC[C@H](c2cccnc2)C1 ZINC001148865927 1049392204 /nfs/dbraw/zinc/39/22/04/1049392204.db2.gz BHNALAKKRYXPNU-SFHVURJKSA-N -1 1 344.414 4.084 20 0 EIADMM CN(CCc1cccs1)C(=O)c1cccc(-c2ccccc2)c1[O-] ZINC001148866499 1049392239 /nfs/dbraw/zinc/39/22/39/1049392239.db2.gz JZVSMQFBXMUUMZ-UHFFFAOYSA-N -1 1 337.444 4.435 20 0 EIADMM Cc1ccccc1C[C@H](C)C(=O)Nc1cccc([O-])c1Br ZINC001158832902 1049476094 /nfs/dbraw/zinc/47/60/94/1049476094.db2.gz VLTQTAMKOUSWAN-LBPRGKRZSA-N -1 1 348.240 4.280 20 0 EIADMM Cc1ccccc1[C@@H]1CCCN1C(=O)Cc1ccc([O-])c(Cl)c1 ZINC001136327080 1049489078 /nfs/dbraw/zinc/48/90/78/1049489078.db2.gz WRIXARIZSRVGLE-KRWDZBQOSA-N -1 1 329.827 4.260 20 0 EIADMM O=C(Cc1ccc([O-])c(Cl)c1)Nc1ccc(-c2ccccc2)cn1 ZINC001136340198 1049503857 /nfs/dbraw/zinc/50/38/57/1049503857.db2.gz HOMCWTYRTLKQDJ-UHFFFAOYSA-N -1 1 338.794 4.289 20 0 EIADMM O=C(c1cc(Cl)ccc1[O-])N1CCC[C@@H]1Cc1ccc(F)cc1 ZINC001136347949 1049519678 /nfs/dbraw/zinc/51/96/78/1049519678.db2.gz PMEBROBFPNJMFH-OAHLLOKOSA-N -1 1 333.790 4.032 20 0 EIADMM C[C@@H]1CCCC[C@H]1CNC(=O)c1cc(-c2ccc(C=O)o2)ccc1[O-] ZINC001136512334 1049704220 /nfs/dbraw/zinc/70/42/20/1049704220.db2.gz XVTRRTKCRGNCSM-HIFRSBDPSA-N -1 1 341.407 4.021 20 0 EIADMM CC(C)(C)OCc1cccc(CNC(=O)c2cc(Cl)ccc2[O-])c1 ZINC001136521664 1049717790 /nfs/dbraw/zinc/71/77/90/1049717790.db2.gz MKRPXOBFUJBTIH-UHFFFAOYSA-N -1 1 347.842 4.291 20 0 EIADMM CCCCN(Cc1ccccc1Cl)C(=O)c1ncc(C)cc1[O-] ZINC001136558322 1049743181 /nfs/dbraw/zinc/74/31/81/1049743181.db2.gz KLSCPKDEDRNCKX-UHFFFAOYSA-N -1 1 332.831 4.192 20 0 EIADMM CCC[C@@H](NC(=O)c1ccc([O-])cn1)c1cccc(C(F)(F)F)c1 ZINC001136563241 1049749001 /nfs/dbraw/zinc/74/90/01/1049749001.db2.gz UCXNQTCEMGGUAY-CQSZACIVSA-N -1 1 338.329 4.077 20 0 EIADMM CC(C)(CNC(=O)c1ccc2ccccc2c1[O-])c1ccccc1F ZINC001136571191 1049753953 /nfs/dbraw/zinc/75/39/53/1049753953.db2.gz HVTAPPSNTXDKNJ-UHFFFAOYSA-N -1 1 337.394 4.392 20 0 EIADMM O=C(Nc1cccc(F)c1[O-])[C@H]1CC[C@@H]1c1ccc(Cl)cc1F ZINC001171636239 1049777279 /nfs/dbraw/zinc/77/72/79/1049777279.db2.gz FICXSVYMSOXRMH-PWSUYJOCSA-N -1 1 337.753 4.456 20 0 EIADMM Cc1cccc2cc(C(=O)Nc3cccc(F)c3[O-])c(Cl)nc12 ZINC001171638555 1049779398 /nfs/dbraw/zinc/77/93/98/1049779398.db2.gz YOILNLZAHUSONU-UHFFFAOYSA-N -1 1 330.746 4.294 20 0 EIADMM CC[C@@H](c1ccccc1OC)N(C)C(=O)c1c([O-])cccc1Cl ZINC000813760190 1049811538 /nfs/dbraw/zinc/81/15/38/1049811538.db2.gz OONYMOSBZFQXTB-AWEZNQCLSA-N -1 1 333.815 4.278 20 0 EIADMM COc1ccc2oc([C@@H](C)NC(=O)c3ccc(F)c([O-])c3)c(C)c2c1 ZINC001136686960 1049829869 /nfs/dbraw/zinc/82/98/69/1049829869.db2.gz VBMQQPJURYGWCZ-LLVKDONJSA-N -1 1 343.354 4.086 20 0 EIADMM COCCOc1ccccc1Nc1ccc(Cl)c(Cl)c1[O-] ZINC001212641431 1049853643 /nfs/dbraw/zinc/85/36/43/1049853643.db2.gz WMXRJGIUGHQLGY-UHFFFAOYSA-N -1 1 328.195 4.468 20 0 EIADMM COCCOc1ccccc1Nc1cc(Cl)c([O-])cc1Cl ZINC001212640302 1049854212 /nfs/dbraw/zinc/85/42/12/1049854212.db2.gz KVPOIFSWZDPESJ-UHFFFAOYSA-N -1 1 328.195 4.468 20 0 EIADMM CC[C@@H]1CC[C@@H](C)N1C(=O)c1ccc(NC(=O)OC(C)(C)C)cc1[O-] ZINC000772872444 1049859494 /nfs/dbraw/zinc/85/94/94/1049859494.db2.gz MWFKYSNSDKBXGV-TZMCWYRMSA-N -1 1 348.443 4.142 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1sccc1Br ZINC000082192671 1049871940 /nfs/dbraw/zinc/87/19/40/1049871940.db2.gz KRDHPNJFYJYFDC-UHFFFAOYSA-N -1 1 332.606 4.122 20 0 EIADMM CC(=O)c1cc(F)c([N-]C(=O)c2c(F)cc(C)cc2F)c(F)c1 ZINC001127618354 1050018311 /nfs/dbraw/zinc/01/83/11/1050018311.db2.gz UMNGWEKLTGODIH-UHFFFAOYSA-N -1 1 325.261 4.006 20 0 EIADMM COc1ccc(C(=O)Nc2c(C)cc(C(F)(F)F)cc2C)c([O-])c1 ZINC001177276059 1050186220 /nfs/dbraw/zinc/18/62/20/1050186220.db2.gz JVFHEDKYLRIXMS-UHFFFAOYSA-N -1 1 339.313 4.289 20 0 EIADMM CC1(C)CCC(CC(=O)Nc2cc(=O)n(-c3ccccc3)[n-]2)CC1 ZINC001185973039 1050204744 /nfs/dbraw/zinc/20/47/44/1050204744.db2.gz LZADCIICJXPRQJ-UHFFFAOYSA-N -1 1 327.428 4.123 20 0 EIADMM COC(=O)c1cc(Nc2c(F)ccc([O-])c2Cl)c(Cl)s1 ZINC001250228983 1050237846 /nfs/dbraw/zinc/23/78/46/1050237846.db2.gz RHOHZLBJVGJDEB-UHFFFAOYSA-N -1 1 336.171 4.430 20 0 EIADMM O=C(Nc1ccccc1-c1ccc(Cl)cn1)c1ccc([O-])c(F)c1 ZINC001186236234 1050265928 /nfs/dbraw/zinc/26/59/28/1050265928.db2.gz CNNRMJRPYZAVAX-UHFFFAOYSA-N -1 1 342.757 4.499 20 0 EIADMM CCOCc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2[O-])cc1 ZINC001187104986 1050473689 /nfs/dbraw/zinc/47/36/89/1050473689.db2.gz WQCJEPNPRHPXOF-UHFFFAOYSA-N -1 1 339.313 4.200 20 0 EIADMM O=S(=O)([N-]c1cccc(F)c1Cl)c1cc2c(s1)CCCC2 ZINC001187207240 1050509067 /nfs/dbraw/zinc/50/90/67/1050509067.db2.gz WCXVZJVOLLAJSW-UHFFFAOYSA-N -1 1 345.848 4.220 20 0 EIADMM Cc1ccc(/C=C\S(=O)(=O)[N-]c2nccc3sccc32)cc1 ZINC000763510865 1050587026 /nfs/dbraw/zinc/58/70/26/1050587026.db2.gz SWGULJZXGDRRTR-FLIBITNWSA-N -1 1 330.434 4.017 20 0 EIADMM COc1ccc(OC)c(Nc2ccc(F)c(Br)c2[O-])c1 ZINC001173920199 1050628694 /nfs/dbraw/zinc/62/86/94/1050628694.db2.gz ANUPUJMDQOPIBQ-UHFFFAOYSA-N -1 1 342.164 4.055 20 0 EIADMM COc1cccc(Nc2ccc(F)c(Br)c2[O-])c1F ZINC001173975017 1050684464 /nfs/dbraw/zinc/68/44/64/1050684464.db2.gz UVCCEHQZAGIGQW-UHFFFAOYSA-N -1 1 330.128 4.185 20 0 EIADMM O=C(NC1CCC2(CC2(F)F)CC1)c1ccc(C(F)(F)F)c([O-])c1 ZINC000619227671 1050710365 /nfs/dbraw/zinc/71/03/65/1050710365.db2.gz DKCFZSRWCIVQDW-UHFFFAOYSA-N -1 1 349.299 4.109 20 0 EIADMM O=C(Nc1ccccc1Cc1ccccc1)c1ncc(C(F)(F)F)[n-]1 ZINC001188289466 1050733157 /nfs/dbraw/zinc/73/31/57/1050733157.db2.gz WWEQWIBMJZYIHS-UHFFFAOYSA-N -1 1 345.324 4.272 20 0 EIADMM O=C(Nc1ccccc1Cc1ccccc1)c1nc(C(F)(F)F)c[n-]1 ZINC001188289466 1050733169 /nfs/dbraw/zinc/73/31/69/1050733169.db2.gz WWEQWIBMJZYIHS-UHFFFAOYSA-N -1 1 345.324 4.272 20 0 EIADMM O=c1nc(CNC2(c3ccccc3Cl)CCC2)[n-]c2ccsc21 ZINC000649643465 1050739991 /nfs/dbraw/zinc/73/99/91/1050739991.db2.gz NCXSITUUPVDGCP-UHFFFAOYSA-N -1 1 345.855 4.219 20 0 EIADMM O=C(Nc1cc(F)c([O-])cc1Cl)[C@@H]1C[C@@H]1c1c(F)cccc1F ZINC001179657049 1050741342 /nfs/dbraw/zinc/74/13/42/1050741342.db2.gz ZWURZPSWTPDKLW-JGVFFNPUSA-N -1 1 341.716 4.205 20 0 EIADMM CC(C)COc1ccccc1C(=O)Nc1cc(F)c([O-])cc1Cl ZINC001179660591 1050741421 /nfs/dbraw/zinc/74/14/21/1050741421.db2.gz YCWKEPOHUNNJJF-UHFFFAOYSA-N -1 1 337.778 4.472 20 0 EIADMM O=C(Nc1cc(=O)n(-c2ccccc2)[n-]1)Nc1cccc(Cl)c1F ZINC001188385179 1050754933 /nfs/dbraw/zinc/75/49/33/1050754933.db2.gz ACCBFZBNWJYBLF-UHFFFAOYSA-N -1 1 346.749 4.014 20 0 EIADMM O=S(=O)([N-]c1ccccc1)c1ccc(-c2ccc(F)cc2)cc1 ZINC001188419711 1050762012 /nfs/dbraw/zinc/76/20/12/1050762012.db2.gz HPNMSVFVPPUAJU-UHFFFAOYSA-N -1 1 327.380 4.294 20 0 EIADMM Cc1cc(Cl)c(NC(=O)c2ccc([O-])c(C(F)(F)F)c2)cc1O ZINC001188589285 1050810503 /nfs/dbraw/zinc/81/05/03/1050810503.db2.gz PXKPWZISXYKRRK-UHFFFAOYSA-N -1 1 345.704 4.331 20 0 EIADMM CC1CCN(C(=O)c2cccc(Nc3cc(F)c([O-])cc3F)c2)CC1 ZINC001174204910 1050840340 /nfs/dbraw/zinc/84/03/40/1050840340.db2.gz SMKHJDJEGAKTRP-UHFFFAOYSA-N -1 1 346.377 4.286 20 0 EIADMM CC1CCN(C(=O)c2cccc(Nc3ccc(F)c(F)c3[O-])c2)CC1 ZINC001174205210 1050840636 /nfs/dbraw/zinc/84/06/36/1050840636.db2.gz XHYKEWDVFQOYIT-UHFFFAOYSA-N -1 1 346.377 4.286 20 0 EIADMM C[C@H]([N-]S(=O)(=O)c1cc(Cl)ccc1F)C1CCCCCC1 ZINC001189064703 1050899377 /nfs/dbraw/zinc/89/93/77/1050899377.db2.gz WPAIPBYRNBUCBU-NSHDSACASA-N -1 1 333.856 4.116 20 0 EIADMM O=C(Nc1cccc(C(F)(F)F)c1[O-])c1cccc(-c2cn[nH]c2)c1 ZINC001189249196 1050938807 /nfs/dbraw/zinc/93/88/07/1050938807.db2.gz BVKGBCBDZISHOO-UHFFFAOYSA-N -1 1 347.296 4.053 20 0 EIADMM Cc1ccc(C(C)C)cc1O[C@@H](C)C(=O)Nc1cccc(F)c1[O-] ZINC001151771393 1051008220 /nfs/dbraw/zinc/00/82/20/1051008220.db2.gz IBFYYZNUKBAYFO-ZDUSSCGKSA-N -1 1 331.387 4.369 20 0 EIADMM C[C@@H]1CCCC[C@H]1CC(=O)N1CCC(C(=O)c2ccc([O-])cc2)CC1 ZINC000620170553 1051047453 /nfs/dbraw/zinc/04/74/53/1051047453.db2.gz MSZUOUIJTXHJQP-QAPCUYQASA-N -1 1 343.467 4.030 20 0 EIADMM CCc1c(Cl)cc(Nc2ccc(C(=O)NC)cc2)c([O-])c1Cl ZINC001174514865 1051047687 /nfs/dbraw/zinc/04/76/87/1051047687.db2.gz JZYGZHBMCSUQGH-UHFFFAOYSA-N -1 1 339.222 4.365 20 0 EIADMM [O-]c1c(Br)ccc(Cl)c1Nc1cnc(C2CC2)nc1 ZINC001174618474 1051085527 /nfs/dbraw/zinc/08/55/27/1051085527.db2.gz YSDXJIHWYHOJQW-UHFFFAOYSA-N -1 1 340.608 4.219 20 0 EIADMM [O-]c1c(Br)ccc(Cl)c1Nc1cc(F)ccc1O ZINC001174630987 1051092696 /nfs/dbraw/zinc/09/26/96/1051092696.db2.gz ALQULJBUOXDZQR-UHFFFAOYSA-N -1 1 332.556 4.396 20 0 EIADMM O=S(=O)([N-]c1cc(Cl)nc(Cl)c1)c1ccc(C2CC2)cc1 ZINC001190467497 1051194514 /nfs/dbraw/zinc/19/45/14/1051194514.db2.gz CQPGZGCGXZVABP-UHFFFAOYSA-N -1 1 343.235 4.067 20 0 EIADMM COc1cc(C(=O)N(CC2CCCCC2)C2CC2)cc(Cl)c1[O-] ZINC000153626178 1051206699 /nfs/dbraw/zinc/20/66/99/1051206699.db2.gz ZJFMSRDWSHBBHN-UHFFFAOYSA-N -1 1 337.847 4.239 20 0 EIADMM Cc1cc(Br)ncc1Nc1cc(Cl)c([O-])cc1F ZINC001250020798 1051310717 /nfs/dbraw/zinc/31/07/17/1051310717.db2.gz RPFAOBUUKHKFNI-UHFFFAOYSA-N -1 1 331.572 4.394 20 0 EIADMM O=C(c1cccc(Nc2ccc(-n3ccc(=O)[n-]3)cc2)c1)C(F)(F)F ZINC001203350089 1051341443 /nfs/dbraw/zinc/34/14/43/1051341443.db2.gz HWDHSVBJMQDYSI-UHFFFAOYSA-N -1 1 347.296 4.067 20 0 EIADMM CC[C@H](C)C1CCC(NC(=O)c2cc(Cl)c([O-])c(OC)c2)CC1 ZINC001191157757 1051368974 /nfs/dbraw/zinc/36/89/74/1051368974.db2.gz CHTBZISGFGLLFG-DCBWTQNWSA-N -1 1 339.863 4.389 20 0 EIADMM Cc1csc(NC(=O)c2ccccc2C(=O)c2ccc([O-])cc2)c1 ZINC001191487580 1051467913 /nfs/dbraw/zinc/46/79/13/1051467913.db2.gz GDPWANYKQZYQNF-UHFFFAOYSA-N -1 1 337.400 4.245 20 0 EIADMM CN(C)c1ccc(Nc2c(Cl)ccc(Br)c2[O-])cn1 ZINC001175343991 1051512861 /nfs/dbraw/zinc/51/28/61/1051512861.db2.gz MDYSRMIZRBVGPF-UHFFFAOYSA-N -1 1 342.624 4.013 20 0 EIADMM O=S(=O)([N-][C@@H]1CCC[C@@H](F)C1)c1sc2ccccc2c1Cl ZINC001191754994 1051538203 /nfs/dbraw/zinc/53/82/03/1051538203.db2.gz CIISKPJAUGGMMD-NXEZZACHSA-N -1 1 347.864 4.114 20 0 EIADMM COC(=O)[N-]C(=S)N(c1cccc(C(C)C)c1)c1ccccc1N ZINC001175779054 1051781969 /nfs/dbraw/zinc/78/19/69/1051781969.db2.gz IRYFJEMRCAMANZ-UHFFFAOYSA-N -1 1 343.452 4.171 20 0 EIADMM CCN(CC)C(=O)c1ccc(F)c(Nc2c([O-])cc(F)cc2F)c1 ZINC001176070632 1051885006 /nfs/dbraw/zinc/88/50/06/1051885006.db2.gz UOULPBWWKWJVGQ-UHFFFAOYSA-N -1 1 338.329 4.035 20 0 EIADMM CC(=O)c1cccc(S(=O)(=O)[N-]c2ccccc2CCC(C)C)c1 ZINC000621548481 1051892566 /nfs/dbraw/zinc/89/25/66/1051892566.db2.gz DEJQSWPALIPKFB-UHFFFAOYSA-N -1 1 345.464 4.279 20 0 EIADMM Cc1csc(CCC(=O)Nc2cccc(C(F)(F)F)c2[O-])c1 ZINC001176183207 1051931827 /nfs/dbraw/zinc/93/18/27/1051931827.db2.gz OWFLZRWVISXZJE-UHFFFAOYSA-N -1 1 329.343 4.352 20 0 EIADMM COc1cc(Br)c([O-])c(NC(=O)OC2CCCCC2)c1 ZINC001193629928 1051958706 /nfs/dbraw/zinc/95/87/06/1051958706.db2.gz ZSEWKDGYYYCRNL-UHFFFAOYSA-N -1 1 344.205 4.045 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc3oncc3c2)c2ccccc12 ZINC001193864677 1052020115 /nfs/dbraw/zinc/02/01/15/1052020115.db2.gz RPVUMOHRXYKXGQ-UHFFFAOYSA-N -1 1 338.388 4.090 20 0 EIADMM CCN(CC)C(=O)c1cc(Nc2cc([O-])c(F)c(F)c2)ccc1F ZINC001176517686 1052105063 /nfs/dbraw/zinc/10/50/63/1052105063.db2.gz IWYHUUNOQCJXDH-UHFFFAOYSA-N -1 1 338.329 4.035 20 0 EIADMM CCN(CC)C(=O)c1cc(Nc2c([O-])cc(F)cc2F)ccc1F ZINC001176517886 1052105500 /nfs/dbraw/zinc/10/55/00/1052105500.db2.gz AHYXRPAVWKXFME-UHFFFAOYSA-N -1 1 338.329 4.035 20 0 EIADMM O=C(NCCc1ccccc1)Nc1cc(Cl)c(Cl)cc1[O-] ZINC001184940055 1052126927 /nfs/dbraw/zinc/12/69/27/1052126927.db2.gz XZANKLFFJFPTIN-UHFFFAOYSA-N -1 1 325.195 4.063 20 0 EIADMM O=C([N-]c1nc(F)c(F)c(Cl)c1F)c1ccc(C(F)(F)F)o1 ZINC001194403669 1052140926 /nfs/dbraw/zinc/14/09/26/1052140926.db2.gz VTYOAVDKEYMGIH-UHFFFAOYSA-N -1 1 344.598 4.016 20 0 EIADMM CC(C)(C)Oc1ccc(Nc2cc3ccc([O-])cc3oc2=O)cc1 ZINC001176638059 1052148148 /nfs/dbraw/zinc/14/81/48/1052148148.db2.gz KBNOSVXWTTWPKF-UHFFFAOYSA-N -1 1 325.364 4.420 20 0 EIADMM Cc1ccc(-c2cc(Nc3c(F)cc(F)c([O-])c3F)n(C)n2)cc1 ZINC001176670538 1052157071 /nfs/dbraw/zinc/15/70/71/1052157071.db2.gz YBJLPEMZRWGYAW-UHFFFAOYSA-N -1 1 333.313 4.262 20 0 EIADMM O=c1cc(Oc2ccc(Nc3c(F)cc(F)c([O-])c3F)cc2)cc[nH]1 ZINC001176670645 1052157374 /nfs/dbraw/zinc/15/73/74/1052157374.db2.gz JGNRPHKEKHIDSG-UHFFFAOYSA-N -1 1 348.280 4.446 20 0 EIADMM [O-]c1c(F)cc(F)c(Nc2ccnn2-c2cccc(Cl)c2)c1F ZINC001176663858 1052157944 /nfs/dbraw/zinc/15/79/44/1052157944.db2.gz NXTPFLQHIJCAMQ-UHFFFAOYSA-N -1 1 339.704 4.392 20 0 EIADMM [O-]c1c(F)cc(F)c(Nc2ccc(F)cc2Br)c1F ZINC001176671345 1052159337 /nfs/dbraw/zinc/15/93/37/1052159337.db2.gz AKKMLPQXHZKUBE-UHFFFAOYSA-N -1 1 336.082 4.455 20 0 EIADMM Cc1c(Br)ccc(N)c1Nc1c(F)cc(F)c([O-])c1F ZINC001176671384 1052159402 /nfs/dbraw/zinc/15/94/02/1052159402.db2.gz BRSKEHIYNVXOLC-UHFFFAOYSA-N -1 1 347.134 4.206 20 0 EIADMM [O-]c1c(F)cc(F)c(Nc2ccc(Cl)c3nsnc32)c1F ZINC001176671379 1052159494 /nfs/dbraw/zinc/15/94/94/1052159494.db2.gz XRMOGITVXJMVOJ-UHFFFAOYSA-N -1 1 331.706 4.211 20 0 EIADMM CCOC(=O)c1ccc(Nc2c(F)cc(F)c([O-])c2F)cc1Cl ZINC001176671584 1052160089 /nfs/dbraw/zinc/16/00/89/1052160089.db2.gz ILZFQDAMHWHTCU-UHFFFAOYSA-N -1 1 345.704 4.383 20 0 EIADMM COC(=O)c1ccc2cc(Nc3c(F)cc(F)c([O-])c3F)ccc2c1 ZINC001176674125 1052161621 /nfs/dbraw/zinc/16/16/21/1052161621.db2.gz QTXNKJXQQQNKPE-UHFFFAOYSA-N -1 1 347.292 4.493 20 0 EIADMM O=C(Nc1cc2ccc([O-])cc2oc1=O)Oc1ccc2ccccc2c1 ZINC001194632269 1052180536 /nfs/dbraw/zinc/18/05/36/1052180536.db2.gz RYGAEYQKNAQAIM-UHFFFAOYSA-N -1 1 347.326 4.263 20 0 EIADMM Cc1nc2cc([N-]S(=O)(=O)c3c(C)cccc3C)c(C)cc2s1 ZINC001194642971 1052183349 /nfs/dbraw/zinc/18/33/49/1052183349.db2.gz GIDMGOCUMQQFRF-UHFFFAOYSA-N -1 1 346.477 4.331 20 0 EIADMM CCOc1cc(C(=O)N2CCCC2(CC)CC)cc(Cl)c1[O-] ZINC001177024210 1052219043 /nfs/dbraw/zinc/21/90/43/1052219043.db2.gz XHRHALGJWZAUQE-UHFFFAOYSA-N -1 1 325.836 4.239 20 0 EIADMM CC(C)(NC(=O)c1c([O-])cccc1F)c1cccc(C(F)(F)F)c1 ZINC000622349844 1052222653 /nfs/dbraw/zinc/22/26/53/1052222653.db2.gz NCNNDCXEEWCSTK-UHFFFAOYSA-N -1 1 341.304 4.215 20 0 EIADMM Cc1ccsc1/C=C/C(=O)Nc1cccc(C(F)(F)F)c1[O-] ZINC001177076141 1052225986 /nfs/dbraw/zinc/22/59/86/1052225986.db2.gz XVQUMCDHISDCML-AATRIKPKSA-N -1 1 327.327 4.433 20 0 EIADMM O=C(NCCc1nc(C2CCCCC2)cs1)c1cc(F)ccc1[O-] ZINC000622365831 1052233291 /nfs/dbraw/zinc/23/32/91/1052233291.db2.gz GQHWGVPSTCCJDV-UHFFFAOYSA-N -1 1 348.443 4.008 20 0 EIADMM CSc1ccccc1[N-]S(=O)(=O)c1ccc(Cl)c(C)c1 ZINC001185524787 1052256242 /nfs/dbraw/zinc/25/62/42/1052256242.db2.gz KTNCACHZZILVGW-UHFFFAOYSA-N -1 1 327.858 4.171 20 0 EIADMM O=C([N-]c1c(F)cc(Cl)cc1F)c1cnc([C@@H]2CCCO2)s1 ZINC000180335315 1052794042 /nfs/dbraw/zinc/79/40/42/1052794042.db2.gz FCNFDVJRJVOTBM-JTQLQIEISA-N -1 1 344.770 4.179 20 0 EIADMM O=C([N-]c1cnoc1)c1sc(-c2ccco2)nc1-c1ccccc1 ZINC000623941073 1052840298 /nfs/dbraw/zinc/84/02/98/1052840298.db2.gz SYUHVRYKYDDBLE-UHFFFAOYSA-N -1 1 337.360 4.310 20 0 EIADMM O=C([N-]c1cnoc1)c1ccc(COc2ccc3ccccc3c2)o1 ZINC000623941847 1052840558 /nfs/dbraw/zinc/84/05/58/1052840558.db2.gz JKJSPZDJWVCMEI-UHFFFAOYSA-N -1 1 334.331 4.252 20 0 EIADMM O=C(Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)c1cc(C2CC2)[nH]c1C1CC1 ZINC000624037669 1052856851 /nfs/dbraw/zinc/85/68/51/1052856851.db2.gz BYCDCEYMZLOMLA-UHFFFAOYSA-N -1 1 348.406 4.118 20 0 EIADMM C[C@H](Sc1nc(C2CC2)cc(=O)[n-]1)c1nc(-c2cccs2)no1 ZINC000195079704 1053051491 /nfs/dbraw/zinc/05/14/91/1053051491.db2.gz ZYEILXJGVIXVBR-QMMMGPOBSA-N -1 1 346.437 4.024 20 0 EIADMM COc1ccc(Cl)cc1[N-]S(=O)(=O)/C=C\c1ccc(C)cc1 ZINC000864255942 1053228367 /nfs/dbraw/zinc/22/83/67/1053228367.db2.gz KGBYIALHRGDIJA-KTKRTIGZSA-N -1 1 337.828 4.070 20 0 EIADMM O=C([O-])CCc1cccc(CNCc2cscc2C(F)(F)F)c1 ZINC000864518599 1053300042 /nfs/dbraw/zinc/30/00/42/1053300042.db2.gz OHRKFCSVCLPDMX-UHFFFAOYSA-N -1 1 343.370 4.074 20 0 EIADMM Cc1ccc([O-])c(C(=O)Nc2ccc(C(F)(F)F)cc2Cl)n1 ZINC001195325769 1053361590 /nfs/dbraw/zinc/36/15/90/1053361590.db2.gz HYWQJBMAMAKNDK-UHFFFAOYSA-N -1 1 330.693 4.020 20 0 EIADMM CCOC(=O)NC(=S)[N-]c1ccc(-c2cccc(Cl)c2)cc1 ZINC001195490552 1053422484 /nfs/dbraw/zinc/42/24/84/1053422484.db2.gz IXJAWWLBZXJLLV-UHFFFAOYSA-N -1 1 334.828 4.450 20 0 EIADMM CCCCC[C@H](CC)C(=O)N1CCC(C(=O)c2ccc([O-])cc2)CC1 ZINC000775774569 1053907696 /nfs/dbraw/zinc/90/76/96/1053907696.db2.gz OAJFHHXXVBKRER-INIZCTEOSA-N -1 1 345.483 4.420 20 0 EIADMM [O-]c1cc(F)ccc1NC(=S)Nc1ccc(OC(F)(F)F)cc1 ZINC001197517432 1053923091 /nfs/dbraw/zinc/92/30/91/1053923091.db2.gz RVNTVPZJCOOVCU-UHFFFAOYSA-N -1 1 346.305 4.239 20 0 EIADMM CCOC1CC2(C[C@H]2C(=O)Nc2cc(Cl)c([O-])c3ccccc23)C1 ZINC000869376671 1053994397 /nfs/dbraw/zinc/99/43/97/1053994397.db2.gz XGYZYGQMQMVNLP-MWCFJMDPSA-N -1 1 345.826 4.343 20 0 EIADMM [O-]c1c(F)cccc1NC(=S)Nc1cccc(C(F)(F)F)c1 ZINC001198059574 1054053886 /nfs/dbraw/zinc/05/38/86/1054053886.db2.gz NCTLEGUVZRHJKJ-UHFFFAOYSA-N -1 1 330.306 4.359 20 0 EIADMM [O-]c1cc(F)ccc1NC(=S)Nc1cccc(C(F)(F)F)c1 ZINC001198057944 1054055221 /nfs/dbraw/zinc/05/52/21/1054055221.db2.gz QNEWNCIFLOIUAZ-UHFFFAOYSA-N -1 1 330.306 4.359 20 0 EIADMM Cc1nc(C(C)C)[n-]c(=O)c1C(=O)N1CCC[C@H](C2CCCCC2)C1 ZINC000856306283 1054055679 /nfs/dbraw/zinc/05/56/79/1054055679.db2.gz ZKBIILIBXFHDGZ-INIZCTEOSA-N -1 1 345.487 4.047 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2ccc(C(F)(F)F)cc2)c(C)s1 ZINC000032532002 1054105288 /nfs/dbraw/zinc/10/52/88/1054105288.db2.gz KPLOIQUWHMVXIM-UHFFFAOYSA-N -1 1 335.372 4.185 20 0 EIADMM CCCC(C)(C)NC(=O)CCn1c(-c2ccc(C)cc2)n[n-]c1=S ZINC000104346098 1054111734 /nfs/dbraw/zinc/11/17/34/1054111734.db2.gz UATOKMZRFIVQTD-UHFFFAOYSA-N -1 1 346.500 4.001 20 0 EIADMM C[C@H](C(=O)[N-]OCCCC(F)(F)F)c1ccccc1C(F)(F)F ZINC000871213278 1054169974 /nfs/dbraw/zinc/16/99/74/1054169974.db2.gz NUXRHHXCOMIYGK-VIFPVBQESA-N -1 1 343.267 4.199 20 0 EIADMM Cc1c(=O)[n-]n(-c2ccccc2)c1NC(=S)Nc1cccc(C)c1 ZINC001198717724 1054247008 /nfs/dbraw/zinc/24/70/08/1054247008.db2.gz KNAIGSUPAIDUBI-UHFFFAOYSA-N -1 1 338.436 4.004 20 0 EIADMM O=S(=O)([N-]c1ccc2sccc2c1)c1ccc2occc2c1 ZINC001198868328 1054294917 /nfs/dbraw/zinc/29/49/17/1054294917.db2.gz IIEDIVFAIJEVPI-UHFFFAOYSA-N -1 1 329.402 4.448 20 0 EIADMM Cc1cccc(C2CC2)c1[N-]S(=O)(=O)c1ccc2occc2c1 ZINC001198869546 1054297269 /nfs/dbraw/zinc/29/72/69/1054297269.db2.gz FPEIEHOBZFRQFZ-UHFFFAOYSA-N -1 1 327.405 4.419 20 0 EIADMM COc1ccc([C@H](C)NC(=O)c2cc3ccccc3cc2[O-])cc1F ZINC000045580833 1054336477 /nfs/dbraw/zinc/33/64/77/1054336477.db2.gz UYLISSXOMSFDJE-LBPRGKRZSA-N -1 1 339.366 4.184 20 0 EIADMM Cc1cccc(-c2n[n-]c(=S)n2CCC(=O)Nc2ccsc2)c1 ZINC000125147695 1054720550 /nfs/dbraw/zinc/72/05/50/1054720550.db2.gz HPSXMLPUDQMXQG-UHFFFAOYSA-N -1 1 344.465 4.006 20 0 EIADMM Cc1ccsc1-c1nsc([N-]C(=O)c2coc(C(C)(C)C)n2)n1 ZINC000875566642 1054801665 /nfs/dbraw/zinc/80/16/65/1054801665.db2.gz ZHYQNNLMXIPKDA-UHFFFAOYSA-N -1 1 348.453 4.113 20 0 EIADMM O=S(=O)([N-]c1ccc2nc(C3CC3)sc2c1)c1cccc(F)c1 ZINC000063879537 1054841705 /nfs/dbraw/zinc/84/17/05/1054841705.db2.gz MCPKIJHJJOBUIM-UHFFFAOYSA-N -1 1 348.424 4.114 20 0 EIADMM CC(C)N(Cc1cccs1)C(=O)NCc1ccc([O-])c(Cl)c1 ZINC000876392656 1054891968 /nfs/dbraw/zinc/89/19/68/1054891968.db2.gz AOOFUEFHDGIXQV-UHFFFAOYSA-N -1 1 338.860 4.227 20 0 EIADMM O=C(Nc1ccccc1Br)Nc1ccc([O-])c(F)c1F ZINC001201974893 1054953150 /nfs/dbraw/zinc/95/31/50/1054953150.db2.gz AOHFUIANKIBBRE-UHFFFAOYSA-N -1 1 343.127 4.077 20 0 EIADMM CCCc1nnc([N-]C(=O)c2cnc(-c3ccccc3F)s2)s1 ZINC000067538899 1055040038 /nfs/dbraw/zinc/04/00/38/1055040038.db2.gz FNHSVJNWJCVCAY-UHFFFAOYSA-N -1 1 348.428 4.006 20 0 EIADMM O=C1c2ccc([O-])cc2CC/C1=C\c1cnc(-c2ccccn2)s1 ZINC000084503105 1055088331 /nfs/dbraw/zinc/08/83/31/1055088331.db2.gz WXXDLCDNGIEFPG-JLHYYAGUSA-N -1 1 334.400 4.123 20 0 EIADMM O=C(Nc1ccc(Br)cc1)Nc1cc(F)c([O-])c(F)c1 ZINC001202332999 1055142858 /nfs/dbraw/zinc/14/28/58/1055142858.db2.gz LPMVRKIHFZDJAJ-UHFFFAOYSA-N -1 1 343.127 4.077 20 0 EIADMM COc1ccc(S(=O)(=O)[N-]c2cc(F)ccc2C)c2ccccc12 ZINC000055555662 1055803098 /nfs/dbraw/zinc/80/30/98/1055803098.db2.gz QKCREYUALFOKBU-UHFFFAOYSA-N -1 1 345.395 4.097 20 0 EIADMM CC(C)c1ccc([C@H](C)CC(=O)Nc2n[n-]c(C(F)(F)F)n2)cc1 ZINC000303752492 1056275992 /nfs/dbraw/zinc/27/59/92/1056275992.db2.gz MDEJSFCBXWQXLH-SNVBAGLBSA-N -1 1 340.349 4.079 20 0 EIADMM C[C@H](c1cc(Cl)ccc1Cl)N1CCC2(C[C@@H]2C(=O)[O-])CC1 ZINC000405363110 1056385512 /nfs/dbraw/zinc/38/55/12/1056385512.db2.gz RDHKOLISWRBMNM-ZWNOBZJWSA-N -1 1 328.239 4.241 20 0 EIADMM O=C(NCc1csc(-c2ccccc2)n1)c1c([O-])cccc1Cl ZINC000744355862 1059429423 /nfs/dbraw/zinc/42/94/23/1059429423.db2.gz ZOYOKQDIHQKNKY-UHFFFAOYSA-N -1 1 344.823 4.099 20 0 EIADMM O=C(OCc1cccc(Cl)n1)c1ccc(Cl)c(Cl)c1[O-] ZINC000744978918 1059684395 /nfs/dbraw/zinc/68/43/95/1059684395.db2.gz UXONKLZLNGQRPC-UHFFFAOYSA-N -1 1 332.570 4.104 20 0 EIADMM CCOc1cc(Nc2ccc(-n3ccc(=O)[n-]3)cc2)ccc1Cl ZINC001212581146 1060436225 /nfs/dbraw/zinc/43/62/25/1060436225.db2.gz SPDCGTVERQNNTQ-UHFFFAOYSA-N -1 1 329.787 4.374 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1cccc([C@H]2CCCOC2)c1 ZINC000766554808 1060549185 /nfs/dbraw/zinc/54/91/85/1060549185.db2.gz ACMHTOZJNQQBKJ-AWEZNQCLSA-N -1 1 331.799 4.192 20 0 EIADMM C[C@@H](Sc1ccc(Cl)cc1)C(=O)Nc1ccc(F)cc1[O-] ZINC000532267115 1032126520 /nfs/dbraw/zinc/12/65/20/1032126520.db2.gz HSFCGNPMBQWSQD-SECBINFHSA-N -1 1 325.792 4.304 20 0 EIADMM Cc1ccccc1C(=O)Nc1c([O-])cc(Br)cc1Cl ZINC000552209745 1039283763 /nfs/dbraw/zinc/28/37/63/1039283763.db2.gz VCQYQWRYAWUDFP-UHFFFAOYSA-N -1 1 340.604 4.369 20 0 EIADMM CCSCc1cccc([N-]S(=O)(=O)c2ccc(C)c(F)c2)c1 ZINC000610194285 1032216080 /nfs/dbraw/zinc/21/60/80/1032216080.db2.gz WWUQSTHKEXZNQN-UHFFFAOYSA-N -1 1 339.457 4.188 20 0 EIADMM COc1ccccc1C[C@H](C)CC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000532749557 1032287308 /nfs/dbraw/zinc/28/73/08/1032287308.db2.gz RFVRUWUIAMKFKK-LBPRGKRZSA-N -1 1 333.815 4.262 20 0 EIADMM C[C@@H]1[C@@H](C(=O)Nc2c([O-])cc(Br)cc2Cl)[C@@H]1C1CC1 ZINC000529368738 1032332571 /nfs/dbraw/zinc/33/25/71/1032332571.db2.gz ZZUYLOCPBRPRLV-HQDFOZKBSA-N -1 1 344.636 4.039 20 0 EIADMM CC1(C(=O)Nc2cc(Cl)c([O-])c3ccccc23)CCC(=O)CC1 ZINC000529540446 1032428179 /nfs/dbraw/zinc/42/81/79/1032428179.db2.gz ZEOSVUWBPUANNT-UHFFFAOYSA-N -1 1 331.799 4.287 20 0 EIADMM C[C@H]1CC(=O)CC[C@@H]1C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000529539433 1032444227 /nfs/dbraw/zinc/44/42/27/1032444227.db2.gz SFHBYBDVDWIKAR-JQWIXIFHSA-N -1 1 331.799 4.143 20 0 EIADMM C[C@H]1C(=O)CC[C@@H]1CC(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000529538376 1032444690 /nfs/dbraw/zinc/44/46/90/1032444690.db2.gz BLFXUOJNQKYQKM-GHMZBOCLSA-N -1 1 331.799 4.143 20 0 EIADMM COCc1c2ccccc2oc1-c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445476415 1032623138 /nfs/dbraw/zinc/62/31/38/1032623138.db2.gz CEIAJDQOMCOVHO-UHFFFAOYSA-N -1 1 340.310 4.141 20 0 EIADMM O=C([O-])c1ccccc1CN1CCC[C@H]1c1nc2ccccc2s1 ZINC000579722932 1018814823 /nfs/dbraw/zinc/81/48/23/1018814823.db2.gz SUABKQFPKJKDGN-INIZCTEOSA-N -1 1 338.432 4.332 20 0 EIADMM C[C@H](NCc1cccc([O-])c1Cl)c1nccn1-c1ccccc1 ZINC000339401167 1018842412 /nfs/dbraw/zinc/84/24/12/1018842412.db2.gz UJFBTISPBUXPEM-ZDUSSCGKSA-N -1 1 327.815 4.082 20 0 EIADMM O=C(c1ccc([O-])cc1)C1CCN(C(=O)c2cccc(C3CC3)c2)CC1 ZINC000654896531 1018981956 /nfs/dbraw/zinc/98/19/56/1018981956.db2.gz YDAYLHPTDDKSLN-UHFFFAOYSA-N -1 1 349.430 4.005 20 0 EIADMM O=C(CCc1ccc(Cl)cc1)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC000510063410 1018993951 /nfs/dbraw/zinc/99/39/51/1018993951.db2.gz PXILSOLFQXQUBS-UHFFFAOYSA-N -1 1 341.798 4.007 20 0 EIADMM CC(C)c1scnc1NC(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC000655082891 1019346021 /nfs/dbraw/zinc/34/60/21/1019346021.db2.gz NRVDHTYEMDOTJF-UHFFFAOYSA-N -1 1 330.331 4.243 20 0 EIADMM CC(C)CCOc1ccc(NC(=O)c2ccc([O-])cc2F)c(F)c1 ZINC000655361360 1019753149 /nfs/dbraw/zinc/75/31/49/1019753149.db2.gz ZRAWDMNWSWADBK-UHFFFAOYSA-N -1 1 335.350 4.348 20 0 EIADMM C[C@@H](c1cccs1)N(Cc1ccccc1)C(=O)c1cncc([O-])c1 ZINC000339893577 1020040731 /nfs/dbraw/zinc/04/07/31/1020040731.db2.gz MXMHRJBFIYCDTO-AWEZNQCLSA-N -1 1 338.432 4.252 20 0 EIADMM O=S(=O)([N-]c1ncccc1Cl)c1ccccc1-c1ccccc1 ZINC000180197891 1020080110 /nfs/dbraw/zinc/08/01/10/1020080110.db2.gz LRWVYKYTSYKDGJ-UHFFFAOYSA-N -1 1 344.823 4.203 20 0 EIADMM O=C([N-]c1nnc(-c2ccsc2)s1)c1coc(C2CCCC2)n1 ZINC000547783705 1020255039 /nfs/dbraw/zinc/25/50/39/1020255039.db2.gz HPMLPLPLPDHDNU-UHFFFAOYSA-N -1 1 346.437 4.165 20 0 EIADMM [O-]c1cccc(CNCc2ccsc2Br)c1Cl ZINC000388563805 1020566123 /nfs/dbraw/zinc/56/61/23/1020566123.db2.gz QSFHVLVCVLOMCO-UHFFFAOYSA-N -1 1 332.650 4.159 20 0 EIADMM O=C([N-]c1nnc(CC2CCCCC2)s1)c1coc(C2CCC2)n1 ZINC000683442843 1020828075 /nfs/dbraw/zinc/82/80/75/1020828075.db2.gz MCHALVNZAWRENN-UHFFFAOYSA-N -1 1 346.456 4.169 20 0 EIADMM Cc1c(Cl)cc(Nc2cnn(C(F)(F)F)c2)c([O-])c1Cl ZINC001210364712 1021051019 /nfs/dbraw/zinc/05/10/19/1021051019.db2.gz JCWXGJBGYGCPEQ-UHFFFAOYSA-N -1 1 326.105 4.424 20 0 EIADMM O=C(Nc1c([O-])cccc1F)c1cc(C2CC2)nc2ccc(F)cc21 ZINC000089541575 1021905715 /nfs/dbraw/zinc/90/57/15/1021905715.db2.gz XUEQBLNOVOFEAF-UHFFFAOYSA-N -1 1 340.329 4.348 20 0 EIADMM O=C(Nc1cc([O-])c(F)cc1F)c1[nH]c2ccc(F)cc2c1Cl ZINC001625893355 1022144091 /nfs/dbraw/zinc/14/40/91/1022144091.db2.gz HKFUHMDUMNFWJE-UHFFFAOYSA-N -1 1 340.688 4.197 20 0 EIADMM O=C([O-])c1csc(C[N@H+]2CCCCC[C@@H]2/C=C\c2ccccc2)n1 ZINC000580720468 1022403019 /nfs/dbraw/zinc/40/30/19/1022403019.db2.gz JTWMBCQIQBYEQJ-BLIJAFNYSA-N -1 1 342.464 4.299 20 0 EIADMM O=C([O-])c1csc(CN2CCCCC[C@@H]2/C=C\c2ccccc2)n1 ZINC000580720468 1022403033 /nfs/dbraw/zinc/40/30/33/1022403033.db2.gz JTWMBCQIQBYEQJ-BLIJAFNYSA-N -1 1 342.464 4.299 20 0 EIADMM O=C([O-])c1csc(CN2CCCCC[C@H]2/C=C/c2ccccc2)n1 ZINC000580720469 1022405338 /nfs/dbraw/zinc/40/53/38/1022405338.db2.gz JTWMBCQIQBYEQJ-OFAQMXQXSA-N -1 1 342.464 4.299 20 0 EIADMM Cc1cccc2c(=O)[nH]c(C(Cl)=Cc3ccc([O-])c(Cl)c3)nc12 ZINC000221617260 1022476197 /nfs/dbraw/zinc/47/61/97/1022476197.db2.gz ZYOYXFYERXKNQY-MDWZMJQESA-N -1 1 347.201 4.327 20 0 EIADMM COC(=O)c1cc(C)c(C(=O)[N-]c2cc(Cl)ccc2SC)o1 ZINC001125475096 1022523277 /nfs/dbraw/zinc/52/32/77/1022523277.db2.gz NAQCEXMNNQXMCJ-UHFFFAOYSA-N -1 1 339.800 4.002 20 0 EIADMM CCOc1cc(C(=O)N(C)[C@H]2CCCC[C@H]2C)cc(Cl)c1[O-] ZINC000186565673 1022673210 /nfs/dbraw/zinc/67/32/10/1022673210.db2.gz QLZINBMQBQDFQU-RISCZKNCSA-N -1 1 325.836 4.095 20 0 EIADMM O=C(c1ncc2ccccc2c1[O-])N1CCC[C@@H](c2ccccc2)CC1 ZINC001143472407 1022685463 /nfs/dbraw/zinc/68/54/63/1022685463.db2.gz DVWBAKGZJLCHIE-QGZVFWFLSA-N -1 1 346.430 4.350 20 0 EIADMM Cc1cccc(CS(=O)(=O)[N-]c2ccc(F)cc2C(F)(F)F)c1 ZINC000186603071 1022692026 /nfs/dbraw/zinc/69/20/26/1022692026.db2.gz NXOKNYQCMQGXEQ-UHFFFAOYSA-N -1 1 347.333 4.095 20 0 EIADMM CCOc1cc(C(=O)NC2(c3cccc(F)c3)CC2)cc(Cl)c1[O-] ZINC000186828276 1022764283 /nfs/dbraw/zinc/76/42/83/1022764283.db2.gz GIZHYJSUPAZDCT-UHFFFAOYSA-N -1 1 349.789 4.003 20 0 EIADMM CCc1nc(SCc2sc(C)nc2C(F)(F)F)[n-]c(=O)c1C ZINC000581023402 1022802461 /nfs/dbraw/zinc/80/24/61/1022802461.db2.gz YPGASKBBMIKHLX-UHFFFAOYSA-N -1 1 349.403 4.129 20 0 EIADMM O=C(Nc1ccc(N2CCCC2)cc1)c1ccc2ccccc2c1[O-] ZINC000327635291 1022839842 /nfs/dbraw/zinc/83/98/42/1022839842.db2.gz RKCCSFZYCOXQDN-UHFFFAOYSA-N -1 1 332.403 4.398 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc(-c3nccs3)cc2)cc1C ZINC000096695246 1022898264 /nfs/dbraw/zinc/89/82/64/1022898264.db2.gz OHGALJKNXXOKIY-UHFFFAOYSA-N -1 1 344.461 4.228 20 0 EIADMM O=C([N-]c1cnoc1)c1ncc(-c2cc(Cl)cc(Cl)c2)s1 ZINC001143391676 1023056983 /nfs/dbraw/zinc/05/69/83/1023056983.db2.gz JOWJKSBZHSHDJE-UHFFFAOYSA-N -1 1 340.191 4.357 20 0 EIADMM CO[C@H](CSc1nc(-c2ccccc2)c(C)c(=O)[n-]1)CC(C)C ZINC000416906496 1023070063 /nfs/dbraw/zinc/07/00/63/1023070063.db2.gz KVBKGNSVKFLRAY-HNNXBMFYSA-N -1 1 332.469 4.311 20 0 EIADMM O=c1nc([C@@H]2CCCO2)[n-]c2scc(-c3ccccc3Cl)c21 ZINC000178983984 1023193865 /nfs/dbraw/zinc/19/38/65/1023193865.db2.gz JKEZWZCZVGCFBI-LBPRGKRZSA-N -1 1 332.812 4.157 20 0 EIADMM CCCc1cc(=O)[n-]c(SCc2csc(-c3ccco3)n2)n1 ZINC000025463033 1023201087 /nfs/dbraw/zinc/20/10/87/1023201087.db2.gz MISNVRPCOSZQLC-UHFFFAOYSA-N -1 1 333.438 4.144 20 0 EIADMM C[C@H](NC(=O)c1ccc([O-])cc1F)c1cccc(C(F)(F)F)c1 ZINC000181048066 1023235388 /nfs/dbraw/zinc/23/53/88/1023235388.db2.gz AXFFCPQDHKJEEV-VIFPVBQESA-N -1 1 327.277 4.041 20 0 EIADMM CN(c1ccccc1NC(=O)c1ccc([O-])cc1F)C1CCCC1 ZINC000182040932 1023286626 /nfs/dbraw/zinc/28/66/26/1023286626.db2.gz YUCXACZXOFFGRV-UHFFFAOYSA-N -1 1 328.387 4.162 20 0 EIADMM O=C([O-])c1cccc(C[N@H+]2CCC[C@@H](Oc3ccccc3Cl)C2)c1 ZINC000414635061 1023304337 /nfs/dbraw/zinc/30/43/37/1023304337.db2.gz FLKPNPLWXIQTOR-MRXNPFEDSA-N -1 1 345.826 4.082 20 0 EIADMM O=C([O-])c1cccc(CN2CCC[C@@H](Oc3ccccc3Cl)C2)c1 ZINC000414635061 1023304341 /nfs/dbraw/zinc/30/43/41/1023304341.db2.gz FLKPNPLWXIQTOR-MRXNPFEDSA-N -1 1 345.826 4.082 20 0 EIADMM CSc1ccc(CN[C@@H](CC(=O)[O-])c2ccc(F)cc2F)s1 ZINC000417569227 1023355347 /nfs/dbraw/zinc/35/53/47/1023355347.db2.gz LGVLAARYACGBFR-ZDUSSCGKSA-N -1 1 343.420 4.054 20 0 EIADMM C[C@@H](NC(=O)c1cc2ccccc2cc1[O-])c1ccc(F)cc1F ZINC001149129241 1023370830 /nfs/dbraw/zinc/37/08/30/1023370830.db2.gz DFGXUXOOHRLWRZ-LLVKDONJSA-N -1 1 327.330 4.315 20 0 EIADMM C[C@H](Oc1cccc(C(C)(C)C)c1)C(=O)Nc1c([O-])cccc1F ZINC000605437932 1023392556 /nfs/dbraw/zinc/39/25/56/1023392556.db2.gz BSNTUHZRKVRLHW-LBPRGKRZSA-N -1 1 331.387 4.235 20 0 EIADMM CCc1ccc(-c2ccc(CN[C@@H](C(=O)[O-])[C@H](C)C3CC3)o2)cc1 ZINC000417640963 1023393268 /nfs/dbraw/zinc/39/32/68/1023393268.db2.gz NWXRBYNEWUFDQL-BFUOFWGJSA-N -1 1 327.424 4.098 20 0 EIADMM CCOc1c(Cl)cccc1CNCc1ccc(C(=O)[O-])c(C)c1 ZINC000417667501 1023402109 /nfs/dbraw/zinc/40/21/09/1023402109.db2.gz IMZSPCQGGBOICE-UHFFFAOYSA-N -1 1 333.815 4.035 20 0 EIADMM O=C(c1c([O-])cnc2ccc(Cl)cc21)N1CC2(C1)CCCCC2 ZINC000549191626 1023453540 /nfs/dbraw/zinc/45/35/40/1023453540.db2.gz YTFPOOHAVPHTHT-UHFFFAOYSA-N -1 1 330.815 4.000 20 0 EIADMM Cc1cc(C)c(C)c(S(=O)(=O)[N-]c2cnc(Cl)cc2C)c1C ZINC000319181398 1023467153 /nfs/dbraw/zinc/46/71/53/1023467153.db2.gz NIBMZBUZMJZYAJ-UHFFFAOYSA-N -1 1 338.860 4.078 20 0 EIADMM CCC[C@@H](C(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)c1ccccc1 ZINC000613666140 1023479542 /nfs/dbraw/zinc/47/95/42/1023479542.db2.gz TVMSWTKFKCSHRQ-QGZVFWFLSA-N -1 1 335.407 4.305 20 0 EIADMM O=C([O-])c1cccc(-c2nc(CN3CCC[C@H](CCF)C3)cs2)c1 ZINC000656764287 1023506149 /nfs/dbraw/zinc/50/61/49/1023506149.db2.gz WSHAHFNDIUCVNM-CYBMUJFWSA-N -1 1 348.443 4.080 20 0 EIADMM [O-]c1cccc(CNc2cc3c(cc2Cl)OCCO3)c1Cl ZINC000328213201 1023534393 /nfs/dbraw/zinc/53/43/93/1023534393.db2.gz JCGRKJPSBGDONN-UHFFFAOYSA-N -1 1 326.179 4.082 20 0 EIADMM CC[C@H](C)Oc1ccc([N-]S(=O)(=O)c2cc(C)sc2C)cc1 ZINC000511697423 1023829597 /nfs/dbraw/zinc/82/95/97/1023829597.db2.gz JYWSWWTXRQRLPM-NSHDSACASA-N -1 1 339.482 4.343 20 0 EIADMM CC[C@H](C)Oc1cccc([N-]S(=O)(=O)c2ccc3c(c2)CCC3)c1 ZINC000511722724 1023838313 /nfs/dbraw/zinc/83/83/13/1023838313.db2.gz NFOQMZVQRRJOKP-AWEZNQCLSA-N -1 1 345.464 4.153 20 0 EIADMM CC[C@H](C)Oc1cccc([N-]S(=O)(=O)c2ccc(Cl)cc2)c1 ZINC000511730179 1023840902 /nfs/dbraw/zinc/84/09/02/1023840902.db2.gz QDUOFWNTMANISD-LBPRGKRZSA-N -1 1 339.844 4.318 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2cc(Cl)ccc2C)cc1Cl ZINC000048653309 1024670034 /nfs/dbraw/zinc/67/00/34/1024670034.db2.gz HAEMKNXMBAIVJH-UHFFFAOYSA-N -1 1 330.236 4.411 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N1CCCCC[C@@H]1[C@@H]1CCCCC1=O ZINC000092429903 1024807051 /nfs/dbraw/zinc/80/70/51/1024807051.db2.gz YQNZSAIMAVGEAL-GOEBONIOSA-N -1 1 349.858 4.190 20 0 EIADMM COc1c(F)cc(Nc2ccc(F)c(Br)c2[O-])cc1F ZINC001211687293 1024874311 /nfs/dbraw/zinc/87/43/11/1024874311.db2.gz ZPCMZMKJQNBZNH-UHFFFAOYSA-N -1 1 348.118 4.324 20 0 EIADMM O=C([O-])CC[C@H]1CCCN(Cc2ccc(Cl)c(C(F)(F)F)c2)C1 ZINC000662211534 1024963005 /nfs/dbraw/zinc/96/30/05/1024963005.db2.gz QFZOHHISHIRUCW-LLVKDONJSA-N -1 1 349.780 4.436 20 0 EIADMM C[C@H]1CCN(C(=O)c2cc3ccccc3cc2[O-])c2c(O)cccc21 ZINC000186256004 1025025694 /nfs/dbraw/zinc/02/56/94/1025025694.db2.gz IGEFTFXOQBNFKH-ZDUSSCGKSA-N -1 1 333.387 4.405 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1CC=C(c2ccc(O)cc2)CC1 ZINC000057839647 1025039531 /nfs/dbraw/zinc/03/95/31/1025039531.db2.gz QJHTZFSMYLALPJ-UHFFFAOYSA-N -1 1 345.398 4.181 20 0 EIADMM CCCc1ccc([N-]S(=O)(=O)c2cccc(C(F)F)c2)cc1 ZINC000780365543 1025176022 /nfs/dbraw/zinc/17/60/22/1025176022.db2.gz DUYVRHVNQGCUCG-UHFFFAOYSA-N -1 1 325.380 4.378 20 0 EIADMM CSc1ccc([O-])c(C(=O)N2CC3(CCC3)c3ccccc32)c1 ZINC000613916918 1025446481 /nfs/dbraw/zinc/44/64/81/1025446481.db2.gz MBEUULCPXKNDBH-UHFFFAOYSA-N -1 1 325.433 4.196 20 0 EIADMM O=S(=O)([N-]c1cccc(Cl)c1F)c1cccc(Cl)c1F ZINC000048653625 1026028996 /nfs/dbraw/zinc/02/89/96/1026028996.db2.gz OEAVYFBHPVJFLO-UHFFFAOYSA-N -1 1 338.162 4.072 20 0 EIADMM C[C@H](Oc1ccc(Cl)cc1)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000111665889 1026314217 /nfs/dbraw/zinc/31/42/17/1026314217.db2.gz YKKOLTWSIUQEFF-VIFPVBQESA-N -1 1 326.179 4.105 20 0 EIADMM CCOc1cc(-c2noc([C@@H](C)Cc3ccco3)n2)cc(Cl)c1[O-] ZINC000664847629 1026472107 /nfs/dbraw/zinc/47/21/07/1026472107.db2.gz YZRGNOAJKLDKRT-JTQLQIEISA-N -1 1 348.786 4.434 20 0 EIADMM O=C([O-])C[C@@H](NCc1ccc(-c2ccccc2)o1)c1ccsc1 ZINC000426686934 1026475945 /nfs/dbraw/zinc/47/59/45/1026475945.db2.gz HSSVZOZSTOYAJM-MRXNPFEDSA-N -1 1 327.405 4.314 20 0 EIADMM O=C([O-])c1ccc(CNCc2ccc(-c3c(F)cccc3F)o2)cc1 ZINC000426691432 1026494352 /nfs/dbraw/zinc/49/43/52/1026494352.db2.gz HXNJFKJAZZKRME-UHFFFAOYSA-N -1 1 343.329 4.213 20 0 EIADMM CC(C)(C)CC[C@@H](NCc1ccc(-c2ccccc2F)o1)C(=O)[O-] ZINC000426742700 1026524126 /nfs/dbraw/zinc/52/41/26/1026524126.db2.gz QNJYHKKVEUTJOZ-MRXNPFEDSA-N -1 1 333.403 4.455 20 0 EIADMM O=C([O-])[C@@H](NCc1ccc(-c2ccc(F)cc2)s1)c1ccccc1 ZINC000426777815 1026552093 /nfs/dbraw/zinc/55/20/93/1026552093.db2.gz QXUTXKAAGQJTLG-SFHVURJKSA-N -1 1 341.407 4.470 20 0 EIADMM Cc1ccc([C@@H](CC(=O)[O-])NCc2cc(Cl)cc3cccnc32)o1 ZINC000426786593 1026562799 /nfs/dbraw/zinc/56/27/99/1026562799.db2.gz WRXQMLXJMRMSLW-OAHLLOKOSA-N -1 1 344.798 4.095 20 0 EIADMM COc1ccc2cc(CN[C@@H](CC(=O)[O-])c3ccc(C)o3)ccc2c1 ZINC000426808395 1026573042 /nfs/dbraw/zinc/57/30/42/1026573042.db2.gz MHMHJACTZYLLCI-SFHVURJKSA-N -1 1 339.391 4.055 20 0 EIADMM CC[C@H](C)c1ccc(S(=O)(=O)[N-]c2ccc3c(c2)COC3)cc1 ZINC000506995350 1026580868 /nfs/dbraw/zinc/58/08/68/1026580868.db2.gz QGSNJXCVNGEDTH-ZDUSSCGKSA-N -1 1 331.437 4.031 20 0 EIADMM Cc1cc(C)cc(C[C@H](NCc2ccc(-c3ccccc3)o2)C(=O)[O-])c1 ZINC000426825350 1026583277 /nfs/dbraw/zinc/58/32/77/1026583277.db2.gz QCPRRUFLJUELRE-FQEVSTJZSA-N -1 1 349.430 4.349 20 0 EIADMM COc1ccc(NC(=O)c2ccc(C(F)(F)F)c([O-])c2)cc1Cl ZINC000684869325 1026628564 /nfs/dbraw/zinc/62/85/64/1026628564.db2.gz RDVKBVPFYHTOFL-UHFFFAOYSA-N -1 1 345.704 4.325 20 0 EIADMM O=C(c1ccc(C(F)(F)F)c([O-])c1)N(Cc1ccccc1)C1CC1 ZINC000684870667 1026633310 /nfs/dbraw/zinc/63/33/10/1026633310.db2.gz IMVUUSQQFHFJKZ-UHFFFAOYSA-N -1 1 335.325 4.216 20 0 EIADMM O=C(c1ccc(C(F)(F)F)c([O-])c1)N1CCC[C@H]1c1ccccc1 ZINC000684871080 1026635656 /nfs/dbraw/zinc/63/56/56/1026635656.db2.gz SOUIXBZBMYHHBT-HNNXBMFYSA-N -1 1 335.325 4.388 20 0 EIADMM Cc1cc(C)c(C)c(S(=O)(=O)[N-]c2ccc3cc[nH]c3c2)c1C ZINC000432618667 1026641675 /nfs/dbraw/zinc/64/16/75/1026641675.db2.gz PCGFGDLCQHUOKF-UHFFFAOYSA-N -1 1 328.437 4.202 20 0 EIADMM C[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684875496 1026649936 /nfs/dbraw/zinc/64/99/36/1026649936.db2.gz GXYDVGDLIBWEFD-UHIISALHSA-N -1 1 327.346 4.204 20 0 EIADMM O=C(Nc1cccc(-c2ncco2)c1)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684876941 1026656841 /nfs/dbraw/zinc/65/68/41/1026656841.db2.gz HEXSYDZCWWLPFH-UHFFFAOYSA-N -1 1 348.280 4.318 20 0 EIADMM COc1ccc(OC)c(CN(Cc2cccc([O-])c2Cl)C2CC2)c1 ZINC000507206748 1026692534 /nfs/dbraw/zinc/69/25/34/1026692534.db2.gz ADJGXTRBQCBGAI-UHFFFAOYSA-N -1 1 347.842 4.227 20 0 EIADMM Cc1cnc(C(=O)N(C)Cc2ccccc2-c2ccccc2)c([O-])c1 ZINC000427111566 1026729263 /nfs/dbraw/zinc/72/92/63/1026729263.db2.gz SLQILHCARJUUTP-UHFFFAOYSA-N -1 1 332.403 4.035 20 0 EIADMM Cc1c([N-]S(=O)(=O)c2ccc(Cl)cc2)cccc1-c1ncco1 ZINC000427291131 1026805040 /nfs/dbraw/zinc/80/50/40/1026805040.db2.gz DOMKTSZWPVQTQD-UHFFFAOYSA-N -1 1 348.811 4.104 20 0 EIADMM Cc1sc2[nH]c(-c3ccc([O-])cn3)nc(=O)c2c1-c1ccccc1 ZINC000427470125 1026861220 /nfs/dbraw/zinc/86/12/20/1026861220.db2.gz FYZVRUQLPPHEEW-UHFFFAOYSA-N -1 1 335.388 4.140 20 0 EIADMM Cc1ccccc1NC(=O)[C@H](C)n1c(-c2cccs2)n[n-]c1=S ZINC000065575467 1026868263 /nfs/dbraw/zinc/86/82/63/1026868263.db2.gz PVKGGSJYVCVQHA-NSHDSACASA-N -1 1 344.465 4.177 20 0 EIADMM C[C@@H](C1CC1)n1cc([N-]c2nn3cc(C4CCCC4)nc3s2)cn1 ZINC000302554997 1027334178 /nfs/dbraw/zinc/33/41/78/1027334178.db2.gz ROCVZWGKFNKIHU-NSHDSACASA-N -1 1 342.472 4.360 20 0 EIADMM Cc1nc(-c2ccc(N[C@H]3CCCC(C)(C)C3)nc2)[n-]c(=O)c1C ZINC000302663373 1027354639 /nfs/dbraw/zinc/35/46/39/1027354639.db2.gz MCNSFEGADJKWCE-HNNXBMFYSA-N -1 1 326.444 4.242 20 0 EIADMM CCCn1ccc2cc([N-]S(=O)(=O)c3ccccc3C)ccc21 ZINC000520279673 1027379019 /nfs/dbraw/zinc/37/90/19/1027379019.db2.gz NNPAORMXRXGUKD-UHFFFAOYSA-N -1 1 328.437 4.161 20 0 EIADMM O=C(Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)C1(Cc2ccccc2)CCC1 ZINC000343017575 1027889918 /nfs/dbraw/zinc/88/99/18/1027889918.db2.gz TUFBQAFGCGVPAC-UHFFFAOYSA-N -1 1 347.418 4.134 20 0 EIADMM O=C([N-]c1c(F)cc(F)cc1F)c1cnc(-c2ccccc2)s1 ZINC000443918061 1028059107 /nfs/dbraw/zinc/05/91/07/1028059107.db2.gz QJEQOMQTAHRDND-UHFFFAOYSA-N -1 1 334.322 4.480 20 0 EIADMM CCOc1cc(-c2noc([C@H]3CC[C@H](CC)O3)n2)cc(Cl)c1[O-] ZINC000278144457 1028295052 /nfs/dbraw/zinc/29/50/52/1028295052.db2.gz UAWPDDKZELZLPY-CMPLNLGQSA-N -1 1 338.791 4.124 20 0 EIADMM CCOc1cc(-c2noc([C@@H](C)CCCOC)n2)cc(Cl)c1[O-] ZINC000278158991 1028344847 /nfs/dbraw/zinc/34/48/47/1028344847.db2.gz VLCZJUJPDKHYFA-JTQLQIEISA-N -1 1 340.807 4.024 20 0 EIADMM Cc1ccc(SCC(F)(F)F)c(NC(=O)c2cncc([O-])c2)c1 ZINC000346366012 1028403950 /nfs/dbraw/zinc/40/39/50/1028403950.db2.gz DTKUMMLZYFKCGD-UHFFFAOYSA-N -1 1 342.342 4.002 20 0 EIADMM CCCCCOCc1nc(-c2cc(Cl)c([O-])c(OCC)c2)no1 ZINC000445425232 1028521115 /nfs/dbraw/zinc/52/11/15/1028521115.db2.gz BUENNULSTNXWQC-UHFFFAOYSA-N -1 1 340.807 4.201 20 0 EIADMM [O-]c1ccc(-c2noc([C@@H]3Cc4cc(Cl)ccc4O3)n2)c(Cl)c1 ZINC000445448708 1028536063 /nfs/dbraw/zinc/53/60/63/1028536063.db2.gz SRBFCKRFOPPBSA-AWEZNQCLSA-N -1 1 349.173 4.425 20 0 EIADMM [O-]c1ccc(-c2noc(Cn3ccc4ccccc43)n2)c(Cl)c1 ZINC000445447238 1028582056 /nfs/dbraw/zinc/58/20/56/1028582056.db2.gz GZSGYHGJILXZRD-UHFFFAOYSA-N -1 1 325.755 4.099 20 0 EIADMM COc1cc(-c2nc(-c3ccc([O-])cc3Cl)no2)ccc1Cl ZINC000445447531 1028582678 /nfs/dbraw/zinc/58/26/78/1028582678.db2.gz HXAFPPKXLXTOAL-UHFFFAOYSA-N -1 1 337.162 4.425 20 0 EIADMM Cc1cccc2[nH]cc(Cc3nc(-c4ccc([O-])cc4Cl)no3)c21 ZINC000445447227 1028583985 /nfs/dbraw/zinc/58/39/85/1028583985.db2.gz RMIHFWDLBBMJTG-UHFFFAOYSA-N -1 1 339.782 4.476 20 0 EIADMM Cc1ccc(SCCc2nc(-c3ccc([O-])cc3F)no2)cc1 ZINC000445465515 1028585796 /nfs/dbraw/zinc/58/57/96/1028585796.db2.gz YYXXSZDPHILCKU-UHFFFAOYSA-N -1 1 330.384 4.225 20 0 EIADMM C[C@H](Oc1cccc(Cl)c1)c1nc(-c2ccc([O-])cc2F)no1 ZINC000445461721 1028617745 /nfs/dbraw/zinc/61/77/45/1028617745.db2.gz HXWZLFCBROKIFA-VIFPVBQESA-N -1 1 334.734 4.375 20 0 EIADMM [O-]c1ccc(-c2noc(COc3cccc4ccccc43)n2)cc1F ZINC000445478513 1028625178 /nfs/dbraw/zinc/62/51/78/1028625178.db2.gz RPWMRFPQWNJIFZ-UHFFFAOYSA-N -1 1 336.322 4.314 20 0 EIADMM [O-]c1ccc(-c2noc(Cc3ccc(Cl)c(Cl)c3)n2)cc1F ZINC000445480301 1028626974 /nfs/dbraw/zinc/62/69/74/1028626974.db2.gz JDIILKPYRDFYQC-UHFFFAOYSA-N -1 1 339.153 4.479 20 0 EIADMM COc1ccc(S[C@@H](C)c2nc(-c3ccc([O-])c(F)c3)no2)cc1 ZINC000445481639 1028628100 /nfs/dbraw/zinc/62/81/00/1028628100.db2.gz NJQROXKUESXYJU-JTQLQIEISA-N -1 1 346.383 4.443 20 0 EIADMM [O-]c1ccc(-c2noc(CSc3ccc(F)c(F)c3)n2)cc1F ZINC000445484647 1028634366 /nfs/dbraw/zinc/63/43/66/1028634366.db2.gz XVWXOLRIKBTAMO-UHFFFAOYSA-N -1 1 338.310 4.152 20 0 EIADMM Cc1cc(-c2nc(-c3ccc([O-])c(F)c3)no2)nn1C1CCCCC1 ZINC000445476591 1028646990 /nfs/dbraw/zinc/64/69/90/1028646990.db2.gz FHRFTCZRTVBCLH-UHFFFAOYSA-N -1 1 342.374 4.258 20 0 EIADMM CCCCCc1ccc([N-]S(=O)(=O)c2ccc3c(c2)COC3)cc1 ZINC000524102653 1028652483 /nfs/dbraw/zinc/65/24/83/1028652483.db2.gz LRLDJHQCQGHNKJ-UHFFFAOYSA-N -1 1 345.464 4.250 20 0 EIADMM C[C@H](C(=O)[N-][C@H](c1ccc(Cl)cc1)C(F)(F)F)C(F)(F)F ZINC000080440486 1028784463 /nfs/dbraw/zinc/78/44/63/1028784463.db2.gz CVBFUWGTKNNSOI-HZGVNTEJSA-N -1 1 333.659 4.258 20 0 EIADMM Cc1ccc(-c2cc(=NC(=O)c3cc4cc(F)ccc4o3)[nH][n-]2)s1 ZINC000524232233 1028795326 /nfs/dbraw/zinc/79/53/26/1028795326.db2.gz CNGXGKHOGGFNKZ-UHFFFAOYSA-N -1 1 341.367 4.006 20 0 EIADMM O=C(Nc1cccc(Oc2ccncc2)c1)c1c(F)ccc([O-])c1F ZINC000343474027 1029326528 /nfs/dbraw/zinc/32/65/28/1029326528.db2.gz KZNUAKZRDHLXAR-UHFFFAOYSA-N -1 1 342.301 4.110 20 0 EIADMM CSc1ccc(O[C@H](C)C(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000132050077 1029420400 /nfs/dbraw/zinc/42/04/00/1029420400.db2.gz JVKVKZSANQSQBZ-SNVBAGLBSA-N -1 1 337.828 4.174 20 0 EIADMM Cc1cccc2c1CC[C@@H]2Nc1ccc(-c2nc(C)c(C)c(=O)[n-]2)cn1 ZINC000525192660 1029516893 /nfs/dbraw/zinc/51/68/93/1029516893.db2.gz LTIBJLSHYDCAOW-SFHVURJKSA-N -1 1 346.434 4.269 20 0 EIADMM CN(Cc1nc(=O)c2sccc2[n-]1)[C@@H]1CCc2ccc(Cl)cc21 ZINC000343627968 1029612799 /nfs/dbraw/zinc/61/27/99/1029612799.db2.gz GZSQIGOGBBXXSA-CQSZACIVSA-N -1 1 345.855 4.170 20 0 EIADMM CC(C)[C@H]1CN([C@H](C(=O)[O-])c2ccc(Cl)cc2Cl)CCS1 ZINC000565107291 1029650897 /nfs/dbraw/zinc/65/08/97/1029650897.db2.gz UWKJFFZYGVIZLD-KGLIPLIRSA-N -1 1 348.295 4.193 20 0 EIADMM O=C([O-])c1csc(CN2CCCC[C@H]2CCCc2ccccc2)n1 ZINC000584236904 1029686027 /nfs/dbraw/zinc/68/60/27/1029686027.db2.gz CHAXBEUVXLBKSF-INIZCTEOSA-N -1 1 344.480 4.219 20 0 EIADMM Cc1ccc([C@H](C)Nc2ccc(-c3nc(C)c(C)c(=O)[n-]3)cn2)s1 ZINC000301329336 1029708724 /nfs/dbraw/zinc/70/87/24/1029708724.db2.gz AVAXYRSJLKHNNW-ZDUSSCGKSA-N -1 1 340.452 4.404 20 0 EIADMM Cc1nc(-c2ccc(N[C@@H]3CC[C@H](C)C[C@H]3C)nc2)[n-]c(=O)c1C ZINC000301412073 1029728161 /nfs/dbraw/zinc/72/81/61/1029728161.db2.gz YSOBLBIEDZJTKU-HWWQOWPSSA-N -1 1 326.444 4.098 20 0 EIADMM CCC(CC)(CC)CNc1ccc(-c2nc(C)c(C)c(=O)[n-]2)cn1 ZINC000301652906 1029782789 /nfs/dbraw/zinc/78/27/89/1029782789.db2.gz TZZYEXAOHBVOEY-UHFFFAOYSA-N -1 1 328.460 4.489 20 0 EIADMM CCc1nc(SCc2ccc(SC)c(OC)c2)[n-]c(=O)c1C ZINC000584422276 1029843588 /nfs/dbraw/zinc/84/35/88/1029843588.db2.gz RKJXAZAKWUPCRF-UHFFFAOYSA-N -1 1 336.482 4.076 20 0 EIADMM CC[C@H]1c2ccccc2CN1c1ccc(-c2nc(C)c(C)c(=O)[n-]2)cn1 ZINC000897353391 1029986311 /nfs/dbraw/zinc/98/63/11/1029986311.db2.gz AKEQQHBXFNSPQK-SFHVURJKSA-N -1 1 346.434 4.332 20 0 EIADMM CC[C@H](Nc1ccc(-c2nc(C)c(C)c(=O)[n-]2)cn1)C1CCCC1 ZINC000450869666 1030060246 /nfs/dbraw/zinc/06/02/46/1030060246.db2.gz BZZBLIKXWFKNAP-INIZCTEOSA-N -1 1 326.444 4.242 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccccc2C(C)(F)F)cc1C ZINC000451088908 1030232906 /nfs/dbraw/zinc/23/29/06/1030232906.db2.gz RJSACSLBUQCCKI-UHFFFAOYSA-N -1 1 325.380 4.216 20 0 EIADMM Cc1ccc(-c2ccc(C)c([N-]S(=O)(=O)c3ccccc3)c2)o1 ZINC000475833498 1030855558 /nfs/dbraw/zinc/85/55/58/1030855558.db2.gz XWEYRXBWLBRSLL-UHFFFAOYSA-N -1 1 327.405 4.364 20 0 EIADMM O=C([O-])c1cccc(CN2CCCC[C@H]2c2nc3ccccc3o2)c1 ZINC000263444614 1030872815 /nfs/dbraw/zinc/87/28/15/1030872815.db2.gz FOTLIKVNDOQENR-KRWDZBQOSA-N -1 1 336.391 4.253 20 0 EIADMM CCC[C@H]1CCCC[N@H+]1Cc1ccc(C(=O)[O-])cc1Br ZINC000226736326 1031104388 /nfs/dbraw/zinc/10/43/88/1031104388.db2.gz CVDZESXHJWHKDC-AWEZNQCLSA-N -1 1 340.261 4.302 20 0 EIADMM CC(C)COc1ccc([N-]S(=O)(=O)c2ccccc2)cc1Cl ZINC000030532140 1031104977 /nfs/dbraw/zinc/10/49/77/1031104977.db2.gz FVJJKWMAXDVSEP-UHFFFAOYSA-N -1 1 339.844 4.176 20 0 EIADMM CCc1cc(Br)ccc1NC(=O)c1ccc([O-])cc1F ZINC000229789919 1031121019 /nfs/dbraw/zinc/12/10/19/1031121019.db2.gz LHOGXNWLTHZMOS-UHFFFAOYSA-N -1 1 338.176 4.109 20 0 EIADMM O=C(Nc1ccc(F)cc1[O-])[C@H]1C[C@@H]1c1ccccc1C(F)(F)F ZINC000532621090 1031429746 /nfs/dbraw/zinc/42/97/46/1031429746.db2.gz VWBLZKJYTWQEEV-NEPJUHHUSA-N -1 1 339.288 4.292 20 0 EIADMM O=C([O-])[C@H]1C[C@H](C2CCCCC2)CN1Cc1sccc1Cl ZINC000576293135 1034387813 /nfs/dbraw/zinc/38/78/13/1034387813.db2.gz JETJPEWYOBWRTL-GXTWGEPZSA-N -1 1 327.877 4.257 20 0 EIADMM C[C@H]1CC(C)(C)CN1Cc1csc(-c2ccc(C(=O)[O-])cc2)n1 ZINC000576710724 1034883283 /nfs/dbraw/zinc/88/32/83/1034883283.db2.gz RMVBEQWCVHEYNI-LBPRGKRZSA-N -1 1 330.453 4.129 20 0 EIADMM C[C@@H]1CC(C)(C)CN1Cc1csc(-c2ccc(C(=O)[O-])cc2)n1 ZINC000576710723 1034883399 /nfs/dbraw/zinc/88/33/99/1034883399.db2.gz RMVBEQWCVHEYNI-GFCCVEGCSA-N -1 1 330.453 4.129 20 0 EIADMM CCc1cccc(S(=O)(=O)[N-]c2ccccc2N2CCCCC2)c1 ZINC000433807678 1034925843 /nfs/dbraw/zinc/92/58/43/1034925843.db2.gz JTWIQDQZUOTITK-UHFFFAOYSA-N -1 1 344.480 4.040 20 0 EIADMM CC[C@H](C)NC(=O)c1ccc(NCc2cccc([O-])c2Cl)cc1 ZINC000513429511 1034937908 /nfs/dbraw/zinc/93/79/08/1034937908.db2.gz GTSKMUXJPIQRDK-LBPRGKRZSA-N -1 1 332.831 4.186 20 0 EIADMM CCc1onc(C)c1[N-]C(=O)c1coc(-c2ccccc2Cl)n1 ZINC000345373920 1035206267 /nfs/dbraw/zinc/20/62/67/1035206267.db2.gz CZVZMOSDGFWJJM-UHFFFAOYSA-N -1 1 331.759 4.106 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2c(C)c(C)c(C)c(C)c2C)c(O)c1 ZINC000034843796 1035480262 /nfs/dbraw/zinc/48/02/62/1035480262.db2.gz HZLUYLUZYWQDRR-UHFFFAOYSA-N -1 1 333.453 4.044 20 0 EIADMM CCOc1cc(-c2noc([C@H](C)CC(F)F)n2)cc(Cl)c1[O-] ZINC000420494731 1035643967 /nfs/dbraw/zinc/64/39/67/1035643967.db2.gz SIKMVEMZIOZHGE-SSDOTTSWSA-N -1 1 332.734 4.253 20 0 EIADMM CCC[C@@]1(C)CCCN(C(=O)c2ccc(Br)c([O-])c2)C1 ZINC000491028009 1035774465 /nfs/dbraw/zinc/77/44/65/1035774465.db2.gz MVVXKTIMOAXIQC-INIZCTEOSA-N -1 1 340.261 4.197 20 0 EIADMM CSCC1(Cc2noc(-c3ccc4ccccc4c3[O-])n2)CC1 ZINC000596608275 1035923344 /nfs/dbraw/zinc/92/33/44/1035923344.db2.gz GABHTNRPDXRIKG-UHFFFAOYSA-N -1 1 326.421 4.281 20 0 EIADMM Cc1noc(C(C)C)c1[N-]C(=O)c1cc(F)c(Cl)nc1Cl ZINC000906275204 1036181859 /nfs/dbraw/zinc/18/18/59/1036181859.db2.gz SLTRVZLIZQVNCH-UHFFFAOYSA-N -1 1 332.162 4.200 20 0 EIADMM O=C(CSc1nc(C(F)F)cc(=O)[n-]1)c1ccc2ccccc2c1 ZINC000572080763 1036406435 /nfs/dbraw/zinc/40/64/35/1036406435.db2.gz LRRYWXQZOVALAW-UHFFFAOYSA-N -1 1 346.358 4.248 20 0 EIADMM O=C(Nc1ccc(-c2csnn2)cc1)Nc1ccc([O-])c(Cl)c1 ZINC000486116048 1036485618 /nfs/dbraw/zinc/48/56/18/1036485618.db2.gz BLEDYGSUOBWUBD-UHFFFAOYSA-N -1 1 346.799 4.208 20 0 EIADMM CCCc1ccc(S(=O)(=O)[N-]c2cccc([C@@H](C)OC)c2)cc1 ZINC000588833412 1036564364 /nfs/dbraw/zinc/56/43/64/1036564364.db2.gz MPLTYPAQYVCAKY-CQSZACIVSA-N -1 1 333.453 4.147 20 0 EIADMM O=C([O-])C[C@H](NCc1cccc(C2CC2)c1)c1ccc(F)cc1F ZINC000421816040 1036803188 /nfs/dbraw/zinc/80/31/88/1036803188.db2.gz OPBLIIZFHHWEHN-SFHVURJKSA-N -1 1 331.362 4.148 20 0 EIADMM CCOc1cc(C(=O)N2CC[C@H](C3CCCC3)C2)cc(Cl)c1[O-] ZINC000421951008 1036867692 /nfs/dbraw/zinc/86/76/92/1036867692.db2.gz PBQDOJPNNDTYIP-ZDUSSCGKSA-N -1 1 337.847 4.097 20 0 EIADMM CCCCS[C@H](C)C(=O)Nc1cccc([O-])c1Br ZINC000908714536 1036925397 /nfs/dbraw/zinc/92/53/97/1036925397.db2.gz DMFQNQVQQXJKIP-SECBINFHSA-N -1 1 332.263 4.015 20 0 EIADMM FC(F)(F)COc1cccc([N-]c2nnc(-c3ccco3)o2)c1 ZINC001212164621 1037087101 /nfs/dbraw/zinc/08/71/01/1037087101.db2.gz ZMZOOQDWSLEHBY-UHFFFAOYSA-N -1 1 325.246 4.014 20 0 EIADMM Cn1cc(C(=O)Nc2ccc([O-])c(Cl)c2)c(C2CCCCC2)n1 ZINC000272709563 1037271978 /nfs/dbraw/zinc/27/19/78/1037271978.db2.gz DJWJVBLNRVOBNZ-UHFFFAOYSA-N -1 1 333.819 4.079 20 0 EIADMM Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)Nc2c([O-])cccc2F)c1 ZINC000605440525 1037791647 /nfs/dbraw/zinc/79/16/47/1037791647.db2.gz TYWSIDJZXWRCNS-ZDUSSCGKSA-N -1 1 331.387 4.369 20 0 EIADMM CCOc1c(Cl)cccc1CN[C@@H](CC(=O)[O-])c1cccs1 ZINC000669472804 1037937960 /nfs/dbraw/zinc/93/79/60/1037937960.db2.gz WVLAFZPWVJJEHH-ZDUSSCGKSA-N -1 1 339.844 4.106 20 0 EIADMM Cc1cccc(S(=O)(=O)[N-]c2ccc(Cl)c(OC(F)F)c2)c1 ZINC000504041513 1038108325 /nfs/dbraw/zinc/10/83/25/1038108325.db2.gz GBEDRXKHYKJBBP-UHFFFAOYSA-N -1 1 347.770 4.051 20 0 EIADMM [O-]c1c(F)cc(CN2CCC[C@@H]3CCC[C@H]32)cc1Br ZINC001232633086 1038176514 /nfs/dbraw/zinc/17/65/14/1038176514.db2.gz DPJVMSHSVIJJNT-SMDDNHRTSA-N -1 1 328.225 4.058 20 0 EIADMM CCC[C@H](CC)[N-]S(=O)(=O)c1c(Cl)cccc1C(F)(F)F ZINC000606905208 1038299798 /nfs/dbraw/zinc/29/97/98/1038299798.db2.gz UECZTLVAXRGMCW-VIFPVBQESA-N -1 1 343.798 4.216 20 0 EIADMM O=c1cc(C(F)(F)F)nc(SCCOC2CCCCCC2)[n-]1 ZINC000607058690 1038346772 /nfs/dbraw/zinc/34/67/72/1038346772.db2.gz HSKGAZQVGCJQLM-UHFFFAOYSA-N -1 1 336.379 4.033 20 0 EIADMM COc1cccc(Cl)c1CSc1nc(C(F)F)cc(=O)[n-]1 ZINC000554942312 1038781268 /nfs/dbraw/zinc/78/12/68/1038781268.db2.gz GBRJQIHELPUHAO-UHFFFAOYSA-N -1 1 332.759 4.074 20 0 EIADMM C[C@H]1CCc2[nH]c3ccc(C(=O)Nc4c([O-])cccc4F)cc3c2C1 ZINC000608365172 1038802858 /nfs/dbraw/zinc/80/28/58/1038802858.db2.gz AIFXXBWNBWJWNC-NSHDSACASA-N -1 1 338.382 4.390 20 0 EIADMM O=C([O-])CC[C@@H]1CCCCN1Cc1cc(F)cc(C(F)(F)F)c1 ZINC000322926970 1038852858 /nfs/dbraw/zinc/85/28/58/1038852858.db2.gz NJTCNOLJELFYSK-AWEZNQCLSA-N -1 1 333.325 4.064 20 0 EIADMM CCC(C)(C)c1ccc(S(=O)(=O)[N-]c2cccc3n[nH]cc32)cc1 ZINC000608755411 1038889438 /nfs/dbraw/zinc/88/94/38/1038889438.db2.gz UJMXAZUMAQXRGN-UHFFFAOYSA-N -1 1 343.452 4.051 20 0 EIADMM COC(=O)c1ccc(C(=O)[N-]c2ccccc2SC2CCCC2)o1 ZINC000156796708 1038979111 /nfs/dbraw/zinc/97/91/11/1038979111.db2.gz RSKSYRARFIIFOV-UHFFFAOYSA-N -1 1 345.420 4.353 20 0 EIADMM CSc1ccc(C)c([N-]S(=O)(=O)c2cc(C)sc2C)c1 ZINC000539399696 1039050630 /nfs/dbraw/zinc/05/06/30/1039050630.db2.gz YJVZPKLHKIFWOY-UHFFFAOYSA-N -1 1 327.496 4.196 20 0 EIADMM CSc1ccc(C)c([N-]S(=O)(=O)c2cc(F)cc(Cl)c2)c1 ZINC000539400876 1039054763 /nfs/dbraw/zinc/05/47/63/1039054763.db2.gz ZNZYPBQVLZNEIY-UHFFFAOYSA-N -1 1 345.848 4.310 20 0 EIADMM CCSc1cccc([N-]S(=O)(=O)c2cc(F)ccc2C)c1 ZINC000505287750 1039192031 /nfs/dbraw/zinc/19/20/31/1039192031.db2.gz OMWKHRUNEFGKQS-UHFFFAOYSA-N -1 1 325.430 4.047 20 0 EIADMM Cc1ccc(C(=O)CCCCC(=O)Nc2ccc([O-])c(F)c2F)cc1 ZINC000456783867 1039604657 /nfs/dbraw/zinc/60/46/57/1039604657.db2.gz LRSQESAMMKIFAG-UHFFFAOYSA-N -1 1 347.361 4.361 20 0 EIADMM O=C(Nc1ccc([O-])c(F)c1F)[C@@H](OC1CCCC1)c1ccccc1 ZINC000456795870 1039613636 /nfs/dbraw/zinc/61/36/36/1039613636.db2.gz VKMSJXDCWFZDID-SFHVURJKSA-N -1 1 347.361 4.309 20 0 EIADMM CC(=O)Nc1ccc(NC(=O)c2cc3ccccc3cc2[O-])cc1C ZINC000029818275 1039729841 /nfs/dbraw/zinc/72/98/41/1039729841.db2.gz OTXARHQHFCUTGW-UHFFFAOYSA-N -1 1 334.375 4.065 20 0 EIADMM O=C(CSc1ccccc1Cl)Nc1ccc([O-])c(Cl)c1 ZINC000601053658 1039885288 /nfs/dbraw/zinc/88/52/88/1039885288.db2.gz ZRDSZOOXVALRTB-UHFFFAOYSA-N -1 1 328.220 4.430 20 0 EIADMM O=S(=O)([N-]c1cc(F)ccc1Cl)c1cc(Cl)ccc1F ZINC000551115107 1039987414 /nfs/dbraw/zinc/98/74/14/1039987414.db2.gz YLPJBYLNSUBDOA-UHFFFAOYSA-N -1 1 338.162 4.072 20 0 EIADMM Cc1c2cc(C)ccc2[nH]c1C(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC000477126564 1040240307 /nfs/dbraw/zinc/24/03/07/1040240307.db2.gz OJYYFPPRDJFYKU-UHFFFAOYSA-N -1 1 346.390 4.133 20 0 EIADMM COc1cc(NC(=O)Nc2ccc([O-])c(Cl)c2)ccc1Cl ZINC000194396474 1040328728 /nfs/dbraw/zinc/32/87/28/1040328728.db2.gz ATSKTCWRSJOIMT-UHFFFAOYSA-N -1 1 327.167 4.352 20 0 EIADMM C[C@@H](NC(=O)c1ccc(Br)c([O-])c1)[C@@H](C)c1ccccc1 ZINC000491243131 1040329851 /nfs/dbraw/zinc/32/98/51/1040329851.db2.gz KQSDGQILAJWCCX-VXGBXAGGSA-N -1 1 348.240 4.077 20 0 EIADMM CCC(=O)c1cccc(S(=O)(=O)[N-]c2ccc3occ(C)c3c2)c1 ZINC000479563201 1040475600 /nfs/dbraw/zinc/47/56/00/1040475600.db2.gz BLSHIFIQDXDMEV-UHFFFAOYSA-N -1 1 343.404 4.135 20 0 EIADMM CC(=O)c1ccc(S(=O)(=O)[N-]c2ccc3oc(C)c(C)c3c2)cc1 ZINC000479564230 1040477941 /nfs/dbraw/zinc/47/79/41/1040477941.db2.gz FFOUUIXPBBIJSK-UHFFFAOYSA-N -1 1 343.404 4.053 20 0 EIADMM [O-]c1ccc(-c2noc(-c3coc(-c4ccccc4)n3)n2)c(Cl)c1 ZINC000445451056 1040775315 /nfs/dbraw/zinc/77/53/15/1040775315.db2.gz ZZJJCZQIJICTSU-UHFFFAOYSA-N -1 1 339.738 4.418 20 0 EIADMM CCc1cc(=O)[n-]c(S[C@@H](C)c2ccccc2Br)n1 ZINC000436192465 1040962077 /nfs/dbraw/zinc/96/20/77/1040962077.db2.gz CQBUVLHHJDYVQF-VIFPVBQESA-N -1 1 339.258 4.360 20 0 EIADMM CC(C)c1cccc(S(=O)(=O)[N-]c2cc(F)c(F)c(F)c2)c1 ZINC000460839476 1040982434 /nfs/dbraw/zinc/98/24/34/1040982434.db2.gz VXOPIEHRDRYYIS-UHFFFAOYSA-N -1 1 329.343 4.028 20 0 EIADMM Cc1sc(-c2ccco2)nc1-c1nc(-c2ccc([O-])cc2F)no1 ZINC000445464531 1041029088 /nfs/dbraw/zinc/02/90/88/1041029088.db2.gz UKEJGRDYZNZRQK-UHFFFAOYSA-N -1 1 343.339 4.273 20 0 EIADMM CC1(C)C[C@H](c2ccccc2)N(Cc2nc(=O)c3sccc3[n-]2)C1 ZINC000425546217 1041237928 /nfs/dbraw/zinc/23/79/28/1041237928.db2.gz SUJYUKXMYLTZDY-OAHLLOKOSA-N -1 1 339.464 4.370 20 0 EIADMM CC(C)c1ccc([C@H](CC(=O)[O-])NCc2ccncc2Cl)cc1 ZINC000904002161 1041249507 /nfs/dbraw/zinc/24/95/07/1041249507.db2.gz OUXCRSMKKQJMRK-KRWDZBQOSA-N -1 1 332.831 4.164 20 0 EIADMM CCN(Cc1ccc(OC)cc1)C(=O)c1ccc2ccccc2c1[O-] ZINC000436495162 1041282144 /nfs/dbraw/zinc/28/21/44/1041282144.db2.gz XBYWOFROCRSEQJ-UHFFFAOYSA-N -1 1 335.403 4.216 20 0 EIADMM COc1cc(-c2nc(Cc3ccccc3C)no2)cc(Cl)c1[O-] ZINC000436510407 1041296310 /nfs/dbraw/zinc/29/63/10/1041296310.db2.gz DEXALQYTKIVDOE-UHFFFAOYSA-N -1 1 330.771 4.003 20 0 EIADMM O=C(NCc1nc2ccccc2s1)c1ccc2ccccc2c1[O-] ZINC000436520910 1041301234 /nfs/dbraw/zinc/30/12/34/1041301234.db2.gz AZICDFWCZBQRJV-UHFFFAOYSA-N -1 1 334.400 4.085 20 0 EIADMM CCOCc1ccc(NC(=O)c2cc(Cl)c([O-])c(OCC)c2)cc1 ZINC000436523459 1041309092 /nfs/dbraw/zinc/30/90/92/1041309092.db2.gz SSFHIUJSFMIHCX-UHFFFAOYSA-N -1 1 349.814 4.233 20 0 EIADMM Cc1ccccc1[C@@H]1C[C@H](C)N(C(=O)c2cc(Cl)ccc2[O-])C1 ZINC000436528923 1041313093 /nfs/dbraw/zinc/31/30/93/1041313093.db2.gz MYDXWDVEWPKZAJ-UONOGXRCSA-N -1 1 329.827 4.372 20 0 EIADMM COCCN(C(=O)c1ccc2ccccc2c1[O-])[C@H](C)c1ccccc1 ZINC000436530363 1041314552 /nfs/dbraw/zinc/31/45/52/1041314552.db2.gz DQUWHMSXWWSRIR-MRXNPFEDSA-N -1 1 349.430 4.395 20 0 EIADMM COCCN(C(=O)c1ccc2ccccc2c1[O-])[C@@H](C)c1ccccc1 ZINC000436530359 1041316053 /nfs/dbraw/zinc/31/60/53/1041316053.db2.gz DQUWHMSXWWSRIR-INIZCTEOSA-N -1 1 349.430 4.395 20 0 EIADMM CN(C(=O)c1ccc2ccccc2c1[O-])[C@H]1CCc2ccccc2C1 ZINC000436546781 1041323879 /nfs/dbraw/zinc/32/38/79/1041323879.db2.gz LKFVZVBLCJSZQF-SFHVURJKSA-N -1 1 331.415 4.175 20 0 EIADMM C[C@@]1(c2ccccc2)CCN(C(=O)c2cc3ccccc3cc2[O-])C1 ZINC000436587759 1041362348 /nfs/dbraw/zinc/36/23/48/1041362348.db2.gz ZRKZJSAHLLMZGS-JOCHJYFZSA-N -1 1 331.415 4.349 20 0 EIADMM [O-]c1ccc(F)cc1-c1nc(-c2ccc(F)cc2C(F)(F)F)no1 ZINC000436680578 1041419675 /nfs/dbraw/zinc/41/96/75/1041419675.db2.gz KPSLAVQOUIHGBR-UHFFFAOYSA-N -1 1 342.223 4.406 20 0 EIADMM COc1cc(-c2nc(-c3cccc(C)c3F)no2)cc(Cl)c1[O-] ZINC000436691242 1041424639 /nfs/dbraw/zinc/42/46/39/1041424639.db2.gz XNLRUEWFDIEYAX-UHFFFAOYSA-N -1 1 334.734 4.219 20 0 EIADMM O=C(c1cc(F)ccc1[O-])N1C[C@H](c2ccccc2)[C@H]2CCCC[C@@H]21 ZINC000436704235 1041435946 /nfs/dbraw/zinc/43/59/46/1041435946.db2.gz GMMGQJITKYKACC-QRQLOZEOSA-N -1 1 339.410 4.330 20 0 EIADMM O=C(NCc1csc(-c2ccccc2)n1)c1ccc(Cl)cc1[O-] ZINC000436717202 1041440971 /nfs/dbraw/zinc/44/09/71/1041440971.db2.gz SLEQREOIBSVGPC-UHFFFAOYSA-N -1 1 344.823 4.099 20 0 EIADMM CC(C)c1ccc(C(=O)Nc2cccc(NC(=O)C3CC3)c2)c([O-])c1 ZINC000436736229 1041446032 /nfs/dbraw/zinc/44/60/32/1041446032.db2.gz FWDSIBXCSNFMIM-UHFFFAOYSA-N -1 1 338.407 4.116 20 0 EIADMM COc1ccc(C(=O)Nc2ccc(-c3ccco3)cc2F)c([O-])c1 ZINC000436727703 1041452659 /nfs/dbraw/zinc/45/26/59/1041452659.db2.gz BQDXAHZEVBLPCS-UHFFFAOYSA-N -1 1 327.311 4.052 20 0 EIADMM CN(CC[C@@H](C(=O)[O-])c1ccccc1)Cc1c(F)cccc1Cl ZINC000516187932 1041454147 /nfs/dbraw/zinc/45/41/47/1041454147.db2.gz NQOMZMOVVHRLJN-CQSZACIVSA-N -1 1 335.806 4.169 20 0 EIADMM O=C(NCCc1nc2ccccc2s1)c1cc2ccccc2cc1[O-] ZINC000436764050 1041460340 /nfs/dbraw/zinc/46/03/40/1041460340.db2.gz JNIACRANYFLWKY-UHFFFAOYSA-N -1 1 348.427 4.128 20 0 EIADMM CCC[C@H](NC(=O)c1cc(Cl)c([O-])c(OC)c1)c1ccccc1 ZINC000436747782 1041461317 /nfs/dbraw/zinc/46/13/17/1041461317.db2.gz CLGMKZFQGRNHEN-HNNXBMFYSA-N -1 1 333.815 4.325 20 0 EIADMM C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)c1ccc(Cl)cc1[O-] ZINC000436751215 1041463428 /nfs/dbraw/zinc/46/34/28/1041463428.db2.gz QRRRBBGRVQTYDD-UKRRQHHQSA-N -1 1 329.827 4.454 20 0 EIADMM O=C(c1ccc(C(F)(F)F)cc1[O-])N1CCC[C@H]1c1cccs1 ZINC000436763758 1041463517 /nfs/dbraw/zinc/46/35/17/1041463517.db2.gz HQSIIWUUCSMTDB-LBPRGKRZSA-N -1 1 341.354 4.450 20 0 EIADMM CN(Cc1cc2ccccc2o1)C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436750242 1041463719 /nfs/dbraw/zinc/46/37/19/1041463719.db2.gz FKUBUAXVZAFWHB-UHFFFAOYSA-N -1 1 349.308 4.429 20 0 EIADMM O=C(c1ccc(Br)cc1[O-])N1CCC[C@@H]1c1ccccc1 ZINC000436754002 1041465455 /nfs/dbraw/zinc/46/54/55/1041465455.db2.gz GSGQLADZNLBZCA-OAHLLOKOSA-N -1 1 346.224 4.132 20 0 EIADMM O=C([O-])C/C(=C\c1cc(F)c(O)c(F)c1)c1nc2ccccc2s1 ZINC000436774690 1041470132 /nfs/dbraw/zinc/47/01/32/1041470132.db2.gz BUGRKXDFFSHXHE-BJMVGYQFSA-N -1 1 347.342 4.295 20 0 EIADMM CN(Cc1cccc(Cl)c1)C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436763531 1041473764 /nfs/dbraw/zinc/47/37/64/1041473764.db2.gz KXBOZJJVAJUCOA-UHFFFAOYSA-N -1 1 343.732 4.337 20 0 EIADMM CCN(Cc1c[nH]c2ccccc12)C(=O)c1cc(Cl)ccc1[O-] ZINC000436788772 1041481968 /nfs/dbraw/zinc/48/19/68/1041481968.db2.gz BYZPBXPEYNVSDS-UHFFFAOYSA-N -1 1 328.799 4.189 20 0 EIADMM O=C(Nc1ccccc1Oc1cccc(F)c1)c1ccc(O)cc1[O-] ZINC000436806346 1041491940 /nfs/dbraw/zinc/49/19/40/1041491940.db2.gz HHXKXJCCFNYWCK-UHFFFAOYSA-N -1 1 339.322 4.282 20 0 EIADMM Cc1ccc([C@H]2CCN(C(=O)c3ccc(Cl)cc3[O-])C2)c(C)c1 ZINC000436848539 1041516659 /nfs/dbraw/zinc/51/66/59/1041516659.db2.gz AKULUSAKGWTIJC-AWEZNQCLSA-N -1 1 329.827 4.292 20 0 EIADMM CC(C)(C)OC1CC(Cc2nc(-c3ccc([O-])cc3Cl)no2)C1 ZINC000436873264 1041529778 /nfs/dbraw/zinc/52/97/78/1041529778.db2.gz PARPVPGUIFCRLD-UHFFFAOYSA-N -1 1 336.819 4.232 20 0 EIADMM O=C(N[C@H](c1ccc(F)cc1)C1CCCC1)c1ccc([O-])cc1F ZINC000436879106 1041537363 /nfs/dbraw/zinc/53/73/63/1041537363.db2.gz IWKICKYBASEGTP-SFHVURJKSA-N -1 1 331.362 4.332 20 0 EIADMM [O-]c1ccc(-c2noc([C@H]3C[C@H]3c3ccc(F)cc3F)n2)cc1F ZINC000436877483 1041537645 /nfs/dbraw/zinc/53/76/45/1041537645.db2.gz GOYHEGCDKAHCMC-RYUDHWBXSA-N -1 1 332.281 4.131 20 0 EIADMM Cc1ccc([C@@H](NC(=O)c2ccc([O-])cc2F)c2ccccc2)cc1 ZINC000436880601 1041538928 /nfs/dbraw/zinc/53/89/28/1041538928.db2.gz OPZRLBAZYLHWIY-FQEVSTJZSA-N -1 1 335.378 4.359 20 0 EIADMM CC(C)(Oc1ccc(F)cc1)c1nc(-c2ccc([O-])cc2F)no1 ZINC000436881983 1041539041 /nfs/dbraw/zinc/53/90/41/1041539041.db2.gz ZLFUQNJXWMIXRG-UHFFFAOYSA-N -1 1 332.306 4.035 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1CC[C@H](COc2ccccc2)C1 ZINC000436915111 1041556287 /nfs/dbraw/zinc/55/62/87/1041556287.db2.gz OXINRAUTLRPGTG-INIZCTEOSA-N -1 1 347.414 4.087 20 0 EIADMM CC[C@@H](C)[C@@H](C)N(C(=O)c1cc(Br)ccc1[O-])C1CC1 ZINC000436927256 1041561644 /nfs/dbraw/zinc/56/16/44/1041561644.db2.gz QPJALSXHRUSBSS-GHMZBOCLSA-N -1 1 340.261 4.194 20 0 EIADMM CC(C)c1ccc(C(=O)Nc2nc(-c3ccccn3)cs2)c([O-])c1 ZINC000436946651 1041570498 /nfs/dbraw/zinc/57/04/98/1041570498.db2.gz DPLVHMHHUXHSRX-UHFFFAOYSA-N -1 1 339.420 4.286 20 0 EIADMM COc1cccc2c1CCCN2C(=O)c1ccc(C(C)C)cc1[O-] ZINC000436991682 1041583062 /nfs/dbraw/zinc/58/30/62/1041583062.db2.gz SGMOZXAROOLTEJ-UHFFFAOYSA-N -1 1 325.408 4.117 20 0 EIADMM CSc1ccc(S(=O)(=O)[N-]c2ccccc2C)cc1Cl ZINC000463514499 1041610508 /nfs/dbraw/zinc/61/05/08/1041610508.db2.gz RALDZJRYUFHQBO-UHFFFAOYSA-N -1 1 327.858 4.171 20 0 EIADMM O=C(Nc1ccc(Cl)cc1[O-])c1ncsc1-c1ccccc1 ZINC000438147253 1042067444 /nfs/dbraw/zinc/06/74/44/1042067444.db2.gz CSJXOTIAMSBYBI-UHFFFAOYSA-N -1 1 330.796 4.421 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1ccc(Oc2ccccc2)nc1 ZINC000541887494 1042165509 /nfs/dbraw/zinc/16/55/09/1042165509.db2.gz VTBDJZCZCUFPIO-UHFFFAOYSA-N -1 1 340.766 4.485 20 0 EIADMM O=C(Nc1nc(-c2cccs2)cs1)c1c(F)ccc([O-])c1F ZINC000438787790 1042348685 /nfs/dbraw/zinc/34/86/85/1042348685.db2.gz WKKHWDQTLOMXRB-UHFFFAOYSA-N -1 1 338.360 4.108 20 0 EIADMM Cc1c(Cl)cccc1S(=O)(=O)[N-]c1cccc(C(F)F)c1 ZINC000509612588 1042689873 /nfs/dbraw/zinc/68/98/73/1042689873.db2.gz ZBDPHKMSIGJCNX-UHFFFAOYSA-N -1 1 331.771 4.387 20 0 EIADMM Cc1ccc(Cl)cc1S(=O)(=O)[N-]c1cccc(C(F)F)c1 ZINC000509596919 1042690970 /nfs/dbraw/zinc/69/09/70/1042690970.db2.gz VZIQBDOIQIPIAW-UHFFFAOYSA-N -1 1 331.771 4.387 20 0 EIADMM CCN(CC1CCC1)C(=O)c1ccc(NC(=O)OC(C)(C)C)cc1[O-] ZINC000492667996 1042717070 /nfs/dbraw/zinc/71/70/70/1042717070.db2.gz DRFXGAQCCQVVJG-UHFFFAOYSA-N -1 1 348.443 4.001 20 0 EIADMM O=S(=O)([N-]c1ccc(OC2CCCCC2)cc1)c1ccsc1 ZINC000506652499 1042735679 /nfs/dbraw/zinc/73/56/79/1042735679.db2.gz GFSLEYSPQIZRNT-UHFFFAOYSA-N -1 1 337.466 4.260 20 0 EIADMM CCOc1cc(C(=O)Nc2ncsc2C2CC2)cc(Cl)c1[O-] ZINC000914112963 1042808414 /nfs/dbraw/zinc/80/84/14/1042808414.db2.gz YVLYSOSJDMDEER-UHFFFAOYSA-N -1 1 338.816 4.031 20 0 EIADMM CCOc1cc(C(=O)N2CCC(C)(C3CC3)CC2)cc(Cl)c1[O-] ZINC000427593174 1042882130 /nfs/dbraw/zinc/88/21/30/1042882130.db2.gz SRISBWPEZYVKOR-UHFFFAOYSA-N -1 1 337.847 4.097 20 0 EIADMM CC(C)(C)c1cc(NC(=O)c2ccc([O-])cc2F)n(C(C)(C)C)n1 ZINC000181942852 1042883015 /nfs/dbraw/zinc/88/30/15/1042883015.db2.gz FIIRSVWAIWJFKN-UHFFFAOYSA-N -1 1 333.407 4.033 20 0 EIADMM O=C([N-]c1nc(-c2ccccc2)ns1)c1ncoc1-c1ccccc1 ZINC000112006091 1043053007 /nfs/dbraw/zinc/05/30/07/1043053007.db2.gz NYFHOAHABZKWMQ-UHFFFAOYSA-N -1 1 348.387 4.112 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@@H]1C[C@H]1c1cc(F)c(F)c(F)c1 ZINC000184001994 1043071213 /nfs/dbraw/zinc/07/12/13/1043071213.db2.gz LTVKRLCOQGTFQA-VHSXEESVSA-N -1 1 341.716 4.205 20 0 EIADMM Cc1cccc(S(=O)(=O)[N-]c2cccc(SC(F)F)c2)c1 ZINC000727362987 1043210186 /nfs/dbraw/zinc/21/01/86/1043210186.db2.gz JUYFGEPHUZQQMI-UHFFFAOYSA-N -1 1 329.393 4.111 20 0 EIADMM CC[C@H](Oc1ccccc1Cl)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000509181514 1043224147 /nfs/dbraw/zinc/22/41/47/1043224147.db2.gz GTXXSXWSKJFRKK-AWEZNQCLSA-N -1 1 340.206 4.495 20 0 EIADMM O=C(NCC1(c2ccc(Cl)cc2)CC1)c1c([O-])cccc1Cl ZINC000727489569 1043230842 /nfs/dbraw/zinc/23/08/42/1043230842.db2.gz ZVJBTGBMDJIJQG-UHFFFAOYSA-N -1 1 336.218 4.161 20 0 EIADMM [O-]c1c(Br)c(F)ccc1Nc1cc(F)cc(F)c1O ZINC001212489607 1043583051 /nfs/dbraw/zinc/58/30/51/1043583051.db2.gz URHQPZZVKMMRKZ-UHFFFAOYSA-N -1 1 334.091 4.021 20 0 EIADMM O=C(Nc1cccc(-c2ncco2)c1)Nc1ccc([O-])c(Cl)c1 ZINC000190981097 1043759922 /nfs/dbraw/zinc/75/99/22/1043759922.db2.gz XHLRHGIPCWEMJT-UHFFFAOYSA-N -1 1 329.743 4.345 20 0 EIADMM C[C@@H]1CO[C@@H](c2ccccc2)[C@@H](C)N1C(=O)c1ccc(Cl)cc1[O-] ZINC000732019432 1043870077 /nfs/dbraw/zinc/87/00/77/1043870077.db2.gz IMWLWCUTGKPJAJ-SNUQEOBHSA-N -1 1 345.826 4.036 20 0 EIADMM CC(C)(C)c1nnc([N-]C(=O)c2nc(-c3ccccc3)cs2)s1 ZINC000079241922 1043874572 /nfs/dbraw/zinc/87/45/72/1043874572.db2.gz SQHHFLTXFAIOQB-UHFFFAOYSA-N -1 1 344.465 4.211 20 0 EIADMM COc1cc(C(=O)N[C@@]2(C)CCCc3ccccc32)cc(Cl)c1[O-] ZINC000442954018 1043903127 /nfs/dbraw/zinc/90/31/27/1043903127.db2.gz CODTUBFLVNPRIH-IBGZPJMESA-N -1 1 345.826 4.036 20 0 EIADMM CC[C@@H](C)[C@@H]1CCCCN1C(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC000442961390 1043921399 /nfs/dbraw/zinc/92/13/99/1043921399.db2.gz FETPIZPUACJIPB-RISCZKNCSA-N -1 1 325.836 4.095 20 0 EIADMM CC[C@H](C)[C@H]1CCCCN1C(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC000442961392 1043921912 /nfs/dbraw/zinc/92/19/12/1043921912.db2.gz FETPIZPUACJIPB-SMDDNHRTSA-N -1 1 325.836 4.095 20 0 EIADMM COc1cc(C(=O)N2C[C@H](c3ccccc3)C[C@H]2C)cc(Cl)c1[O-] ZINC000442981946 1043948720 /nfs/dbraw/zinc/94/87/20/1043948720.db2.gz WKQAKNHWOQWYKT-IUODEOHRSA-N -1 1 345.826 4.072 20 0 EIADMM O=C(Nc1ccc(OC(F)(F)F)cc1)Nc1cc(F)cc(F)c1[O-] ZINC000168808952 1043968497 /nfs/dbraw/zinc/96/84/97/1043968497.db2.gz UQPGHTKRMLNTDW-UHFFFAOYSA-N -1 1 348.227 4.213 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N1CCC[C@@H]1c1ccc(F)c(F)c1 ZINC000733002686 1044058197 /nfs/dbraw/zinc/05/81/97/1044058197.db2.gz HMANBVXZKRTUCZ-OAHLLOKOSA-N -1 1 337.753 4.301 20 0 EIADMM Cc1cccc(C2(NC(=O)Cc3ccc([O-])c(Cl)c3)CCCC2)c1 ZINC001143616781 1044225388 /nfs/dbraw/zinc/22/53/88/1044225388.db2.gz ZPZIIWXRTPNQBL-UHFFFAOYSA-N -1 1 343.854 4.482 20 0 EIADMM [O-]c1ccc(F)cc1-c1nc(Cc2ccc(Cl)c(Cl)c2)no1 ZINC000388909723 1044232178 /nfs/dbraw/zinc/23/21/78/1044232178.db2.gz UFLKCFNZTBOYDO-UHFFFAOYSA-N -1 1 339.153 4.479 20 0 EIADMM CCOc1cc(C(=O)N[C@H]2CCC[C@H](C)CC2)cc(Cl)c1[O-] ZINC000443385434 1044250899 /nfs/dbraw/zinc/25/08/99/1044250899.db2.gz PGUYFIOTQONGPH-AAEUAGOBSA-N -1 1 325.836 4.143 20 0 EIADMM Cc1ccc([C@@H]2CCN(C(=O)c3ccc(C(F)(F)F)cc3[O-])C2)cc1 ZINC000543365016 1044424034 /nfs/dbraw/zinc/42/40/34/1044424034.db2.gz ATWJKXMWWMZIJM-CQSZACIVSA-N -1 1 349.352 4.349 20 0 EIADMM Cc1ccc(-c2ncc(CN(CC(=O)[O-])CC(C)(C)C)s2)cc1 ZINC000665350384 1044488207 /nfs/dbraw/zinc/48/82/07/1044488207.db2.gz PPJARYVXWPUGFP-UHFFFAOYSA-N -1 1 332.469 4.051 20 0 EIADMM C[C@@H](NC(=O)c1ccc(Cl)cc1[O-])c1nc2ccccc2s1 ZINC000734112815 1044489619 /nfs/dbraw/zinc/48/96/19/1044489619.db2.gz BGUXQMCZVATRDY-SECBINFHSA-N -1 1 332.812 4.146 20 0 EIADMM O=S(=O)([N-]c1ccc(F)c(Cl)c1)c1ccc(F)c(Cl)c1 ZINC000001465411 1044824719 /nfs/dbraw/zinc/82/47/19/1044824719.db2.gz XFSUOLNQBOEGDZ-UHFFFAOYSA-N -1 1 338.162 4.072 20 0 EIADMM CCCc1cc(=O)[n-]c(SC[C@@H](O)c2ccc3ccccc3c2)n1 ZINC000915057804 1045015143 /nfs/dbraw/zinc/01/51/43/1045015143.db2.gz OSCUSOGTQDBXSL-QGZVFWFLSA-N -1 1 340.448 4.114 20 0 EIADMM CCOc1cc(C(=O)Nc2ccc(N(C)C)c(C)c2)cc(Cl)c1[O-] ZINC000186594322 1045025365 /nfs/dbraw/zinc/02/53/65/1045025365.db2.gz ILSZCGTUXHXWDT-UHFFFAOYSA-N -1 1 348.830 4.071 20 0 EIADMM O=S(=O)([N-]c1cccc(C(F)F)c1)c1ccc(F)c(Cl)c1 ZINC000625089719 1045077685 /nfs/dbraw/zinc/07/76/85/1045077685.db2.gz CQMIIUKWHSYOEO-UHFFFAOYSA-N -1 1 335.734 4.218 20 0 EIADMM CSc1cccc(S(=O)(=O)[N-]c2ccc(C(F)(F)F)cc2)c1 ZINC000509098306 1045119296 /nfs/dbraw/zinc/11/92/96/1045119296.db2.gz KQMPTFQIMKPGJV-UHFFFAOYSA-N -1 1 347.383 4.228 20 0 EIADMM CSc1cccc(S(=O)(=O)[N-]c2cc(Cl)ccc2C)c1 ZINC000509103332 1045132280 /nfs/dbraw/zinc/13/22/80/1045132280.db2.gz ODNYFTUUJGYAKI-UHFFFAOYSA-N -1 1 327.858 4.171 20 0 EIADMM CC(C)(C)OC(=O)Nc1ccc(F)c(NC(=O)c2ccccc2[O-])c1 ZINC000915152175 1045145345 /nfs/dbraw/zinc/14/53/45/1045145345.db2.gz NLRPILRLNCVPTD-UHFFFAOYSA-N -1 1 346.358 4.131 20 0 EIADMM O=S(=O)(/C=C/c1ccccc1Cl)[N-]c1cc(Cl)ccc1O ZINC000740811321 1045228470 /nfs/dbraw/zinc/22/84/70/1045228470.db2.gz BADCOZVLGIKNBZ-BQYQJAHWSA-N -1 1 344.219 4.112 20 0 EIADMM CC(C)(C)OC(=O)Nc1ccccc1NC(=O)c1ccc([O-])c(F)c1 ZINC000767940572 1045683855 /nfs/dbraw/zinc/68/38/55/1045683855.db2.gz NYODCYOAWHGXQO-UHFFFAOYSA-N -1 1 346.358 4.131 20 0 EIADMM O=C(CSc1nc(-c2ccccc2)cs1)c1ccc([O-])c(O)c1 ZINC000026040100 1045743399 /nfs/dbraw/zinc/74/33/99/1045743399.db2.gz KJBSRDWZNMKBIL-UHFFFAOYSA-N -1 1 343.429 4.196 20 0 EIADMM CC1(C)[C@@H](C(F)(F)F)CCN1C(=O)c1ccc2ccccc2c1[O-] ZINC000326418196 1045805302 /nfs/dbraw/zinc/80/53/02/1045805302.db2.gz QJMAFPCHBDVERQ-AWEZNQCLSA-N -1 1 337.341 4.348 20 0 EIADMM CSc1ccc([O-])c(C(=O)Nc2cnn(CC(C)C)c2C2CC2)c1 ZINC000614878268 1045899520 /nfs/dbraw/zinc/89/95/20/1045899520.db2.gz MOIDFTRLONNFHE-UHFFFAOYSA-N -1 1 345.468 4.096 20 0 EIADMM C[C@@H](c1nc2ccccc2s1)N(C)C(=O)c1c([O-])cccc1Cl ZINC000769617894 1046035471 /nfs/dbraw/zinc/03/54/71/1046035471.db2.gz RKMVVQIMRCBAJQ-JTQLQIEISA-N -1 1 346.839 4.489 20 0 EIADMM CC(C)[C@@H](NC(=O)c1c([O-])cccc1Cl)c1nc2ccccc2[nH]1 ZINC000769664332 1046041527 /nfs/dbraw/zinc/04/15/27/1046041527.db2.gz OFAJXTWOEDCMRR-MRXNPFEDSA-N -1 1 343.814 4.049 20 0 EIADMM CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1cc(F)ccc1[O-] ZINC000769672652 1046042989 /nfs/dbraw/zinc/04/29/89/1046042989.db2.gz XFRSLBJCBJTXTC-UHFFFAOYSA-N -1 1 341.304 4.212 20 0 EIADMM O=C(c1c([O-])cccc1Cl)N1CCCCC[C@@H]1c1ccncc1 ZINC000769693060 1046045921 /nfs/dbraw/zinc/04/59/21/1046045921.db2.gz ZXDFOVHKLIFCJZ-OAHLLOKOSA-N -1 1 330.815 4.198 20 0 EIADMM O=C(c1c([O-])cccc1Cl)N1CCCCC[C@H]1c1ccncc1 ZINC000769693058 1046045992 /nfs/dbraw/zinc/04/59/92/1046045992.db2.gz ZXDFOVHKLIFCJZ-HNNXBMFYSA-N -1 1 330.815 4.198 20 0 EIADMM C[C@H]1C[N@@H+](Cc2nc(=O)c3sccc3[n-]2)CC[C@H]1c1ccccc1 ZINC000253544669 1046058113 /nfs/dbraw/zinc/05/81/13/1046058113.db2.gz SUDCNRPJQAVMRN-DZGCQCFKSA-N -1 1 339.464 4.023 20 0 EIADMM C[C@H]1CN(Cc2nc(=O)c3sccc3[n-]2)CC[C@H]1c1ccccc1 ZINC000253544669 1046058133 /nfs/dbraw/zinc/05/81/33/1046058133.db2.gz SUDCNRPJQAVMRN-DZGCQCFKSA-N -1 1 339.464 4.023 20 0 EIADMM O=S(=O)([N-]c1ccc(-c2cc[nH]n2)cc1)c1cccc2ccccc21 ZINC000328377329 1046122438 /nfs/dbraw/zinc/12/24/38/1046122438.db2.gz WQKQEMZSMJBWNY-UHFFFAOYSA-N -1 1 349.415 4.031 20 0 EIADMM CCc1cc(=O)[n-]c(SCc2nc(-c3ccccc3)oc2C)n1 ZINC000428693282 1046557060 /nfs/dbraw/zinc/55/70/60/1046557060.db2.gz LONXPTHXTZHUKU-UHFFFAOYSA-N -1 1 327.409 4.000 20 0 EIADMM COc1ccc(C(=O)N(C)c2ccc(-c3ccccc3)cc2)c([O-])c1 ZINC000536723703 1046735119 /nfs/dbraw/zinc/73/51/19/1046735119.db2.gz YJGWJLHVDLCEAC-UHFFFAOYSA-N -1 1 333.387 4.344 20 0 EIADMM CCc1cc(=O)[nH]c(C[NH2+][C@H](c2oc3ccccc3c2C)C(C)C)n1 ZINC000537059220 1046910195 /nfs/dbraw/zinc/91/01/95/1046910195.db2.gz UUNKXYRMPJZJST-IBGZPJMESA-N -1 1 339.439 4.286 20 0 EIADMM CC[C@H](Cc1nc(-c2ccc([O-])c(F)c2)no1)c1ccc(OC)cc1 ZINC000445477387 1047024301 /nfs/dbraw/zinc/02/43/01/1047024301.db2.gz NUQDOKNAIRSEMT-GFCCVEGCSA-N -1 1 342.370 4.326 20 0 EIADMM Cc1ccc(C2=CCN(C(=O)c3ccc(Cl)cc3[O-])CC2)cc1 ZINC000788317249 1047167854 /nfs/dbraw/zinc/16/78/54/1047167854.db2.gz ZAQCYRDAESPJHO-UHFFFAOYSA-N -1 1 327.811 4.284 20 0 EIADMM CC(=O)c1cc(F)c([N-]C(=O)c2cc3cc(F)ccc3o2)c(F)c1 ZINC000537438468 1047211989 /nfs/dbraw/zinc/21/19/89/1047211989.db2.gz CVPFURRXGQOQCW-UHFFFAOYSA-N -1 1 333.265 4.305 20 0 EIADMM CCn1cc(CC(=O)Nc2ccc([O-])c(Cl)c2)c2ccccc21 ZINC000129616463 1047447693 /nfs/dbraw/zinc/44/76/93/1047447693.db2.gz SDYUIZPERUWNEA-UHFFFAOYSA-N -1 1 328.799 4.201 20 0 EIADMM CC(C)(CNC(=O)c1cccc([O-])c1F)c1ccc2ccccc2c1 ZINC001170113317 1047449732 /nfs/dbraw/zinc/44/97/32/1047449732.db2.gz YDPRULNGMWYXAW-UHFFFAOYSA-N -1 1 337.394 4.392 20 0 EIADMM CSc1ccc([N-]S(=O)(=O)c2ccc(F)cc2)cc1Cl ZINC000476415047 1047801776 /nfs/dbraw/zinc/80/17/76/1047801776.db2.gz YMOUYQLDOZJBOJ-UHFFFAOYSA-N -1 1 331.821 4.002 20 0 EIADMM C[C@H]1CN(C(=O)c2ccc3ccccc3c2[O-])C[C@H](c2ccccc2)O1 ZINC000130976629 1047818408 /nfs/dbraw/zinc/81/84/08/1047818408.db2.gz VEDQKFOEGWSSPX-MGPUTAFESA-N -1 1 347.414 4.148 20 0 EIADMM O=C(C[C@@H]1C=CCC1)Nc1c([O-])cc(Br)cc1Cl ZINC000556847461 1048062320 /nfs/dbraw/zinc/06/23/20/1048062320.db2.gz WMXRNFOZLUYENK-MRVPVSSYSA-N -1 1 330.609 4.103 20 0 EIADMM O=C([N-]c1c(F)ccc(Br)c1F)c1c(F)cccc1F ZINC001134628690 1048157967 /nfs/dbraw/zinc/15/79/67/1048157967.db2.gz URVOSURCMGYWRB-UHFFFAOYSA-N -1 1 348.093 4.258 20 0 EIADMM O=C(Nc1cc(F)ccc1Oc1ccccc1)c1ccc(O)cc1[O-] ZINC001143709190 1048167844 /nfs/dbraw/zinc/16/78/44/1048167844.db2.gz FJEHYDBSRHDGKW-UHFFFAOYSA-N -1 1 339.322 4.282 20 0 EIADMM Cc1nc(C(C)C)[n-]c(=O)c1C(=O)N[C@H](C1CCC1)C1CCCCC1 ZINC000844054141 1048184539 /nfs/dbraw/zinc/18/45/39/1048184539.db2.gz YAQBPOPZEDAGMS-KRWDZBQOSA-N -1 1 345.487 4.093 20 0 EIADMM Cc1ccc(Cl)cc1S(=O)(=O)[N-]c1cccc(-c2ncco2)c1 ZINC000132752088 1048483399 /nfs/dbraw/zinc/48/33/99/1048483399.db2.gz QISIJKNQNGUVEP-UHFFFAOYSA-N -1 1 348.811 4.104 20 0 EIADMM [O-]c1cc(F)c(CN2CCC(Sc3ccccc3)CC2)c(F)c1 ZINC001144561298 1048727347 /nfs/dbraw/zinc/72/73/47/1048727347.db2.gz FSMKIEXMAKGHAL-UHFFFAOYSA-N -1 1 335.419 4.427 20 0 EIADMM Cc1ccccc1OC1CCN(Cc2cc(F)c([O-])cc2F)CC1 ZINC001144647123 1048771029 /nfs/dbraw/zinc/77/10/29/1048771029.db2.gz ZJVJBFIXILZHMT-UHFFFAOYSA-N -1 1 333.378 4.022 20 0 EIADMM COc1cccc([C@@H]2CCC[N@@H+](Cc3cc(F)c([O-])cc3F)C2)c1 ZINC001144663560 1048781880 /nfs/dbraw/zinc/78/18/80/1048781880.db2.gz GKJBQHLXEMIVDN-CQSZACIVSA-N -1 1 333.378 4.059 20 0 EIADMM [O-]c1cc(F)c(CN2CCc3c(cccc3C(F)(F)F)C2)cc1F ZINC001144659607 1048793687 /nfs/dbraw/zinc/79/36/87/1048793687.db2.gz NAIOJMANQOKKMQ-UHFFFAOYSA-N -1 1 343.295 4.248 20 0 EIADMM CC[C@@H](C)CO[N-]C(=O)[C@@H](C)c1cccc(C(=O)c2ccccc2)c1 ZINC000816980023 1048884046 /nfs/dbraw/zinc/88/40/46/1048884046.db2.gz CYFRCWYOHKUMLG-CVEARBPZSA-N -1 1 339.435 4.115 20 0 EIADMM CC[C@@H](C)CO[N-]C(=O)[C@H](C)c1cccc(C(=O)c2ccccc2)c1 ZINC000816980025 1048885527 /nfs/dbraw/zinc/88/55/27/1048885527.db2.gz CYFRCWYOHKUMLG-HZPDHXFCSA-N -1 1 339.435 4.115 20 0 EIADMM O=C(Nc1cccc(-c2nc3ccccc3[nH]2)c1)c1ccc(F)c([O-])c1 ZINC001135844046 1048916891 /nfs/dbraw/zinc/91/68/91/1048916891.db2.gz KJUXMRWNOPMINV-UHFFFAOYSA-N -1 1 347.349 4.327 20 0 EIADMM Cc1c([N-]C(=O)c2oc(C3CC3)nc2C(F)F)noc1C(C)(C)C ZINC001132677900 1048975299 /nfs/dbraw/zinc/97/52/99/1048975299.db2.gz PQUXPTDWWHLNRY-UHFFFAOYSA-N -1 1 339.342 4.336 20 0 EIADMM CC(F)(F)c1ccc(CNC(=O)c2c([O-])cccc2Cl)cc1 ZINC000817462493 1048982113 /nfs/dbraw/zinc/98/21/13/1048982113.db2.gz MTWYACGQRRVEFY-UHFFFAOYSA-N -1 1 325.742 4.087 20 0 EIADMM Cc1cc(C=O)c([O-])c(C(=O)N[C@H](CC(C)C)c2ccccc2C)c1 ZINC001146488310 1049029427 /nfs/dbraw/zinc/02/94/27/1049029427.db2.gz JFEBQAKQZBICAX-LJQANCHMSA-N -1 1 339.435 4.339 20 0 EIADMM CCO[N-]C(=O)Cc1sc(-c2cccs2)nc1-c1ccccc1 ZINC001136002983 1049039580 /nfs/dbraw/zinc/03/95/80/1049039580.db2.gz MKJBYSCCUOMMFE-UHFFFAOYSA-N -1 1 344.461 4.149 20 0 EIADMM O=C(N[C@@H]1CC[C@@H]2CCCC[C@@H]2C1)c1ccc(C(F)(F)F)c([O-])c1 ZINC001136019206 1049040751 /nfs/dbraw/zinc/04/07/51/1049040751.db2.gz MNHISFTYHAMCPG-OUCADQQQSA-N -1 1 341.373 4.500 20 0 EIADMM CSc1ccc([O-])c(C(=O)Nc2ccccc2CC(F)(F)F)c1 ZINC001147111716 1049090897 /nfs/dbraw/zinc/09/08/97/1049090897.db2.gz HZMXZPHDXQWXSI-UHFFFAOYSA-N -1 1 341.354 4.471 20 0 EIADMM CCCN(Cc1c(F)cccc1Cl)C(=O)c1cccc([O-])c1F ZINC001136176218 1049224216 /nfs/dbraw/zinc/22/42/16/1049224216.db2.gz LGOHDKRPCLYBOD-UHFFFAOYSA-N -1 1 339.769 4.376 20 0 EIADMM CCC1CCC(N(C)C(=O)c2ccc(Br)cc2[O-])CC1 ZINC000044490971 1049233197 /nfs/dbraw/zinc/23/31/97/1049233197.db2.gz JFVUIFWFEHUQAH-UHFFFAOYSA-N -1 1 340.261 4.196 20 0 EIADMM O=C(Nc1cc(Cl)c([O-])c2ccccc12)c1cc(C2CC2)on1 ZINC001148253910 1049288353 /nfs/dbraw/zinc/28/83/53/1049288353.db2.gz XHYSLXQZXRMPTP-UHFFFAOYSA-N -1 1 328.755 4.317 20 0 EIADMM CN(Cc1ccccc1F)Cn1c(CCC2CCCC2)n[n-]c1=S ZINC000170841540 1049305127 /nfs/dbraw/zinc/30/51/27/1049305127.db2.gz JEUNJKZMCMXTTI-UHFFFAOYSA-N -1 1 348.491 4.292 20 0 EIADMM O=C(NCC1CCc2ccccc2CC1)c1ccc2ccccc2c1[O-] ZINC001148786049 1049371440 /nfs/dbraw/zinc/37/14/40/1049371440.db2.gz QCPDLDDYGMWJBU-UHFFFAOYSA-N -1 1 345.442 4.470 20 0 EIADMM O=C(N[C@H]1CCCc2cccnc21)c1cccc(-c2ccccc2)c1[O-] ZINC001148873478 1049385983 /nfs/dbraw/zinc/38/59/83/1049385983.db2.gz WCEFWCFUSPZMKK-IBGZPJMESA-N -1 1 344.414 4.262 20 0 EIADMM CC[C@H](CNC(=O)c1ccc2ccccc2c1[O-])Oc1cccc(C)c1 ZINC001136278887 1049388527 /nfs/dbraw/zinc/38/85/27/1049388527.db2.gz KBCQYEUNXCFNTI-QGZVFWFLSA-N -1 1 349.430 4.441 20 0 EIADMM O=C(Nc1nccc2cnccc21)c1cccc(-c2ccccc2)c1[O-] ZINC001148861047 1049391370 /nfs/dbraw/zinc/39/13/70/1049391370.db2.gz IIUVMDMUPJDHHY-UHFFFAOYSA-N -1 1 341.370 4.255 20 0 EIADMM Cc1ccccc1C(F)(F)CNC(=O)c1ccc2ccccc2c1[O-] ZINC001148894571 1049394484 /nfs/dbraw/zinc/39/44/84/1049394484.db2.gz JAAQUKPEGPDJCZ-UHFFFAOYSA-N -1 1 341.357 4.376 20 0 EIADMM CCN(C(=O)c1cc(Br)ccc1[O-])c1ccccc1C ZINC000220537985 1049710802 /nfs/dbraw/zinc/71/08/02/1049710802.db2.gz MDGYXEKODOYVDI-UHFFFAOYSA-N -1 1 334.213 4.130 20 0 EIADMM CC(C)(CCc1ccccc1)NC(=O)c1ccc2ccc(O)cc2c1[O-] ZINC001136578400 1049757256 /nfs/dbraw/zinc/75/72/56/1049757256.db2.gz LTMZXARGPFZHBF-UHFFFAOYSA-N -1 1 349.430 4.392 20 0 EIADMM C[C@H](CC(=O)Nc1cccc(F)c1[O-])C(=O)c1ccc(Cl)cc1 ZINC001171632539 1049763689 /nfs/dbraw/zinc/76/36/89/1049763689.db2.gz FMXKTATUOQLNFR-SNVBAGLBSA-N -1 1 335.762 4.032 20 0 EIADMM Cc1sc(-n2cccc2)c(C(=O)Nc2cccc(F)c2[O-])c1C ZINC001171632679 1049764346 /nfs/dbraw/zinc/76/43/46/1049764346.db2.gz KHXRLQNXWYFFAA-UHFFFAOYSA-N -1 1 330.384 4.253 20 0 EIADMM CCCC[C@H]1CCC[C@@H]1NC(=O)c1c([O-])cnc2c(F)cccc21 ZINC001136601330 1049776730 /nfs/dbraw/zinc/77/67/30/1049776730.db2.gz SUNTUEMLKJJNEX-WFASDCNBSA-N -1 1 330.403 4.168 20 0 EIADMM N#CC(=C([O-])c1ccc(N2CCCCC2)cc1)c1nc2ccccc2o1 ZINC000179916183 1049800596 /nfs/dbraw/zinc/80/05/96/1049800596.db2.gz ZHNMOBKAILHOBO-QGZVFWFLSA-N -1 1 345.402 4.308 20 0 EIADMM C[C@]1(Cc2ccc(F)c(F)c2)CCCN1C(=O)c1ccc([O-])c(F)c1 ZINC001171938519 1049829958 /nfs/dbraw/zinc/82/99/58/1049829958.db2.gz HKHKSWOQXSBINH-LJQANCHMSA-N -1 1 349.352 4.047 20 0 EIADMM O=C(Nc1ccc([O-])c(F)c1F)[C@H]1CCC[C@@H]1Cc1ccccc1 ZINC000616100555 1049845846 /nfs/dbraw/zinc/84/58/46/1049845846.db2.gz JVPQYRMIFKNUGK-KGLIPLIRSA-N -1 1 331.362 4.268 20 0 EIADMM COCCOc1ccccc1Nc1c(Cl)ccc([O-])c1Cl ZINC001212640498 1049855118 /nfs/dbraw/zinc/85/51/18/1049855118.db2.gz UYKIMZBOAHFVEB-UHFFFAOYSA-N -1 1 328.195 4.468 20 0 EIADMM CN1CCCc2cc(NC(=O)c3cc4ccccc4cc3[O-])ccc21 ZINC001136742526 1049861286 /nfs/dbraw/zinc/86/12/86/1049861286.db2.gz QSPVWQZSLZRLBS-UHFFFAOYSA-N -1 1 332.403 4.180 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1ccc(Br)s1 ZINC000082192546 1049872296 /nfs/dbraw/zinc/87/22/96/1049872296.db2.gz BUSBISNSYPQQEM-UHFFFAOYSA-N -1 1 332.606 4.122 20 0 EIADMM CC(C)COc1ccc(Nc2cc3ccc([O-])cc3oc2=O)cc1 ZINC001212285668 1049917980 /nfs/dbraw/zinc/91/79/80/1049917980.db2.gz JORBXUSMAMRTKF-UHFFFAOYSA-N -1 1 325.364 4.277 20 0 EIADMM CCOC(=O)Nc1ccc(NCc2cccc(Cl)c2[O-])cc1C#N ZINC000181511101 1050166829 /nfs/dbraw/zinc/16/68/29/1050166829.db2.gz FXMJONQQGPTFQK-UHFFFAOYSA-N -1 1 345.786 4.098 20 0 EIADMM FC(F)(F)c1cnc(-c2nc(-c3ccc4sccc4c3)no2)[n-]1 ZINC001212689945 1050227786 /nfs/dbraw/zinc/22/77/86/1050227786.db2.gz UYAPDYMFDXOXBS-UHFFFAOYSA-N -1 1 336.298 4.360 20 0 EIADMM FC(F)(F)c1c[n-]c(-c2nc(-c3ccc4sccc4c3)no2)n1 ZINC001212689945 1050227794 /nfs/dbraw/zinc/22/77/94/1050227794.db2.gz UYAPDYMFDXOXBS-UHFFFAOYSA-N -1 1 336.298 4.360 20 0 EIADMM Cc1cc(-c2noc(-c3ncc(C(F)(F)F)[n-]3)n2)ccc1Cl ZINC001212690061 1050228137 /nfs/dbraw/zinc/22/81/37/1050228137.db2.gz VQFZGGLKCPTIEN-UHFFFAOYSA-N -1 1 328.681 4.107 20 0 EIADMM Cc1cc(-c2noc(-c3nc(C(F)(F)F)c[n-]3)n2)ccc1Cl ZINC001212690061 1050228149 /nfs/dbraw/zinc/22/81/49/1050228149.db2.gz VQFZGGLKCPTIEN-UHFFFAOYSA-N -1 1 328.681 4.107 20 0 EIADMM Cc1c(=O)[n-]n(-c2ccccc2)c1NC1CCC2(CCOCC2)CC1 ZINC001173044776 1050270932 /nfs/dbraw/zinc/27/09/32/1050270932.db2.gz DZIJUHISSULQFY-UHFFFAOYSA-N -1 1 341.455 4.038 20 0 EIADMM Cc1c(NC(=O)c2ccc([O-])c(F)c2)snc1-c1ccccc1 ZINC001186209271 1050271210 /nfs/dbraw/zinc/27/12/10/1050271210.db2.gz UQCCUQKIEMDAPT-UHFFFAOYSA-N -1 1 328.368 4.216 20 0 EIADMM O=C(NCCc1ccc(F)cc1)Nc1cc(Cl)c(Cl)cc1[O-] ZINC001186279830 1050280189 /nfs/dbraw/zinc/28/01/89/1050280189.db2.gz WZRVMXRHSKDYCT-UHFFFAOYSA-N -1 1 343.185 4.202 20 0 EIADMM COC(=O)c1ccc(Cl)c(Nc2c(F)ccc([O-])c2Cl)c1 ZINC001250234539 1050285259 /nfs/dbraw/zinc/28/52/59/1050285259.db2.gz RLAXGQDDWUHYOT-UHFFFAOYSA-N -1 1 330.142 4.368 20 0 EIADMM O=C(Nc1cc2[nH]ccc2cc1Br)c1ccc([O-])cc1F ZINC001186329647 1050300534 /nfs/dbraw/zinc/30/05/34/1050300534.db2.gz UEFVNKLYRLUKIZ-UHFFFAOYSA-N -1 1 349.159 4.027 20 0 EIADMM O=S(=O)([N-][C@@H](c1ccccc1)C1CCC1)c1cc2ccccc2o1 ZINC001186679074 1050396647 /nfs/dbraw/zinc/39/66/47/1050396647.db2.gz TWZLHBGLNUFRDB-IBGZPJMESA-N -1 1 341.432 4.253 20 0 EIADMM CSc1ccc(/C=C/C(=O)Nc2ccc([O-])c(Cl)c2)s1 ZINC001151582300 1050412407 /nfs/dbraw/zinc/41/24/07/1050412407.db2.gz FIOYXOUFYBVEPN-ZZXKWVIFSA-N -1 1 325.842 4.481 20 0 EIADMM Cc1cccc(Cl)c1[N-]S(=O)(=O)c1cc2c(s1)CCCC2 ZINC001187173406 1050502314 /nfs/dbraw/zinc/50/23/14/1050502314.db2.gz BQPHPJRBCINUSE-UHFFFAOYSA-N -1 1 341.885 4.390 20 0 EIADMM [O-]c1c(Cl)cc(Br)cc1Nc1cc(F)cc(CO)c1 ZINC001212751427 1050546748 /nfs/dbraw/zinc/54/67/48/1050546748.db2.gz GNGXGFGJOWIDJG-UHFFFAOYSA-N -1 1 346.583 4.183 20 0 EIADMM Cc1c(Cl)cc(Nc2ccc(S(C)(=O)=O)cc2)c([O-])c1Cl ZINC001173944679 1050658914 /nfs/dbraw/zinc/65/89/14/1050658914.db2.gz MXQLQOILDGOBRT-UHFFFAOYSA-N -1 1 346.235 4.155 20 0 EIADMM Cc1ccccc1Oc1cccc(NC(=O)c2ccc(O)cc2[O-])c1 ZINC001179531345 1050712106 /nfs/dbraw/zinc/71/21/06/1050712106.db2.gz BWJXTPVFBVFHCU-UHFFFAOYSA-N -1 1 335.359 4.451 20 0 EIADMM C[C@@H](CC(=O)Nc1cc(F)c([O-])cc1Cl)c1ccccc1F ZINC001179656548 1050737271 /nfs/dbraw/zinc/73/72/71/1050737271.db2.gz SDIRHPAXJTYCPT-VIFPVBQESA-N -1 1 325.742 4.456 20 0 EIADMM Cc1c(=O)[n-]c(S[C@@H](C)C(=O)c2ccco2)nc1-c1ccccc1 ZINC001189102876 1050910153 /nfs/dbraw/zinc/91/01/53/1050910153.db2.gz FBEFCURXXGBISK-LBPRGKRZSA-N -1 1 340.404 4.114 20 0 EIADMM CC(=O)NCc1cccc(Nc2cc(Cl)cc(Cl)c2[O-])c1 ZINC001174369810 1050932671 /nfs/dbraw/zinc/93/26/71/1050932671.db2.gz YBCVWDANSQTYJG-UHFFFAOYSA-N -1 1 325.195 4.079 20 0 EIADMM CC(=O)NCc1cccc(Nc2cc(Cl)c(C)c(Cl)c2[O-])c1 ZINC001174370778 1050934926 /nfs/dbraw/zinc/93/49/26/1050934926.db2.gz VSOMFQYZMJTSOZ-UHFFFAOYSA-N -1 1 339.222 4.387 20 0 EIADMM Cc1cccc(C)c1[N-]S(=O)(=O)c1ccc(F)c2ccccc21 ZINC001189349622 1050978218 /nfs/dbraw/zinc/97/82/18/1050978218.db2.gz ZJZFGQWPIHDRNE-UHFFFAOYSA-N -1 1 329.396 4.397 20 0 EIADMM CC(C)(O)c1cccc(Nc2ccc(F)c(Br)c2[O-])c1 ZINC001174409325 1050984676 /nfs/dbraw/zinc/98/46/76/1050984676.db2.gz LHUIWKXNZFFHOX-UHFFFAOYSA-N -1 1 340.192 4.265 20 0 EIADMM COC(=O)c1cc(Br)c([O-])c(Nc2ccsc2C)c1 ZINC001174461016 1051007078 /nfs/dbraw/zinc/00/70/78/1051007078.db2.gz JQBMKBZLWTWLHN-UHFFFAOYSA-N -1 1 342.214 4.055 20 0 EIADMM Cc1ccc(C(C)C)cc1O[C@H](C)C(=O)Nc1cccc(F)c1[O-] ZINC001151771384 1051008110 /nfs/dbraw/zinc/00/81/10/1051008110.db2.gz IBFYYZNUKBAYFO-CYBMUJFWSA-N -1 1 331.387 4.369 20 0 EIADMM COc1ccc(CSc2nc(-c3ccccc3)cc(=O)[n-]2)cc1C ZINC001190211743 1051138049 /nfs/dbraw/zinc/13/80/49/1051138049.db2.gz WPUMVODHEDZDOI-UHFFFAOYSA-N -1 1 338.432 4.459 20 0 EIADMM [O-]c1c(Cl)c(Cl)ccc1Nc1ccc(N2CCOCC2)cc1 ZINC001174711070 1051145315 /nfs/dbraw/zinc/14/53/15/1051145315.db2.gz ZTAQFJFCLFODEL-UHFFFAOYSA-N -1 1 339.222 4.279 20 0 EIADMM Cc1cc(C)c([N-]S(=O)(=O)c2cc(F)cc(F)c2F)c(Cl)c1 ZINC001190389662 1051165033 /nfs/dbraw/zinc/16/50/33/1051165033.db2.gz KSBSUYWORQXTPP-UHFFFAOYSA-N -1 1 349.761 4.175 20 0 EIADMM O=S(=O)([N-]c1ccc(F)c(Cl)c1)c1ccc(C2CC2)cc1 ZINC001190501214 1051195783 /nfs/dbraw/zinc/19/57/83/1051195783.db2.gz YIYRJBPGXOVAQP-UHFFFAOYSA-N -1 1 325.792 4.157 20 0 EIADMM COc1ccc(Nc2c(Cl)ccc([O-])c2Cl)c(OC)c1OC ZINC001174901918 1051237417 /nfs/dbraw/zinc/23/74/17/1051237417.db2.gz VQGVAWDQPASXIL-UHFFFAOYSA-N -1 1 344.194 4.468 20 0 EIADMM CC(C)(CC(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)c1ccccc1 ZINC000620774386 1051309872 /nfs/dbraw/zinc/30/98/72/1051309872.db2.gz IYDVCQUESUGXMT-UHFFFAOYSA-N -1 1 335.407 4.089 20 0 EIADMM CCCOc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1[O-] ZINC001191003540 1051323376 /nfs/dbraw/zinc/32/33/76/1051323376.db2.gz JJLYUCCLNCWJAY-UHFFFAOYSA-N -1 1 339.313 4.452 20 0 EIADMM COc1cc(Nc2cc(Cl)c([O-])cc2F)cc(Br)n1 ZINC001250023291 1051327024 /nfs/dbraw/zinc/32/70/24/1051327024.db2.gz HEGYCSDWZGVAGZ-UHFFFAOYSA-N -1 1 347.571 4.094 20 0 EIADMM O=C(Nc1ccc(-c2nc3ccccc3[nH]2)cc1)c1ccc([O-])cc1F ZINC000154773890 1051336188 /nfs/dbraw/zinc/33/61/88/1051336188.db2.gz ABBVJUOYNDWDJH-UHFFFAOYSA-N -1 1 347.349 4.327 20 0 EIADMM C[C@@H](NC(=O)c1ccc([O-])cc1F)c1nc(-c2ccccc2)cs1 ZINC000154872511 1051344023 /nfs/dbraw/zinc/34/40/23/1051344023.db2.gz WKDCAATXVPZZHI-LLVKDONJSA-N -1 1 342.395 4.146 20 0 EIADMM COc1cc(C(=O)N[C@@H](c2ccccc2F)C2CC2)cc(Cl)c1[O-] ZINC001191155899 1051366887 /nfs/dbraw/zinc/36/68/87/1051366887.db2.gz PTMOJJIIEUPWDQ-MRXNPFEDSA-N -1 1 349.789 4.074 20 0 EIADMM CC(C)c1cc(C(=O)[N-]c2nnc(-c3cccc(Cl)c3)s2)no1 ZINC000156065268 1051490006 /nfs/dbraw/zinc/49/00/06/1051490006.db2.gz RQLGNIGSNGNSBW-UHFFFAOYSA-N -1 1 348.815 4.222 20 0 EIADMM CC(=O)c1cc(Br)ccc1Nc1c(F)ccc([O-])c1F ZINC001175266350 1051503439 /nfs/dbraw/zinc/50/34/39/1051503439.db2.gz XQFOUKVANQRHEA-UHFFFAOYSA-N -1 1 342.139 4.379 20 0 EIADMM COc1cc(Nc2ccc(F)c(Br)c2[O-])ccc1F ZINC001175398993 1051542019 /nfs/dbraw/zinc/54/20/19/1051542019.db2.gz BVXWSFRJOZYWHQ-UHFFFAOYSA-N -1 1 330.128 4.185 20 0 EIADMM COc1ccc2cc(S(=O)(=O)[N-]c3cc(F)ccc3C)ccc2c1 ZINC001191932543 1051586464 /nfs/dbraw/zinc/58/64/64/1051586464.db2.gz RUQOULDBXDBHNX-UHFFFAOYSA-N -1 1 345.395 4.097 20 0 EIADMM CCS(=O)(=O)c1cccc(Nc2cc(Cl)cc(Cl)c2[O-])c1 ZINC001175451714 1051624007 /nfs/dbraw/zinc/62/40/07/1051624007.db2.gz CXIDTLWQPACXGA-UHFFFAOYSA-N -1 1 346.235 4.236 20 0 EIADMM O=C(Nc1cccc(C(F)(F)F)c1[O-])[C@]12CC[C@H](O1)c1ccccc12 ZINC001182486295 1051627226 /nfs/dbraw/zinc/62/72/26/1051627226.db2.gz JHECKAUOJJJZTO-WMLDXEAASA-N -1 1 349.308 4.110 20 0 EIADMM O=C(Nc1ccc(OC(F)F)cc1)Nc1ccc(Cl)cc1[O-] ZINC001192176697 1051658422 /nfs/dbraw/zinc/65/84/22/1051658422.db2.gz REKJCZZFDAAELF-UHFFFAOYSA-N -1 1 328.702 4.291 20 0 EIADMM CCCc1ccc(N(C(=S)[N-]C(=O)OC)c2ccccc2N)cc1 ZINC001175721069 1051740349 /nfs/dbraw/zinc/74/03/49/1051740349.db2.gz IZNNRVQXBINVGP-UHFFFAOYSA-N -1 1 343.452 4.000 20 0 EIADMM O=S(=O)([N-]CC1=CCCC1)c1c(Cl)cc(Cl)cc1Cl ZINC001192764203 1051806474 /nfs/dbraw/zinc/80/64/74/1051806474.db2.gz GDRFVJQOEKZOEF-UHFFFAOYSA-N -1 1 340.659 4.035 20 0 EIADMM O=C(CC1CCCCCC1)Nc1n[nH]c(-c2ccc([O-])c(Cl)c2)n1 ZINC001183251211 1051816518 /nfs/dbraw/zinc/81/65/18/1051816518.db2.gz QIBOIQQYBHYBMZ-UHFFFAOYSA-N -1 1 348.834 4.130 20 0 EIADMM O=C(CC1CCCCCC1)Nc1nc(-c2ccc([O-])c(Cl)c2)n[nH]1 ZINC001183251211 1051816527 /nfs/dbraw/zinc/81/65/27/1051816527.db2.gz QIBOIQQYBHYBMZ-UHFFFAOYSA-N -1 1 348.834 4.130 20 0 EIADMM CSc1cccc([N-]S(=O)(=O)c2cccc3ncccc32)c1C ZINC000774623734 1051836735 /nfs/dbraw/zinc/83/67/35/1051836735.db2.gz RVJSNVIBTCFDJK-UHFFFAOYSA-N -1 1 344.461 4.066 20 0 EIADMM CSc1cc(C)nc(SC)c1[N-]C(=O)c1ccnc(C2CC2)c1 ZINC001193001088 1051845705 /nfs/dbraw/zinc/84/57/05/1051845705.db2.gz KCVHEZKQHJUYOM-UHFFFAOYSA-N -1 1 345.493 4.359 20 0 EIADMM [O-]c1c(Cl)cc(Br)cc1Nc1cnn(C2CC2)c1 ZINC001175964142 1051850946 /nfs/dbraw/zinc/85/09/46/1051850946.db2.gz QIYRTNALMAOKDH-UHFFFAOYSA-N -1 1 328.597 4.083 20 0 EIADMM [O-]c1c(Cl)c(Cl)ccc1Nc1cccc(N2CCOCC2)c1 ZINC001176020939 1051878292 /nfs/dbraw/zinc/87/82/92/1051878292.db2.gz GCYSQBOYPFPEDK-UHFFFAOYSA-N -1 1 339.222 4.279 20 0 EIADMM CCN(CC)C(=O)c1ccc(F)c(Nc2cc(F)c([O-])c(F)c2)c1 ZINC001176068528 1051904273 /nfs/dbraw/zinc/90/42/73/1051904273.db2.gz HDHYORBIKQLGEM-UHFFFAOYSA-N -1 1 338.329 4.035 20 0 EIADMM O=C(Nc1ccc(C(=O)C2CC2)cc1)c1ccc([O-])cc1C(F)(F)F ZINC001193748620 1051991887 /nfs/dbraw/zinc/99/18/87/1051991887.db2.gz SKECFZJXVZFQIP-UHFFFAOYSA-N -1 1 349.308 4.256 20 0 EIADMM COCc1ccc([N-]S(=O)(=O)c2ccc(C)c3ccccc32)cc1 ZINC001193863264 1052018775 /nfs/dbraw/zinc/01/87/75/1052018775.db2.gz JLOZXSNQFMSTJY-UHFFFAOYSA-N -1 1 341.432 4.095 20 0 EIADMM Cc1ccccc1-c1cccc([N-]S(=O)(=O)c2ccccc2N)c1 ZINC001193930141 1052023172 /nfs/dbraw/zinc/02/31/72/1052023172.db2.gz WMLKJKJUNISOOR-UHFFFAOYSA-N -1 1 338.432 4.045 20 0 EIADMM Cc1cc(O)cc([N-]S(=O)(=O)c2ccc(-c3cccs3)cc2)c1 ZINC001194169725 1052094370 /nfs/dbraw/zinc/09/43/70/1052094370.db2.gz SUNAPEYUGUZGFU-UHFFFAOYSA-N -1 1 345.445 4.230 20 0 EIADMM O=S(=O)([N-]c1cccc(F)c1)c1ccc2c(Cl)cccc2c1 ZINC001194215533 1052108737 /nfs/dbraw/zinc/10/87/37/1052108737.db2.gz HNMWKAJIWNHXOH-UHFFFAOYSA-N -1 1 335.787 4.433 20 0 EIADMM Nc1cccc2c3ccccc3n(-c3c(F)cc(F)c([O-])c3F)c21 ZINC001176673217 1052159442 /nfs/dbraw/zinc/15/94/42/1052159442.db2.gz UPPIFGGTYOUXSV-UHFFFAOYSA-N -1 1 328.293 4.489 20 0 EIADMM CC(=O)Nc1cc(Nc2c(F)cc(F)c([O-])c2F)ccc1Cl ZINC001176672051 1052159590 /nfs/dbraw/zinc/15/95/90/1052159590.db2.gz RXIRCJXFOUAKIR-UHFFFAOYSA-N -1 1 330.693 4.165 20 0 EIADMM CCOc1ccc(Nc2c(F)cc(F)c([O-])c2F)cc1OCC ZINC001176673121 1052159623 /nfs/dbraw/zinc/15/96/23/1052159623.db2.gz PMMKPMFIJRAZJZ-UHFFFAOYSA-N -1 1 327.302 4.351 20 0 EIADMM CC(=O)Nc1ccc(Nc2c(F)cc(F)c([O-])c2F)cc1Cl ZINC001176671609 1052159947 /nfs/dbraw/zinc/15/99/47/1052159947.db2.gz JVTTZVDUMDIDQZ-UHFFFAOYSA-N -1 1 330.693 4.165 20 0 EIADMM [O-]c1c(F)cc(F)c(Nc2cccc(F)c2Br)c1F ZINC001176672020 1052160312 /nfs/dbraw/zinc/16/03/12/1052160312.db2.gz CLSQFXKBCAZAHT-UHFFFAOYSA-N -1 1 336.082 4.455 20 0 EIADMM CCOC(=O)c1cc(F)c(C)c(Nc2c(F)cc(F)c([O-])c2F)c1 ZINC001176671112 1052160380 /nfs/dbraw/zinc/16/03/80/1052160380.db2.gz SXZMLLQNTSGAEW-UHFFFAOYSA-N -1 1 343.276 4.177 20 0 EIADMM Cc1cnn(-c2ccccc2C)c1Nc1c(F)cc(F)c([O-])c1F ZINC001176663381 1052173126 /nfs/dbraw/zinc/17/31/26/1052173126.db2.gz HTHFRFWSQWHWJL-UHFFFAOYSA-N -1 1 333.313 4.356 20 0 EIADMM Cc1cc(Nc2c(F)cc(F)c([O-])c2F)ncc1Br ZINC001176662658 1052173183 /nfs/dbraw/zinc/17/31/83/1052173183.db2.gz UWAUBJSTRRSVLP-UHFFFAOYSA-N -1 1 333.107 4.019 20 0 EIADMM CC(C)CN(C(=O)c1ccc(C(F)(F)F)cc1[O-])C1CCCC1 ZINC000622334173 1052213417 /nfs/dbraw/zinc/21/34/17/1052213417.db2.gz ADNYZDHFXNASOY-UHFFFAOYSA-N -1 1 329.362 4.452 20 0 EIADMM Cc1ccc(C(F)(F)F)cc1NC(=O)c1c(F)ccc([O-])c1F ZINC000622406061 1052247825 /nfs/dbraw/zinc/24/78/25/1052247825.db2.gz GUTIIEUMLUUDFX-UHFFFAOYSA-N -1 1 331.240 4.250 20 0 EIADMM CCC[C@]1(C)CCCN(C(=O)c2ccc(C(F)(F)F)cc2[O-])C1 ZINC000622403503 1052247878 /nfs/dbraw/zinc/24/78/78/1052247878.db2.gz XKQMHQFVISEHAD-MRXNPFEDSA-N -1 1 329.362 4.453 20 0 EIADMM CC(C)[C@@H](CC(F)(F)F)NC(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000622543280 1052321790 /nfs/dbraw/zinc/32/17/90/1052321790.db2.gz GBSWNCQFYXXQDS-SNVBAGLBSA-N -1 1 343.267 4.118 20 0 EIADMM O=C([N-]c1c(F)cc(Cl)cc1F)c1cnc([C@H]2CCCO2)s1 ZINC000180335331 1052794789 /nfs/dbraw/zinc/79/47/89/1052794789.db2.gz FCNFDVJRJVOTBM-SNVBAGLBSA-N -1 1 344.770 4.179 20 0 EIADMM Cc1cc(Br)c([O-])c(NC(=O)c2cccc3[nH]ccc32)c1 ZINC000182905809 1052955085 /nfs/dbraw/zinc/95/50/85/1052955085.db2.gz JAJWXMBZZGSBJT-UHFFFAOYSA-N -1 1 345.196 4.197 20 0 EIADMM CC1(C)[C@H](C(F)(F)F)CCN1Cc1cccc(C(=O)[O-])c1Cl ZINC000382211062 1053161057 /nfs/dbraw/zinc/16/10/57/1053161057.db2.gz SQWBCVYSVQXJHQ-LLVKDONJSA-N -1 1 335.753 4.201 20 0 EIADMM O=C([O-])c1sc2ccccc2c1CN1CC=C(C(F)(F)F)CC1 ZINC000382550853 1053224789 /nfs/dbraw/zinc/22/47/89/1053224789.db2.gz UQKZXXZXTQBRBL-UHFFFAOYSA-N -1 1 341.354 4.294 20 0 EIADMM CC(C)c1cccc(S(=O)(=O)[N-]c2ncc(Cl)cc2Cl)c1 ZINC001195116104 1053275433 /nfs/dbraw/zinc/27/54/33/1053275433.db2.gz MKAJOKLAFAXAGK-UHFFFAOYSA-N -1 1 345.251 4.313 20 0 EIADMM CC(C)c1cccc(S(=O)(=O)[N-]c2ccnc(C(C)(C)C)c2)c1 ZINC001195120757 1053281268 /nfs/dbraw/zinc/28/12/68/1053281268.db2.gz SPBAARGYQYSAEU-UHFFFAOYSA-N -1 1 332.469 4.303 20 0 EIADMM Cc1ccc2cc([N-]S(=O)(=O)c3cccc(C(C)C)c3)ccc2n1 ZINC001195154019 1053304411 /nfs/dbraw/zinc/30/44/11/1053304411.db2.gz RVLNWYLQYUXGNW-UHFFFAOYSA-N -1 1 340.448 4.467 20 0 EIADMM CCc1ccccc1[C@@H](CC(=O)[O-])NCc1ncc(C(C)C)s1 ZINC000864527636 1053307335 /nfs/dbraw/zinc/30/73/35/1053307335.db2.gz GPTVSYJGQNJCAZ-OAHLLOKOSA-N -1 1 332.469 4.135 20 0 EIADMM O=C([N-]c1c(Cl)cnnc1Cl)c1sccc1C(F)(F)F ZINC001195206493 1053331726 /nfs/dbraw/zinc/33/17/26/1053331726.db2.gz VQTVYHJJQJCJST-UHFFFAOYSA-N -1 1 342.129 4.116 20 0 EIADMM Cc1nc(SCc2nc(Cl)ccc2Cl)[n-]c(=O)c1C1CC1 ZINC000865372985 1053486331 /nfs/dbraw/zinc/48/63/31/1053486331.db2.gz AUNSVWBMGVMVCY-UHFFFAOYSA-N -1 1 342.251 4.362 20 0 EIADMM C[C@H]([N-]C(=O)C(F)(F)c1ccccc1F)c1ccc(F)c(F)c1 ZINC000765545078 1053664363 /nfs/dbraw/zinc/66/43/63/1053664363.db2.gz OEDGWSXELSYPQW-VIFPVBQESA-N -1 1 329.268 4.073 20 0 EIADMM [O-]c1c(NC(=S)NCc2ccc(F)cc2)cccc1C(F)(F)F ZINC001196496265 1053692817 /nfs/dbraw/zinc/69/28/17/1053692817.db2.gz SCXRULJHPBMCFC-UHFFFAOYSA-N -1 1 344.333 4.037 20 0 EIADMM CN(Cc1ccc2ccccc2c1)C(=O)c1cc(Cl)ccc1[O-] ZINC000021926808 1053748616 /nfs/dbraw/zinc/74/86/16/1053748616.db2.gz XKFMPTWAFQHEHW-UHFFFAOYSA-N -1 1 325.795 4.471 20 0 EIADMM O=C(Nc1cc(F)c([O-])cc1Cl)[C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000885674345 1053788061 /nfs/dbraw/zinc/78/80/61/1053788061.db2.gz LZIAEALDUDBVIX-HTQZYQBOSA-N -1 1 339.716 4.492 20 0 EIADMM COc1c(C)ccc([N-]S(=O)(=O)c2cc(Cl)ccc2C)c1C ZINC000031722556 1054077579 /nfs/dbraw/zinc/07/75/79/1054077579.db2.gz QHSYDSTWAFDHDS-UHFFFAOYSA-N -1 1 339.844 4.075 20 0 EIADMM O=C([O-])CC[C@@H](NCc1cncs1)c1ccc(Cl)c(Cl)c1 ZINC000871066260 1054150267 /nfs/dbraw/zinc/15/02/67/1054150267.db2.gz PRDVNSUQIALGLR-CYBMUJFWSA-N -1 1 345.251 4.146 20 0 EIADMM CCC(=O)Nc1ccc(NC(=O)c2cc3ccccc3cc2[O-])cc1 ZINC000044795312 1054305615 /nfs/dbraw/zinc/30/56/15/1054305615.db2.gz SFPFSVQUTZHLFE-UHFFFAOYSA-N -1 1 334.375 4.146 20 0 EIADMM COc1ccc(S(=O)(=O)[N-]c2ccccc2-c2ccco2)c(C)c1 ZINC001198951475 1054320511 /nfs/dbraw/zinc/32/05/11/1054320511.db2.gz RRIZHJLWSCISIV-UHFFFAOYSA-N -1 1 343.404 4.064 20 0 EIADMM CCCCC[C@@H](NC(=O)Cn1c(CCC)n[n-]c1=S)C(C)(C)C ZINC000115446508 1054350511 /nfs/dbraw/zinc/35/05/11/1054350511.db2.gz CGFRWQURHIAJDR-CYBMUJFWSA-N -1 1 340.537 4.004 20 0 EIADMM Cc1cc(C)c(-c2cc(NC(=O)c3ccc([O-])cc3F)n[nH]2)cc1C ZINC000776120270 1054558382 /nfs/dbraw/zinc/55/83/82/1054558382.db2.gz UZAGANOELFIDEU-UHFFFAOYSA-N -1 1 339.370 4.099 20 0 EIADMM Cc1onc(-c2ccc(F)cc2)c1C(=O)[N-]c1nc(C(C)C)ns1 ZINC000874697757 1054718673 /nfs/dbraw/zinc/71/86/73/1054718673.db2.gz YCTWYOOVYQWJKZ-UHFFFAOYSA-N -1 1 346.387 4.016 20 0 EIADMM Cc1c(Cl)cc(Nc2cnn(Cc3ccccn3)c2)c([O-])c1Cl ZINC001201428263 1054798335 /nfs/dbraw/zinc/79/83/35/1054798335.db2.gz PJPXAZVQOARKNJ-UHFFFAOYSA-N -1 1 349.221 4.391 20 0 EIADMM S=c1[n-]nc(CCC2CCCC2)n1CN1Cc2ccccc2C1 ZINC000106062991 1054844146 /nfs/dbraw/zinc/84/41/46/1054844146.db2.gz VBZWQCTWRONATO-UHFFFAOYSA-N -1 1 328.485 4.037 20 0 EIADMM CCc1ccccc1[N-]S(=O)(=O)c1ccc(F)c(C(F)(F)F)c1 ZINC000063911447 1054844277 /nfs/dbraw/zinc/84/42/77/1054844277.db2.gz LZVGIVPWRRPPKU-UHFFFAOYSA-N -1 1 347.333 4.208 20 0 EIADMM [O-]c1c(Br)ccc(Cl)c1Nc1cnn(C(F)F)c1 ZINC001201751543 1054896186 /nfs/dbraw/zinc/89/61/86/1054896186.db2.gz VESRZHDWGCRCBQ-UHFFFAOYSA-N -1 1 338.539 4.143 20 0 EIADMM O=C(Nc1ccccc1Br)Nc1cc(F)c(F)cc1[O-] ZINC001201979214 1054956534 /nfs/dbraw/zinc/95/65/34/1054956534.db2.gz RVKHKQLCLLAOJV-UHFFFAOYSA-N -1 1 343.127 4.077 20 0 EIADMM CCN1C(=O)c2ccc(Cl)cc2N[C@H]1c1ccc([O-])c(Cl)c1 ZINC000065888093 1054976465 /nfs/dbraw/zinc/97/64/65/1054976465.db2.gz NRCULMGAAPSENC-OAHLLOKOSA-N -1 1 337.206 4.285 20 0 EIADMM CCC[C@@H](C)CC(=O)N1CCC(c2n[n-]c(=S)n2C(C)C)CC1 ZINC000068446986 1055083033 /nfs/dbraw/zinc/08/30/33/1055083033.db2.gz LFJOWOGRRIATBH-CYBMUJFWSA-N -1 1 338.521 4.054 20 0 EIADMM CCC1=NO[C@H](c2nc(=O)c3c(-c4ccc(C)s4)csc3[n-]2)C1 ZINC000126614754 1055090822 /nfs/dbraw/zinc/09/08/22/1055090822.db2.gz PFNMZWGLSJJNNG-NSHDSACASA-N -1 1 345.449 4.249 20 0 EIADMM CCC1=NO[C@H](c2nc(=O)c3c(C[C@@H](C)CC)c(C)sc3[n-]2)C1 ZINC000126616761 1055090885 /nfs/dbraw/zinc/09/08/85/1055090885.db2.gz VNMLZFUBNHKQOD-ZANVPECISA-N -1 1 333.457 4.109 20 0 EIADMM O=C(Nc1cccc(C(F)(F)F)c1)Nc1c(F)cc([O-])cc1F ZINC001202297460 1055128950 /nfs/dbraw/zinc/12/89/50/1055128950.db2.gz GELQBMBAFGREQP-UHFFFAOYSA-N -1 1 332.228 4.333 20 0 EIADMM O=C(Nc1ccc(C(F)(F)F)cc1)Nc1cc([O-])c(F)cc1F ZINC001202411435 1055161186 /nfs/dbraw/zinc/16/11/86/1055161186.db2.gz LDNUFFXZQONMQJ-UHFFFAOYSA-N -1 1 332.228 4.333 20 0 EIADMM Cc1ccc([C@@H](C)[N@@H+](C)Cc2nnc(-c3ccccc3O)o2)c(C)c1 ZINC000877987508 1055169796 /nfs/dbraw/zinc/16/97/96/1055169796.db2.gz JYMPFDQWKYAACZ-OAHLLOKOSA-N -1 1 337.423 4.252 20 0 EIADMM CC[C@@H]1CCC[C@]1(C)C(=O)N1CCC(C(=O)c2ccc([O-])cc2)CC1 ZINC000878046098 1055179249 /nfs/dbraw/zinc/17/92/49/1055179249.db2.gz QTHQIHQZPFNCTN-UTKZUKDTSA-N -1 1 343.467 4.030 20 0 EIADMM COc1ccc(SCCC(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000111666928 1055226060 /nfs/dbraw/zinc/22/60/60/1055226060.db2.gz IERMHSISILHTNL-UHFFFAOYSA-N -1 1 337.828 4.175 20 0 EIADMM COc1ccc2oc(C(=O)Nc3ccc([O-])c(Cl)c3)c(C)c2c1 ZINC000111667825 1055226521 /nfs/dbraw/zinc/22/65/21/1055226521.db2.gz CUGHNHAMDGDXTG-UHFFFAOYSA-N -1 1 331.755 4.361 20 0 EIADMM O=C(CCc1ccc(OC(F)F)cc1)Nc1ccc([O-])c(Cl)c1 ZINC000111667671 1055226598 /nfs/dbraw/zinc/22/65/98/1055226598.db2.gz LPPHCXLPTJNDAX-UHFFFAOYSA-N -1 1 341.741 4.218 20 0 EIADMM Cc1cc(Cl)cc(C)c1[N-]S(=O)(=O)c1cc(F)c(F)c(F)c1 ZINC001116467169 1055867035 /nfs/dbraw/zinc/86/70/35/1055867035.db2.gz UKMRWXNWOXNFEG-UHFFFAOYSA-N -1 1 349.761 4.175 20 0 EIADMM O=C(Nc1cc(Cl)c([O-])c(Cl)c1)c1c(O)cccc1Cl ZINC000765861200 1056021198 /nfs/dbraw/zinc/02/11/98/1056021198.db2.gz ANMPKXHVFPYKCM-UHFFFAOYSA-N -1 1 332.570 4.310 20 0 EIADMM O=C(Nc1ccc(OC(F)(F)F)cc1)Nc1cc(F)c([O-])c(F)c1 ZINC000169180159 1056080030 /nfs/dbraw/zinc/08/00/30/1056080030.db2.gz VLYUODNNWBQCJV-UHFFFAOYSA-N -1 1 348.227 4.213 20 0 EIADMM Cc1ccc(Cl)cc1[N-]S(=O)(=O)c1ccc2c(c1)CCCC2 ZINC000007409019 1056793949 /nfs/dbraw/zinc/79/39/49/1056793949.db2.gz HXTQYUCJEUOZRA-UHFFFAOYSA-N -1 1 335.856 4.328 20 0 EIADMM Cc1cccc(C)c1[N-]S(=O)(=O)c1cc(Cl)cc(Cl)c1 ZINC000007409060 1056794538 /nfs/dbraw/zinc/79/45/38/1056794538.db2.gz DRRLWHMEISANKP-UHFFFAOYSA-N -1 1 330.236 4.411 20 0 EIADMM CC(=O)c1ccc([O-])c(CCOC(=O)C[C@H](C)c2ccccc2C)c1 ZINC000745051131 1059709801 /nfs/dbraw/zinc/70/98/01/1059709801.db2.gz WEPHWXAASYWZTA-HNNXBMFYSA-N -1 1 340.419 4.183 20 0 EIADMM CC(=O)c1ccc([O-])c(CCOC(=O)C[C@H](C)c2cccc(F)c2)c1 ZINC000745050359 1059710070 /nfs/dbraw/zinc/71/00/70/1059710070.db2.gz KNMQKGDUHWJEBI-ZDUSSCGKSA-N -1 1 344.382 4.013 20 0 EIADMM O=C(Nc1ccc(-n2ccc(=O)[n-]2)cc1)[C@H]1CCC[C@H]1c1ccccc1 ZINC001168915519 1060517225 /nfs/dbraw/zinc/51/72/25/1060517225.db2.gz XTNBNVZOBLPVOS-OALUTQOASA-N -1 1 347.418 4.100 20 0 EIADMM CCC(=CC(=O)Nc1ccc(-n2ccc(=O)[n-]2)cc1)c1ccc(C)cc1 ZINC001168914845 1060519484 /nfs/dbraw/zinc/51/94/84/1060519484.db2.gz OMYIZLKAKZQFHC-PEZBUJJGSA-N -1 1 347.418 4.318 20 0 EIADMM CCc1cc(=O)[n-]c(SCSCc2ccc(Cl)cc2)n1 ZINC000767057206 1061091629 /nfs/dbraw/zinc/09/16/29/1061091629.db2.gz HAWHDTYGUIVBAS-UHFFFAOYSA-N -1 1 326.874 4.381 20 0 EIADMM Cc1cc(OC(C)C)ccc1[N-]S(=O)(=O)c1cccc(Cl)c1 ZINC000614863585 1032102547 /nfs/dbraw/zinc/10/25/47/1032102547.db2.gz FMCJATFAFVYNRE-UHFFFAOYSA-N -1 1 339.844 4.236 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1CCC[C@@H](c2nccs2)C1 ZINC000172092167 1032276274 /nfs/dbraw/zinc/27/62/74/1032276274.db2.gz NZNKBOFDYKRAJA-CQSZACIVSA-N -1 1 338.432 4.022 20 0 EIADMM CO[C@H]1CCC[C@H](C(=O)Nc2cc(Cl)c([O-])c3ccccc23)C1 ZINC000529539036 1032428473 /nfs/dbraw/zinc/42/84/73/1032428473.db2.gz OCUQUPLPCIAYGD-RYUDHWBXSA-N -1 1 333.815 4.343 20 0 EIADMM CCc1c(NC(=O)Nc2ccc([O-])c(Cl)c2)cnn1CC(C)C ZINC000683078742 1018776882 /nfs/dbraw/zinc/77/68/82/1018776882.db2.gz IFSXUPYNBYAAQT-UHFFFAOYSA-N -1 1 336.823 4.105 20 0 EIADMM Cc1cc(C)cc(C2=CCN(Cc3ccc(C(=O)[O-])c(F)c3)CC2)c1 ZINC000579735667 1018844968 /nfs/dbraw/zinc/84/49/68/1018844968.db2.gz KEBYXELZSPALOF-UHFFFAOYSA-N -1 1 339.410 4.430 20 0 EIADMM CC(C)c1c(NC(=O)c2ccc([O-])c(F)c2)cnn1-c1ccccc1 ZINC000683122681 1018865891 /nfs/dbraw/zinc/86/58/91/1018865891.db2.gz ZSQPQMOKYNNTJW-UHFFFAOYSA-N -1 1 339.370 4.093 20 0 EIADMM C[C@H](c1ccccc1Cl)N(C)CCOc1cccc(C(=O)[O-])c1 ZINC000320462783 1018896045 /nfs/dbraw/zinc/89/60/45/1018896045.db2.gz PGOFEFBPLWVCAC-CYBMUJFWSA-N -1 1 333.815 4.110 20 0 EIADMM Cc1ccccc1S(=O)(=O)[N-]c1cccc(C(F)(F)F)c1C ZINC000471131248 1019048541 /nfs/dbraw/zinc/04/85/41/1019048541.db2.gz BMBQXADGFFLPMS-UHFFFAOYSA-N -1 1 329.343 4.123 20 0 EIADMM O=C([O-])[C@H](NCc1csc2ccccc12)c1cc(F)ccc1F ZINC000683174668 1019099010 /nfs/dbraw/zinc/09/90/10/1019099010.db2.gz WORQPJPGTXFZJT-MRXNPFEDSA-N -1 1 333.359 4.095 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1CC(F)(c2ccccc2F)C1 ZINC000646892295 1019616201 /nfs/dbraw/zinc/61/62/01/1019616201.db2.gz UHQKQVQTYOSPJT-UHFFFAOYSA-N -1 1 339.341 4.005 20 0 EIADMM C[C@H](c1cccs1)N(Cc1ccccc1)C(=O)c1cncc([O-])c1 ZINC000339893579 1020041091 /nfs/dbraw/zinc/04/10/91/1020041091.db2.gz MXMHRJBFIYCDTO-CQSZACIVSA-N -1 1 338.432 4.252 20 0 EIADMM CCCCCC[C@](C)(CC)C(=O)NCc1n[n-]c(=S)n1C1CC1 ZINC000080061378 1020150750 /nfs/dbraw/zinc/15/07/50/1020150750.db2.gz ZGJZIANGZMVCQP-KRWDZBQOSA-N -1 1 338.521 4.278 20 0 EIADMM CCCN(C(=O)c1ncc2ccccc2c1[O-])[C@@H]1CCc2ccccc21 ZINC001625845244 1020269546 /nfs/dbraw/zinc/26/95/46/1020269546.db2.gz KTDRFJOUCMPUAA-LJQANCHMSA-N -1 1 346.430 4.480 20 0 EIADMM CSCc1ccc([N-]S(=O)(=O)c2cc(C)sc2C)cc1 ZINC000340090104 1020308732 /nfs/dbraw/zinc/30/87/32/1020308732.db2.gz HZVHYPLSJYGCPF-UHFFFAOYSA-N -1 1 327.496 4.029 20 0 EIADMM Cc1ccccc1[C@@H](CC(F)(F)F)NC(=O)c1ccc([O-])c(F)c1 ZINC000683520165 1020861766 /nfs/dbraw/zinc/86/17/66/1020861766.db2.gz LWPRQJJCIYVALF-CQSZACIVSA-N -1 1 341.304 4.263 20 0 EIADMM CCC[C@H]1CCc2nc(NC(=O)c3ccc([O-])c(F)c3)sc2C1 ZINC001143379348 1020997526 /nfs/dbraw/zinc/99/75/26/1020997526.db2.gz SSQZZVAIOIFWAJ-JTQLQIEISA-N -1 1 334.416 4.145 20 0 EIADMM CC(C)Cn1ccc2c1cccc2C(=O)Nc1c([O-])cccc1F ZINC000683629349 1021022996 /nfs/dbraw/zinc/02/29/96/1021022996.db2.gz LTRIHKZLVGYRCF-UHFFFAOYSA-N -1 1 326.371 4.394 20 0 EIADMM CC(C)c1ccccc1[N-]S(=O)(=O)c1cc(F)cc(Cl)c1 ZINC000533689770 1021024873 /nfs/dbraw/zinc/02/48/73/1021024873.db2.gz PWMWYHGEDXSIGH-UHFFFAOYSA-N -1 1 327.808 4.403 20 0 EIADMM [O-]c1ccc(-c2noc(-c3ccc([C@H]4CCCOC4)cc3)n2)c(F)c1 ZINC000570355879 1021362597 /nfs/dbraw/zinc/36/25/97/1021362597.db2.gz RJSBBAPUFVZPEP-AWEZNQCLSA-N -1 1 340.354 4.142 20 0 EIADMM CC[C@@H](C)n1ncc(NC(=O)c2cc(SC)ccc2[O-])c1C1CC1 ZINC000613121157 1021734848 /nfs/dbraw/zinc/73/48/48/1021734848.db2.gz FKGBZNXKTWAIPY-LLVKDONJSA-N -1 1 345.468 4.411 20 0 EIADMM O=C([O-])c1ccc(CN2CCC(c3cccc(F)c3F)CC2)cc1F ZINC000564585613 1021745344 /nfs/dbraw/zinc/74/53/44/1021745344.db2.gz MFSNVCUDNOYEBS-UHFFFAOYSA-N -1 1 349.352 4.182 20 0 EIADMM Cc1nc(C(C)C)ccc1CSc1nc(C(F)(F)F)cc(=O)[n-]1 ZINC000549336706 1022013285 /nfs/dbraw/zinc/01/32/85/1022013285.db2.gz FYVCSJKAQZQAMO-UHFFFAOYSA-N -1 1 343.374 4.320 20 0 EIADMM Cc1ccccc1[N-]S(=O)(=O)c1ccc(C(F)(F)F)c(C)c1 ZINC000580492344 1022090516 /nfs/dbraw/zinc/09/05/16/1022090516.db2.gz FMJPCOMAGDUYAA-UHFFFAOYSA-N -1 1 329.343 4.123 20 0 EIADMM CCCCCC[C@H](C)CC(=O)NCc1n[n-]c(=S)n1C(C)C ZINC000066639888 1022171346 /nfs/dbraw/zinc/17/13/46/1022171346.db2.gz HUIMASFVOCGFNP-ZDUSSCGKSA-N -1 1 326.510 4.134 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1CCS[C@@H]2CCCC[C@H]21 ZINC000175456962 1022358035 /nfs/dbraw/zinc/35/80/35/1022358035.db2.gz HDXZAZNLDOYZRS-SJLPKXTDSA-N -1 1 327.449 4.046 20 0 EIADMM Cc1cccc(S(=O)(=O)[N-]c2ccc(CCC(F)(F)F)cc2)c1 ZINC000175775898 1022456992 /nfs/dbraw/zinc/45/69/92/1022456992.db2.gz YCXIGALOSOOLTL-UHFFFAOYSA-N -1 1 343.370 4.291 20 0 EIADMM Cc1cc(OCC[N@@H+](CC(=O)[O-])Cc2ccccc2)ccc1C(C)C ZINC000580778459 1022496717 /nfs/dbraw/zinc/49/67/17/1022496717.db2.gz KOCUJEIAMSMJJK-UHFFFAOYSA-N -1 1 341.451 4.084 20 0 EIADMM Cc1cc(OCCN(CC(=O)[O-])Cc2ccccc2)ccc1C(C)C ZINC000580778459 1022496730 /nfs/dbraw/zinc/49/67/30/1022496730.db2.gz KOCUJEIAMSMJJK-UHFFFAOYSA-N -1 1 341.451 4.084 20 0 EIADMM Cc1nc(-c2ccccc2)oc1C(=O)[N-]c1c(F)cc(F)cc1F ZINC000176019493 1022541922 /nfs/dbraw/zinc/54/19/22/1022541922.db2.gz GEYDQOMKDJPOOF-UHFFFAOYSA-N -1 1 332.281 4.320 20 0 EIADMM O=C(Nc1cc([O-])c(F)cc1F)c1cccc(Oc2ccccn2)c1 ZINC001625896015 1023043550 /nfs/dbraw/zinc/04/35/50/1023043550.db2.gz CUKLIINHESQQIN-UHFFFAOYSA-N -1 1 342.301 4.110 20 0 EIADMM Cc1cccc(S(=O)(=O)[N-]c2ccc(Cl)cc2Cl)c1F ZINC000313209174 1023089244 /nfs/dbraw/zinc/08/92/44/1023089244.db2.gz MXNMQYJFRJSMDD-UHFFFAOYSA-N -1 1 334.199 4.242 20 0 EIADMM CCCc1cc(=O)[n-]c(SCc2coc(-c3ccc(C)cc3)n2)n1 ZINC000025479580 1023231415 /nfs/dbraw/zinc/23/14/15/1023231415.db2.gz HFYUQHAZMXVLSI-UHFFFAOYSA-N -1 1 341.436 4.390 20 0 EIADMM Cc1csc(-c2ccc(NC(=O)c3ccc([O-])cc3F)cc2)n1 ZINC000181201464 1023234667 /nfs/dbraw/zinc/23/46/67/1023234667.db2.gz MTMOJNLACDXMPW-UHFFFAOYSA-N -1 1 328.368 4.216 20 0 EIADMM COc1ccccc1-c1cccc(NC(=O)c2ccc(O)cc2[O-])c1 ZINC000182419690 1023305715 /nfs/dbraw/zinc/30/57/15/1023305715.db2.gz NZXIYRCZPZDHCB-UHFFFAOYSA-N -1 1 335.359 4.026 20 0 EIADMM O=C([O-])[C@H]1C[C@@H](NCc2csc(Cl)c2Cl)c2ccccc21 ZINC000417637521 1023390406 /nfs/dbraw/zinc/39/04/06/1023390406.db2.gz ZABGPKPTFJJQRN-NWDGAFQWSA-N -1 1 342.247 4.458 20 0 EIADMM Cc1cc2[nH]c(C(=O)Nc3ccc(-c4cc(=O)[nH][n-]4)cc3)cc2c(C)c1 ZINC000613666627 1023475784 /nfs/dbraw/zinc/47/57/84/1023475784.db2.gz CHRGJAGIMCVQBF-UHFFFAOYSA-N -1 1 346.390 4.133 20 0 EIADMM CC(C)(C)OC(=O)[C@@H](NCc1cccc([O-])c1Cl)c1ccccc1 ZINC000594965397 1024175937 /nfs/dbraw/zinc/17/59/37/1024175937.db2.gz GVIDIUWHCMWDTO-KRWDZBQOSA-N -1 1 347.842 4.218 20 0 EIADMM CC1(c2cccc(Cl)c2)CCN(C(=O)c2ccc([O-])c(F)c2)CC1 ZINC000684528411 1024301365 /nfs/dbraw/zinc/30/13/65/1024301365.db2.gz KGFBQJBJSUBZOB-UHFFFAOYSA-N -1 1 347.817 4.379 20 0 EIADMM CCOc1cc(-c2nc([C@@H]3CCCCS3)no2)cc(Cl)c1[O-] ZINC000276953851 1024824855 /nfs/dbraw/zinc/82/48/55/1024824855.db2.gz QXPRYURIQIDBBE-LBPRGKRZSA-N -1 1 340.832 4.453 20 0 EIADMM CC[C@@]1(C)CCN(Cc2csc(-c3ccc(C(=O)[O-])cc3)n2)C1 ZINC000652431869 1024828854 /nfs/dbraw/zinc/82/88/54/1024828854.db2.gz SCLAQRCIMKQUIQ-SFHVURJKSA-N -1 1 330.453 4.130 20 0 EIADMM O=C(NCCc1cccc(-c2ccccc2)c1)c1cccc([O-])c1F ZINC001167787307 1024868196 /nfs/dbraw/zinc/86/81/96/1024868196.db2.gz ILEURCPRTGAIRM-UHFFFAOYSA-N -1 1 335.378 4.171 20 0 EIADMM O=C([O-])CC[C@@H]1CCCN(Cc2ccc(Cl)c(C(F)(F)F)c2)C1 ZINC000662211535 1024961936 /nfs/dbraw/zinc/96/19/36/1024961936.db2.gz QFZOHHISHIRUCW-NSHDSACASA-N -1 1 349.780 4.436 20 0 EIADMM CCSc1nnc([N-]C(=O)c2csc(-c3ccccc3)n2)s1 ZINC000008061083 1024997152 /nfs/dbraw/zinc/99/71/52/1024997152.db2.gz KGYIJJITFOGHCI-UHFFFAOYSA-N -1 1 348.478 4.026 20 0 EIADMM CSc1ccc([N-]S(=O)(=O)c2ccc(C(F)(F)F)cc2)cc1 ZINC000007745952 1025449992 /nfs/dbraw/zinc/44/99/92/1025449992.db2.gz HDLYTJKLSIIRMM-UHFFFAOYSA-N -1 1 347.383 4.228 20 0 EIADMM CSc1ccc([O-])c(-c2nc(-c3ccc4c(n3)CCCC4)no2)c1 ZINC000664800443 1025835538 /nfs/dbraw/zinc/83/55/38/1025835538.db2.gz WLELLFFKEPBCEQ-UHFFFAOYSA-N -1 1 339.420 4.105 20 0 EIADMM CCc1nc(CNCc2ccc(-c3ccccc3)cc2)ccc1C(=O)[O-] ZINC000426651840 1025850049 /nfs/dbraw/zinc/85/00/49/1025850049.db2.gz PLAMUXWJDRQTTL-UHFFFAOYSA-N -1 1 346.430 4.299 20 0 EIADMM O=S(=O)([N-]c1ccc(Cl)cc1F)c1cccc(Cl)c1F ZINC000048653026 1026031267 /nfs/dbraw/zinc/03/12/67/1026031267.db2.gz NRAFMVFBBQZDSC-UHFFFAOYSA-N -1 1 338.162 4.072 20 0 EIADMM COc1ccc2cc(C(=O)Nc3ccc([O-])c(Cl)c3)c(C)nc2c1 ZINC000111667834 1026314471 /nfs/dbraw/zinc/31/44/71/1026314471.db2.gz PLHNXOTWZLWFEP-UHFFFAOYSA-N -1 1 342.782 4.163 20 0 EIADMM Cc1c(C(=O)Nc2ccc([O-])c(Cl)c2)cnn1C1CCCCC1 ZINC000512191347 1026333644 /nfs/dbraw/zinc/33/36/44/1026333644.db2.gz JZOXRMPJBSXXJE-UHFFFAOYSA-N -1 1 333.819 4.308 20 0 EIADMM C[C@H](NC(=O)c1c(F)ccc([O-])c1F)c1ccc(Cl)cc1Cl ZINC000684828761 1026479352 /nfs/dbraw/zinc/47/93/52/1026479352.db2.gz WSOBACVTKWSLFS-ZETCQYMHSA-N -1 1 346.160 4.468 20 0 EIADMM O=C([O-])[C@@H](NCc1ccc(Cl)cc1Cl)c1cccc(F)c1 ZINC000426805857 1026561219 /nfs/dbraw/zinc/56/12/19/1026561219.db2.gz GKORRKHVTSPGIS-AWEZNQCLSA-N -1 1 328.170 4.048 20 0 EIADMM O=C([O-])[C@H](NCc1cccc(Cl)c1Cl)c1cccc(F)c1 ZINC000426804888 1026571329 /nfs/dbraw/zinc/57/13/29/1026571329.db2.gz WZENMADCEYJRDM-CQSZACIVSA-N -1 1 328.170 4.048 20 0 EIADMM O=C([O-])C[C@H](NCc1cc(Cl)ccc1F)c1cccc(Cl)c1 ZINC000426804247 1026571406 /nfs/dbraw/zinc/57/14/06/1026571406.db2.gz SOHYPIIIECYFCY-HNNXBMFYSA-N -1 1 342.197 4.438 20 0 EIADMM O=C([O-])[C@H](NCc1ccc(-c2ccccc2)s1)c1cccs1 ZINC000426804306 1026571725 /nfs/dbraw/zinc/57/17/25/1026571725.db2.gz SZIBROHIAXVBJD-MRXNPFEDSA-N -1 1 329.446 4.392 20 0 EIADMM O=C([O-])C[C@H](NCc1cc(F)c(F)c(F)c1)c1cccc(Cl)c1 ZINC000426829440 1026572382 /nfs/dbraw/zinc/57/23/82/1026572382.db2.gz PHSHQSNCHBHGNA-AWEZNQCLSA-N -1 1 343.732 4.063 20 0 EIADMM O=C([O-])C[C@H](NCc1cc(Cl)ccc1Cl)c1cccs1 ZINC000236423368 1026574035 /nfs/dbraw/zinc/57/40/35/1026574035.db2.gz WICYKHXNSSZCFN-LBPRGKRZSA-N -1 1 330.236 4.361 20 0 EIADMM COc1cc(C)c(CN(C)Cc2cccc([O-])c2Cl)cc1OC ZINC000507022908 1026600139 /nfs/dbraw/zinc/60/01/39/1026600139.db2.gz VHGCDKPSTWEWKG-UHFFFAOYSA-N -1 1 335.831 4.003 20 0 EIADMM Cc1cc(N(C)C)ccc1NC(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684871752 1026631170 /nfs/dbraw/zinc/63/11/70/1026631170.db2.gz QNSAYLCNNNQAJU-UHFFFAOYSA-N -1 1 338.329 4.038 20 0 EIADMM C[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684875494 1026650977 /nfs/dbraw/zinc/65/09/77/1026650977.db2.gz GXYDVGDLIBWEFD-JTNHKYCSSA-N -1 1 327.346 4.204 20 0 EIADMM C[C@@H]1CN(C(=O)c2ccc(C(F)(F)F)c([O-])c2)[C@@H]1c1ccccc1 ZINC000684876073 1026651937 /nfs/dbraw/zinc/65/19/37/1026651937.db2.gz PKOKXQWDUNQZTF-BZNIZROVSA-N -1 1 335.325 4.244 20 0 EIADMM O=C(c1ccc(C(F)(F)F)c([O-])c1)N1CCc2c1cccc2Cl ZINC000684876099 1026652722 /nfs/dbraw/zinc/65/27/22/1026652722.db2.gz UDJMPDKCFOXEFE-UHFFFAOYSA-N -1 1 341.716 4.267 20 0 EIADMM CSc1c(F)cccc1[N-]C(=O)c1cnc([C@@H]2CCCO2)s1 ZINC000617274743 1026706923 /nfs/dbraw/zinc/70/69/23/1026706923.db2.gz HPFHKAWOBGKKIA-NSHDSACASA-N -1 1 338.429 4.108 20 0 EIADMM Cc1cc2cc([N-]S(=O)(=O)c3cccc(C(F)F)c3)ccc2[nH]1 ZINC000780376695 1026712826 /nfs/dbraw/zinc/71/28/26/1026712826.db2.gz KTDBEPMDESMUDW-UHFFFAOYSA-N -1 1 336.363 4.215 20 0 EIADMM CCc1cc(=O)[n-]c(S[C@H](C)c2ccc(OC(F)(F)F)cc2)n1 ZINC000188090172 1027075605 /nfs/dbraw/zinc/07/56/05/1027075605.db2.gz VRRZWLTWDNLJNT-SECBINFHSA-N -1 1 344.358 4.084 20 0 EIADMM O=S(=O)([N-]c1cccc2ccc(O)cc21)c1cccc(C(F)F)c1 ZINC000780396143 1027428775 /nfs/dbraw/zinc/42/87/75/1027428775.db2.gz ZDQWFTJUHVOKNY-UHFFFAOYSA-N -1 1 349.358 4.284 20 0 EIADMM Cc1cc(CN(C)C(=O)c2ccc(C(F)(F)F)cc2[O-])ccc1F ZINC000444425629 1027536269 /nfs/dbraw/zinc/53/62/69/1027536269.db2.gz UYEBRLTWMQBGJE-UHFFFAOYSA-N -1 1 341.304 4.131 20 0 EIADMM O=C([N-]c1cc(F)cc(F)c1F)c1nc(-c2ccccc2)cs1 ZINC000582956755 1027768464 /nfs/dbraw/zinc/76/84/64/1027768464.db2.gz TZRCPLZYSMJSNM-UHFFFAOYSA-N -1 1 334.322 4.480 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1cccn1Cc1ccccc1 ZINC000126116556 1027887197 /nfs/dbraw/zinc/88/71/97/1027887197.db2.gz OMNYUJXJZOIICP-UHFFFAOYSA-N -1 1 326.783 4.148 20 0 EIADMM Cc1ccnc(C)c1[N-]S(=O)(=O)c1c(C)c(C)c(C)c(C)c1C ZINC000331247263 1027945989 /nfs/dbraw/zinc/94/59/89/1027945989.db2.gz VGVPIQUPPICLKW-UHFFFAOYSA-N -1 1 332.469 4.041 20 0 EIADMM Cc1ncc(-c2ccc([N-]S(=O)(=O)c3ccc(Cl)cc3)cc2)o1 ZINC000029433137 1028198457 /nfs/dbraw/zinc/19/84/57/1028198457.db2.gz RNDIXODNOUQLSE-UHFFFAOYSA-N -1 1 348.811 4.104 20 0 EIADMM CCOc1cc(-c2noc(/C=C\c3cccnc3)n2)cc(Cl)c1[O-] ZINC000445427073 1028526827 /nfs/dbraw/zinc/52/68/27/1028526827.db2.gz NNVRKAOSGVFASL-WAYWQWQTSA-N -1 1 343.770 4.060 20 0 EIADMM [O-]c1ccc(-c2noc(C/C=C/c3ccccc3F)n2)c(Cl)c1 ZINC000445450841 1028540692 /nfs/dbraw/zinc/54/06/92/1028540692.db2.gz XIUWZPZMZOLELS-HWKANZROSA-N -1 1 330.746 4.491 20 0 EIADMM C[C@H](Oc1ccc(F)cc1)c1nc(-c2ccc([O-])cc2Cl)no1 ZINC000445450787 1028541795 /nfs/dbraw/zinc/54/17/95/1028541795.db2.gz WQKOKTUENPAZSH-VIFPVBQESA-N -1 1 334.734 4.375 20 0 EIADMM [O-]c1ccc(-c2noc(C3(Cc4ccccc4)CC3)n2)c(Cl)c1 ZINC000445451116 1028543421 /nfs/dbraw/zinc/54/34/21/1028543421.db2.gz AQQVKVGYYKPRME-UHFFFAOYSA-N -1 1 326.783 4.370 20 0 EIADMM COc1ccc(S[C@H](C)c2nc(-c3ccc([O-])cc3F)no2)cc1 ZINC000445464470 1028581672 /nfs/dbraw/zinc/58/16/72/1028581672.db2.gz TYIWGHIBVCMOJY-SNVBAGLBSA-N -1 1 346.383 4.443 20 0 EIADMM CC[C@H](Oc1cccc(C)c1)c1nc(-c2ccc([O-])cc2F)no1 ZINC000445455804 1028606377 /nfs/dbraw/zinc/60/63/77/1028606377.db2.gz GKRAKNHMLLKMIW-INIZCTEOSA-N -1 1 328.343 4.420 20 0 EIADMM [O-]c1ccc(-c2noc(Cc3ccc(C(F)(F)F)cc3)n2)c(F)c1 ZINC000445455515 1028610834 /nfs/dbraw/zinc/61/08/34/1028610834.db2.gz KWTISTBRBFYOOL-UHFFFAOYSA-N -1 1 338.260 4.191 20 0 EIADMM Cc1nc(C(C)(C)C)sc1-c1nc(-c2ccc([O-])cc2F)no1 ZINC000445455935 1028610854 /nfs/dbraw/zinc/61/08/54/1028610854.db2.gz GZALHFMEOKKPDI-UHFFFAOYSA-N -1 1 333.388 4.311 20 0 EIADMM [O-]c1ccc(-c2noc([C@H]3C[C@@H]3c3c(F)cccc3F)n2)c(F)c1 ZINC000445457017 1028612824 /nfs/dbraw/zinc/61/28/24/1028612824.db2.gz QHNWLHGTUWOKOE-QWRGUYRKSA-N -1 1 332.281 4.131 20 0 EIADMM CC[C@H](Oc1ccccc1C)c1nc(-c2ccc([O-])cc2F)no1 ZINC000445459204 1028615040 /nfs/dbraw/zinc/61/50/40/1028615040.db2.gz YLWGKXPTWBUNLL-HNNXBMFYSA-N -1 1 328.343 4.420 20 0 EIADMM Cc1nc(CC(C)C)sc1-c1nc(-c2ccc([O-])cc2F)no1 ZINC000445461041 1028619513 /nfs/dbraw/zinc/61/95/13/1028619513.db2.gz FACAVMCASIGUDS-UHFFFAOYSA-N -1 1 333.388 4.212 20 0 EIADMM [O-]c1ccc(-c2noc(/C=C\c3nc4ccccc4s3)n2)cc1F ZINC000445477834 1028621879 /nfs/dbraw/zinc/62/18/79/1028621879.db2.gz DUQUYACKEKXRGA-FPLPWBNLSA-N -1 1 339.351 4.361 20 0 EIADMM C[C@@H](CCOc1ccccc1)c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445477531 1028623853 /nfs/dbraw/zinc/62/38/53/1028623853.db2.gz CPYXZZADRYONFS-LBPRGKRZSA-N -1 1 328.343 4.154 20 0 EIADMM C[C@@H](Oc1ccccc1Cl)c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445478434 1028624604 /nfs/dbraw/zinc/62/46/04/1028624604.db2.gz HADJJNDFMLGZKR-SECBINFHSA-N -1 1 334.734 4.375 20 0 EIADMM [O-]c1ccc(-c2noc(-c3csc(-c4ccccc4)n3)n2)cc1F ZINC000445477207 1028625414 /nfs/dbraw/zinc/62/54/14/1028625414.db2.gz MREZPUPXJJSVSD-UHFFFAOYSA-N -1 1 339.351 4.372 20 0 EIADMM [O-]c1ccc(-c2noc(/C=C\c3ccc(OC(F)F)cc3)n2)cc1F ZINC000445478445 1028625453 /nfs/dbraw/zinc/62/54/53/1028625453.db2.gz HCOAYJWHDYSSMA-BAQGIRSFSA-N -1 1 348.280 4.353 20 0 EIADMM [O-]c1ccc(-c2noc(C3=Cc4cc(Cl)ccc4OC3)n2)cc1F ZINC000445480746 1028627032 /nfs/dbraw/zinc/62/70/32/1028627032.db2.gz IWYOXCRUUXRRRI-UHFFFAOYSA-N -1 1 344.729 4.168 20 0 EIADMM Cc1cc(C)c(C)c(OCCc2nc(-c3ccc([O-])c(F)c3)no2)c1 ZINC000445480090 1028627570 /nfs/dbraw/zinc/62/75/70/1028627570.db2.gz KXRZLWPAKBJCPA-UHFFFAOYSA-N -1 1 342.370 4.128 20 0 EIADMM COc1ccccc1CC(C)(C)c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445481029 1028630805 /nfs/dbraw/zinc/63/08/05/1028630805.db2.gz NHDABMJDPYIYHX-UHFFFAOYSA-N -1 1 342.370 4.110 20 0 EIADMM COc1cc(-c2nc(C(C)(C)c3ccccc3)no2)cc(Cl)c1[O-] ZINC000445481305 1028631149 /nfs/dbraw/zinc/63/11/49/1028631149.db2.gz HWHCTTAZWBPJHJ-UHFFFAOYSA-N -1 1 344.798 4.430 20 0 EIADMM [O-]c1ccc(-c2noc([C@H]3C[C@H]3c3c(F)cccc3F)n2)cc1F ZINC000445474186 1028645773 /nfs/dbraw/zinc/64/57/73/1028645773.db2.gz XIIZUXQRNSYOIC-ZJUUUORDSA-N -1 1 332.281 4.131 20 0 EIADMM Cc1ccc(Br)c(-c2nc(-c3ccc([O-])c(F)c3)no2)c1 ZINC000445476570 1028648338 /nfs/dbraw/zinc/64/83/38/1028648338.db2.gz DZASTWRHKUSRIZ-UHFFFAOYSA-N -1 1 349.159 4.319 20 0 EIADMM Cc1nc2sccn2c1-c1noc(-c2ccc3ccccc3c2[O-])n1 ZINC000445641582 1028810224 /nfs/dbraw/zinc/81/02/24/1028810224.db2.gz YSYHLBKWFYWRJA-UHFFFAOYSA-N -1 1 348.387 4.280 20 0 EIADMM CCC(=O)Nc1ccc(NC(=O)c2ccc3ccccc3c2[O-])cc1 ZINC000192636052 1028860349 /nfs/dbraw/zinc/86/03/49/1028860349.db2.gz JANLBUJPVFXWEF-UHFFFAOYSA-N -1 1 334.375 4.146 20 0 EIADMM Cc1csc(C(=O)Nc2ccc([O-])c(Cl)c2)c1Br ZINC000192034545 1028940409 /nfs/dbraw/zinc/94/04/09/1028940409.db2.gz XKCKUXXEBFOBJU-UHFFFAOYSA-N -1 1 346.633 4.430 20 0 EIADMM CCC1(CC)[C@H]([N@@H+](C)Cc2cccc(C(=O)[O-])c2Cl)C[C@@H]1OC ZINC000583877687 1029313511 /nfs/dbraw/zinc/31/35/11/1029313511.db2.gz VHBVXGZHTDHYCV-CABCVRRESA-N -1 1 339.863 4.064 20 0 EIADMM O=S(=O)([N-]c1ccc(CC(F)(F)F)cc1)c1ccc(Cl)cc1 ZINC000525017722 1029391907 /nfs/dbraw/zinc/39/19/07/1029391907.db2.gz HUXYKVVDAMIRCK-UHFFFAOYSA-N -1 1 349.761 4.246 20 0 EIADMM CCSCc1cccc([N-]S(=O)(=O)c2cccc(Cl)c2)c1 ZINC000525012021 1029400875 /nfs/dbraw/zinc/40/08/75/1029400875.db2.gz QVIAPKTXEDXZKB-UHFFFAOYSA-N -1 1 341.885 4.394 20 0 EIADMM CN(Cc1nc(=O)c2sccc2[n-]1)[C@H]1CCc2ccc(Cl)cc21 ZINC000343627967 1029613818 /nfs/dbraw/zinc/61/38/18/1029613818.db2.gz GZSQIGOGBBXXSA-AWEZNQCLSA-N -1 1 345.855 4.170 20 0 EIADMM Cc1ccc(F)c(S(=O)(=O)[N-]c2c(C)c(C)ccc2Cl)c1 ZINC000446946313 1029648822 /nfs/dbraw/zinc/64/88/22/1029648822.db2.gz PRVYFFPOMQMAPD-UHFFFAOYSA-N -1 1 327.808 4.205 20 0 EIADMM CC(C)[C@@H]1CN([C@H](C(=O)[O-])c2ccc(Cl)cc2Cl)CCS1 ZINC000565107282 1029650744 /nfs/dbraw/zinc/65/07/44/1029650744.db2.gz UWKJFFZYGVIZLD-KBPBESRZSA-N -1 1 348.295 4.193 20 0 EIADMM CC[C@@H]1CCC[C@H](Nc2ccc(-c3nc(C)c(C)c(=O)[n-]3)cn2)C1 ZINC000301393947 1029725253 /nfs/dbraw/zinc/72/52/53/1029725253.db2.gz JYAXTUPWBRPQDV-ZBFHGGJFSA-N -1 1 326.444 4.242 20 0 EIADMM Cc1nc(-c2ccc(N[C@@H]3C[C@H]3C3CCCCC3)nc2)[n-]c(=O)c1C ZINC000301429890 1029732180 /nfs/dbraw/zinc/73/21/80/1029732180.db2.gz QDAJWGYTGUBIRW-DLBZAZTESA-N -1 1 338.455 4.242 20 0 EIADMM Cc1nc(-c2ccc(NC3CCC(C)(C)CC3)nc2)[n-]c(=O)c1C ZINC000301448313 1029734888 /nfs/dbraw/zinc/73/48/88/1029734888.db2.gz WHFHUCUISGKOPE-UHFFFAOYSA-N -1 1 326.444 4.242 20 0 EIADMM COC[C@@H]([N-]c1nc(C(C)C)no1)c1cccc(C(F)(F)F)c1 ZINC000301736835 1029801462 /nfs/dbraw/zinc/80/14/62/1029801462.db2.gz BPRARBBZMXKAAU-GFCCVEGCSA-N -1 1 329.322 4.011 20 0 EIADMM CC1(C)[C@H](c2cccc(F)c2)CCN1C(=O)c1ccc([O-])c(F)c1 ZINC000530035527 1030060076 /nfs/dbraw/zinc/06/00/76/1030060076.db2.gz BGHGFBDJQMXTLM-HNNXBMFYSA-N -1 1 331.362 4.079 20 0 EIADMM CC1(C)CCc2cccc(NC(=O)c3c(F)ccc([O-])c3F)c2O1 ZINC000530041194 1030079698 /nfs/dbraw/zinc/07/96/98/1030079698.db2.gz AXANJERVZGBFKL-UHFFFAOYSA-N -1 1 333.334 4.026 20 0 EIADMM CC(=O)CCCCCSc1nc(-c2ccccc2)c(C)c(=O)[n-]1 ZINC000450901224 1030103349 /nfs/dbraw/zinc/10/33/49/1030103349.db2.gz HYIMZGFQUXGDLD-UHFFFAOYSA-N -1 1 330.453 4.399 20 0 EIADMM COc1cc(C(=O)N[C@@H]2CC[C@@H]3CCCC[C@H]3C2)cc(Cl)c1[O-] ZINC000525953757 1030120648 /nfs/dbraw/zinc/12/06/48/1030120648.db2.gz SNWNINXHEUFWBW-SGMGOOAPSA-N -1 1 337.847 4.143 20 0 EIADMM O=C(CCSc1ccccc1Cl)Nc1ccc(F)cc1[O-] ZINC000536219926 1030141922 /nfs/dbraw/zinc/14/19/22/1030141922.db2.gz KUBPQRCUBLEOBI-UHFFFAOYSA-N -1 1 325.792 4.306 20 0 EIADMM CCc1cccc(S(=O)(=O)[N-]c2ccccc2C(C)(F)F)c1 ZINC000451090957 1030230275 /nfs/dbraw/zinc/23/02/75/1030230275.db2.gz VPOBGAKFQPJPKN-UHFFFAOYSA-N -1 1 325.380 4.162 20 0 EIADMM O=C(Nc1cccc(CC(F)(F)F)c1)c1c(F)ccc([O-])c1F ZINC000685442038 1030321018 /nfs/dbraw/zinc/32/10/18/1030321018.db2.gz LRNMNGZFMNZAOA-UHFFFAOYSA-N -1 1 331.240 4.028 20 0 EIADMM Cn1ccnc1-c1cccc(NC(=O)Nc2ccc([O-])c(Cl)c2)c1 ZINC000190961311 1030590997 /nfs/dbraw/zinc/59/09/97/1030590997.db2.gz BZUHWYJTGMYIGP-UHFFFAOYSA-N -1 1 342.786 4.090 20 0 EIADMM Cc1ccccc1[C@@H](CC(F)(F)F)NCc1cccc(C(=O)[O-])c1 ZINC000263394411 1030848208 /nfs/dbraw/zinc/84/82/08/1030848208.db2.gz GDMDZYLTHXPNJA-MRXNPFEDSA-N -1 1 337.341 4.477 20 0 EIADMM Cc1noc(-c2ccccc2)c1[N-]C(=O)c1scnc1C1CC1 ZINC000122636362 1030918946 /nfs/dbraw/zinc/91/89/46/1030918946.db2.gz UIQDYRLLFNSRQN-UHFFFAOYSA-N -1 1 325.393 4.236 20 0 EIADMM COc1ccc(S(=O)(=O)[N-]c2ccc(Cl)cc2)c2ccccc12 ZINC000035685429 1031002176 /nfs/dbraw/zinc/00/21/76/1031002176.db2.gz NIXPOYVHIYURNZ-UHFFFAOYSA-N -1 1 347.823 4.303 20 0 EIADMM C[C@@H]([N@@H+](C)Cc1ccc(C(=O)[O-])cc1Br)C(C)(C)C ZINC000226726235 1031104918 /nfs/dbraw/zinc/10/49/18/1031104918.db2.gz CMVLNYMPZWCIBJ-SNVBAGLBSA-N -1 1 328.250 4.014 20 0 EIADMM CO[C@H](CC(=O)Nc1cc(Cl)c([O-])c2ccccc12)C(F)(F)F ZINC000628233765 1031264561 /nfs/dbraw/zinc/26/45/61/1031264561.db2.gz UDXUGWIFVROHQU-GFCCVEGCSA-N -1 1 347.720 4.105 20 0 EIADMM O=C(Cc1coc(-c2ccc(F)cc2)n1)Nc1ccc([O-])c(Cl)c1 ZINC000113461004 1031361871 /nfs/dbraw/zinc/36/18/71/1031361871.db2.gz FTJVFEHIOLKQHQ-UHFFFAOYSA-N -1 1 346.745 4.021 20 0 EIADMM O=C(Nc1ccc(F)cc1[O-])c1ccc(-n2cnc3ccccc32)cc1 ZINC000531756254 1031534991 /nfs/dbraw/zinc/53/49/91/1031534991.db2.gz BPFXCCAIYOUMKB-UHFFFAOYSA-N -1 1 347.349 4.123 20 0 EIADMM O=S(=O)([N-]c1ccc(Cl)c(F)c1)c1ccc2ccccc2c1 ZINC000614829251 1031804881 /nfs/dbraw/zinc/80/48/81/1031804881.db2.gz LYSQBVZXQUWOOU-UHFFFAOYSA-N -1 1 335.787 4.433 20 0 EIADMM Cc1cc(Br)c([O-])c(NC(=O)C[C@H](C)c2ccco2)c1 ZINC000528980258 1031994782 /nfs/dbraw/zinc/99/47/82/1031994782.db2.gz UJTPNPVPUFFSHY-JTQLQIEISA-N -1 1 338.201 4.188 20 0 EIADMM Cc1ccc(C)c(S(=O)(=O)[N-]c2cc(-c3ncco3)ccc2C)c1 ZINC000134683096 1032007247 /nfs/dbraw/zinc/00/72/47/1032007247.db2.gz GTRLUDYXOOJGTJ-UHFFFAOYSA-N -1 1 342.420 4.068 20 0 EIADMM CCc1cc(=O)[n-]c(SCCc2cccc(Cl)c2Cl)n1 ZINC000433019066 1033666868 /nfs/dbraw/zinc/66/68/68/1033666868.db2.gz KZLGMHSGOCAUMA-UHFFFAOYSA-N -1 1 329.252 4.386 20 0 EIADMM CCN(C(=O)c1cc(Br)ccc1[O-])[C@@H]1CCCC[C@H]1C ZINC001143552875 1033787054 /nfs/dbraw/zinc/78/70/54/1033787054.db2.gz GHAMQURGSXAQQK-BXUZGUMPSA-N -1 1 340.261 4.196 20 0 EIADMM CC1(C)CC[C@@H]1[N-]S(=O)(=O)c1sc2ccccc2c1Cl ZINC001211799787 1033953267 /nfs/dbraw/zinc/95/32/67/1033953267.db2.gz SZWVURHVSPDPBN-NSHDSACASA-N -1 1 329.874 4.022 20 0 EIADMM COC[C@@H](NCc1cccc([O-])c1Cl)c1cccc(Cl)c1 ZINC000645181838 1033992280 /nfs/dbraw/zinc/99/22/80/1033992280.db2.gz UOQPVXRTHTVHIK-CQSZACIVSA-N -1 1 326.223 4.176 20 0 EIADMM CCc1cccc(S(=O)(=O)[N-]c2cccc(CC(F)(F)F)c2)c1 ZINC000433528121 1034637962 /nfs/dbraw/zinc/63/79/62/1034637962.db2.gz LCPFSZXKYSTHDQ-UHFFFAOYSA-N -1 1 343.370 4.155 20 0 EIADMM CCCc1ccc(S(=O)(=O)[N-]c2cccc(C(=O)CC)c2)cc1 ZINC000433598843 1034837948 /nfs/dbraw/zinc/83/79/48/1034837948.db2.gz IFBSUHFVVZQZJC-UHFFFAOYSA-N -1 1 331.437 4.033 20 0 EIADMM Cc1[n-][nH]c(=O)c1NC(=O)c1ccc(C)cc1Sc1ccccc1 ZINC000647815549 1034957123 /nfs/dbraw/zinc/95/71/23/1034957123.db2.gz BBTCJROITUTYHL-UHFFFAOYSA-N -1 1 339.420 4.136 20 0 EIADMM CCOc1cc(-c2noc(-c3cc(C4CC4)no3)n2)cc(Cl)c1[O-] ZINC000420490650 1035637740 /nfs/dbraw/zinc/63/77/40/1035637740.db2.gz DXSPBFIUERNNLB-UHFFFAOYSA-N -1 1 347.758 4.027 20 0 EIADMM O=C([N-]c1cnoc1)c1nc(-c2ccccc2)oc1-c1ccccc1 ZINC000595947997 1035809222 /nfs/dbraw/zinc/80/92/22/1035809222.db2.gz XLCUZAUXHHRXMT-UHFFFAOYSA-N -1 1 331.331 4.249 20 0 EIADMM Cc1ccc(F)c([N-]S(=O)(=O)c2ccc(Cl)cc2Cl)c1 ZINC000485392436 1035854923 /nfs/dbraw/zinc/85/49/23/1035854923.db2.gz GTTCQXHEMJJTEL-UHFFFAOYSA-N -1 1 334.199 4.242 20 0 EIADMM COc1ccccc1CN(C(=O)c1cc2ccccc2cc1[O-])C1CC1 ZINC000195700778 1035882728 /nfs/dbraw/zinc/88/27/28/1035882728.db2.gz KTAJXROAFBENQR-UHFFFAOYSA-N -1 1 347.414 4.359 20 0 EIADMM COc1cc([C@@H](C)NCc2cc(C(=O)[O-])oc2C)cc2ccccc21 ZINC000905798666 1035896548 /nfs/dbraw/zinc/89/65/48/1035896548.db2.gz IVQGJQMRQRCIMB-GFCCVEGCSA-N -1 1 339.391 4.299 20 0 EIADMM CCCCN(Cc1csc(-c2cccc(C(=O)[O-])c2)n1)C1CC1 ZINC000571096428 1035942778 /nfs/dbraw/zinc/94/27/78/1035942778.db2.gz CEQWJOZRVZYJRW-UHFFFAOYSA-N -1 1 330.453 4.273 20 0 EIADMM [O-]c1c(Cl)cc(CN2C[C@@H]3CCC[C@H]3C2)cc1Br ZINC001231746517 1036062164 /nfs/dbraw/zinc/06/21/64/1036062164.db2.gz VWNNMUNLABMTIT-QWRGUYRKSA-N -1 1 330.653 4.040 20 0 EIADMM Cc1cnc(C(=O)N2CCCCC[C@@H]2/C=C\c2ccccc2)c([O-])c1 ZINC000460127399 1036093221 /nfs/dbraw/zinc/09/32/21/1036093221.db2.gz MCQQORBQOAHKGY-YUIUBULTSA-N -1 1 336.435 4.194 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2cccc3[nH]ccc32)ccc1OC(C)C ZINC000588633656 1036385520 /nfs/dbraw/zinc/38/55/20/1036385520.db2.gz JKOAKVLLAFQGIS-UHFFFAOYSA-N -1 1 344.436 4.064 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc(C(=O)C3CCC3)cc2)c(C)c1 ZINC000486090652 1036478667 /nfs/dbraw/zinc/47/86/67/1036478667.db2.gz VAPBKYFHDRJERZ-UHFFFAOYSA-N -1 1 343.448 4.087 20 0 EIADMM CC(C)c1ccc(C(=O)Nc2cnc3c(cnn3C(C)C)c2)c([O-])c1 ZINC000588923925 1036597846 /nfs/dbraw/zinc/59/78/46/1036597846.db2.gz RHCWTTKJTGHZFI-UHFFFAOYSA-N -1 1 338.411 4.094 20 0 EIADMM CC(NC(=O)c1ccc([O-])cc1F)(c1ccccc1)c1ccccc1 ZINC000436878895 1036688273 /nfs/dbraw/zinc/68/82/73/1036688273.db2.gz FCZHJZQNMSVPHC-UHFFFAOYSA-N -1 1 335.378 4.225 20 0 EIADMM CC(C)c1ccc(S(=O)(=O)[N-]c2cccc(-c3cn[nH]c3)c2)cc1 ZINC000761288529 1036791575 /nfs/dbraw/zinc/79/15/75/1036791575.db2.gz PVHADXYLMHBTHW-UHFFFAOYSA-N -1 1 341.436 4.001 20 0 EIADMM CC1(C(=O)Nc2cccc([O-])c2Br)CCC(F)(F)CC1 ZINC000908717788 1036927430 /nfs/dbraw/zinc/92/74/30/1036927430.db2.gz OIGZZSRXWSDSQH-UHFFFAOYSA-N -1 1 348.187 4.309 20 0 EIADMM Cc1nc(C(C)C)ccc1C(=O)Nc1cccc([O-])c1Br ZINC000908707538 1036920130 /nfs/dbraw/zinc/92/01/30/1036920130.db2.gz KOANIYUILUFDMR-UHFFFAOYSA-N -1 1 349.228 4.234 20 0 EIADMM COc1c(Cl)cccc1[N-]S(=O)(=O)C1=Cc2ccccc2CC1 ZINC000057123443 1036920701 /nfs/dbraw/zinc/92/07/01/1036920701.db2.gz YPWINNRFNRUYHR-UHFFFAOYSA-N -1 1 349.839 4.078 20 0 EIADMM CCc1nc(SCc2csc(CCC(C)C)n2)[n-]c(=O)c1C ZINC000573267272 1037458030 /nfs/dbraw/zinc/45/80/30/1037458030.db2.gz CXOBLGJQRRZVOV-UHFFFAOYSA-N -1 1 337.514 4.390 20 0 EIADMM CC(C)C(=O)c1ccc([C@H](C)C(=O)Nc2cc(F)cc(F)c2[O-])cc1 ZINC000910985980 1037595776 /nfs/dbraw/zinc/59/57/76/1037595776.db2.gz DJWLIIMQNRPVIU-NSHDSACASA-N -1 1 347.361 4.251 20 0 EIADMM O=C(CCCc1ncc(-c2ccccc2)o1)Nc1c([O-])cccc1F ZINC000605435535 1037788411 /nfs/dbraw/zinc/78/84/11/1037788411.db2.gz GXGFTVNLSYGSSS-UHFFFAOYSA-N -1 1 340.354 4.148 20 0 EIADMM C[C@H](Sc1ccccc1Cl)C(=O)Nc1c([O-])cccc1F ZINC000605440560 1037791567 /nfs/dbraw/zinc/79/15/67/1037791567.db2.gz VGIGUFGDJBWUSS-VIFPVBQESA-N -1 1 325.792 4.304 20 0 EIADMM CCc1cccc(CC)c1S(=O)(=O)[N-]c1cccc([C@@H](C)OC)c1 ZINC000605496044 1037823288 /nfs/dbraw/zinc/82/32/88/1037823288.db2.gz WPOQCYFMVSGMRH-CQSZACIVSA-N -1 1 347.480 4.320 20 0 EIADMM Cc1cccc(C2=CCN(Cc3ccc(C(=O)[O-])cc3F)CC2)c1 ZINC000574577682 1038298832 /nfs/dbraw/zinc/29/88/32/1038298832.db2.gz DGFRIEXWGJWXAV-UHFFFAOYSA-N -1 1 325.383 4.122 20 0 EIADMM CCCc1ccc(S(=O)(=O)[N-]c2ccccc2C(F)F)cc1 ZINC000424062422 1038484323 /nfs/dbraw/zinc/48/43/23/1038484323.db2.gz HCJDOMWSDJYTRQ-UHFFFAOYSA-N -1 1 325.380 4.378 20 0 EIADMM O=C([O-])CC[C@H]1CCCCN1Cc1csc(-c2cccs2)n1 ZINC000424268405 1038763952 /nfs/dbraw/zinc/76/39/52/1038763952.db2.gz ZZJROZYVXKDXIH-CYBMUJFWSA-N -1 1 336.482 4.091 20 0 EIADMM COc1cc(C(=O)Nc2c([O-])cccc2F)ccc1OCCC(C)C ZINC000608367089 1038805034 /nfs/dbraw/zinc/80/50/34/1038805034.db2.gz UCEIXMGIXHNWEW-UHFFFAOYSA-N -1 1 347.386 4.217 20 0 EIADMM CCOc1cc(-c2noc([C@H]3CCC[C@@H](F)C3)n2)cc(Cl)c1[O-] ZINC000424355500 1038821133 /nfs/dbraw/zinc/82/11/33/1038821133.db2.gz JQYSAVSFZBROIA-GXSJLCMTSA-N -1 1 340.782 4.490 20 0 EIADMM Cc1c(F)cccc1-c1ccc(CN2CCC[C@@H](C)[C@@H]2C(=O)[O-])o1 ZINC000424417969 1038843576 /nfs/dbraw/zinc/84/35/76/1038843576.db2.gz MWZDPZJTFORSQV-KZULUSFZSA-N -1 1 331.387 4.079 20 0 EIADMM C[C@@H]1CCCN(Cc2ccc(Cl)c(C(F)(F)F)c2)[C@@H]1C(=O)[O-] ZINC000424413223 1038851164 /nfs/dbraw/zinc/85/11/64/1038851164.db2.gz FIOIPHQRILXNEW-RNCFNFMXSA-N -1 1 335.753 4.044 20 0 EIADMM CC(=O)c1cc(F)c([N-]C(=O)c2cnc(C(C)(C)C)s2)c(F)c1 ZINC000534066832 1039082926 /nfs/dbraw/zinc/08/29/26/1039082926.db2.gz YLCUKQYERBQCFQ-UHFFFAOYSA-N -1 1 338.379 4.174 20 0 EIADMM O=C(Nc1ccc([O-])c(F)c1F)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F ZINC000424863957 1039170574 /nfs/dbraw/zinc/17/05/74/1039170574.db2.gz JVMBZMAPSYJGOX-KBOCCFJNSA-N -1 1 349.299 4.224 20 0 EIADMM CCCOc1ccc(CCC(=O)Nc2ccc([O-])c(F)c2F)cc1 ZINC000456774537 1039590663 /nfs/dbraw/zinc/59/06/63/1039590663.db2.gz CHXQYRHXEYVKKJ-UHFFFAOYSA-N -1 1 335.350 4.031 20 0 EIADMM CC(C)C(=O)c1ccc([C@@H](C)C(=O)Nc2ccc([O-])c(F)c2F)cc1 ZINC000456780855 1039600015 /nfs/dbraw/zinc/60/00/15/1039600015.db2.gz IZVHJMDFWXFASG-LLVKDONJSA-N -1 1 347.361 4.251 20 0 EIADMM O=C(Nc1cccc(Cl)c1[O-])c1cn[nH]c1-c1cccc(Cl)c1 ZINC000534699553 1039707625 /nfs/dbraw/zinc/70/76/25/1039707625.db2.gz GILRESQSDFWZLY-UHFFFAOYSA-N -1 1 348.189 4.341 20 0 EIADMM CCOc1cc(C(=O)NC2(C(F)F)CCCCC2)cc(Cl)c1[O-] ZINC000552860410 1039844716 /nfs/dbraw/zinc/84/47/16/1039844716.db2.gz STGRQKKRLOHUPC-UHFFFAOYSA-N -1 1 347.789 4.142 20 0 EIADMM Cc1cc(-c2nc(=O)c3c([n-]2)sc(C)c3-c2ccc(F)cc2)no1 ZINC000479182472 1040184219 /nfs/dbraw/zinc/18/42/19/1040184219.db2.gz KNALDSTYCUUXBE-UHFFFAOYSA-N -1 1 341.367 4.475 20 0 EIADMM CCOc1cc(C(=O)N[C@@H]2CCCC[C@@H]2CC)cc(Cl)c1[O-] ZINC000567977222 1040268948 /nfs/dbraw/zinc/26/89/48/1040268948.db2.gz IFBMXIDBTNDRSS-SMDDNHRTSA-N -1 1 325.836 4.143 20 0 EIADMM CC(C)(C)c1nc(Cc2nc(-c3ccc([O-])cc3Cl)no2)cs1 ZINC000445450346 1040323410 /nfs/dbraw/zinc/32/34/10/1040323410.db2.gz SBKMYRRJEQYJEL-UHFFFAOYSA-N -1 1 349.843 4.440 20 0 EIADMM C[C@@H](Cc1cncc2ccccc21)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000553951279 1040654731 /nfs/dbraw/zinc/65/47/31/1040654731.db2.gz JRGVDTDNIWCUNP-LBPRGKRZSA-N -1 1 340.810 4.411 20 0 EIADMM [O-]c1ccc(-c2noc(C3(c4ccc(Cl)cc4)CC3)n2)c(F)c1 ZINC000445456252 1040799713 /nfs/dbraw/zinc/79/97/13/1040799713.db2.gz SZKXJVPYDWCMII-UHFFFAOYSA-N -1 1 330.746 4.315 20 0 EIADMM CCOc1cccc([N-]S(=O)(=O)c2ccccc2C(C)(C)C)c1 ZINC000460841469 1040983219 /nfs/dbraw/zinc/98/32/19/1040983219.db2.gz UPUKAKRROTYSAZ-UHFFFAOYSA-N -1 1 333.453 4.184 20 0 EIADMM Cc1ccc(-c2cnc(CSc3nc(C4CC4)cc(=O)[n-]3)o2)cc1 ZINC000436245957 1040993410 /nfs/dbraw/zinc/99/34/10/1040993410.db2.gz OJVMBZDGDDBEKZ-UHFFFAOYSA-N -1 1 339.420 4.315 20 0 EIADMM Cc1nc(-c2ccc(N[C@H]3C[C@H](C)C[C@H](C)C3)nc2)[n-]c(=O)c1C ZINC000462860566 1041039157 /nfs/dbraw/zinc/03/91/57/1041039157.db2.gz HOSHRBNDAQSWIV-ATCWAGBWSA-N -1 1 326.444 4.098 20 0 EIADMM CCc1ccc([N-]S(=O)(=O)c2ccc(CC(F)(F)F)cc2)cc1 ZINC000480193773 1041050722 /nfs/dbraw/zinc/05/07/22/1041050722.db2.gz DXTMZZPWELDTCY-UHFFFAOYSA-N -1 1 343.370 4.155 20 0 EIADMM CCC[C@@H](C)C[C@@H](NCc1ccc(-c2ccc(F)cc2)o1)C(=O)[O-] ZINC000904002848 1041248746 /nfs/dbraw/zinc/24/87/46/1041248746.db2.gz FTHLBEWLNBALKR-CXAGYDPISA-N -1 1 333.403 4.455 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cnc4c(F)ccc(F)c4c3)n2)cc1F ZINC000436522907 1041304461 /nfs/dbraw/zinc/30/44/61/1041304461.db2.gz YGMAGVKIGQPBOQ-UHFFFAOYSA-N -1 1 343.264 4.075 20 0 EIADMM O=C(c1cc(Cl)ccc1[O-])N1C[C@H](c2ccccc2)[C@H]2CCC[C@H]21 ZINC000436552232 1041328537 /nfs/dbraw/zinc/32/85/37/1041328537.db2.gz BLOLUPPHNZXVHU-KBAYOESNSA-N -1 1 341.838 4.454 20 0 EIADMM CCC[C@@]1(C)CCCN(C(=O)c2cc(Cl)c([O-])c(OC)c2)C1 ZINC000436539575 1041334294 /nfs/dbraw/zinc/33/42/94/1041334294.db2.gz YXSHUAXDWLPNJZ-KRWDZBQOSA-N -1 1 325.836 4.097 20 0 EIADMM Cc1c(NC(=O)c2cc(F)ccc2[O-])cccc1OCC(F)(F)F ZINC000436570021 1041346349 /nfs/dbraw/zinc/34/63/49/1041346349.db2.gz LOFQWBUSQFIPCL-UHFFFAOYSA-N -1 1 343.276 4.033 20 0 EIADMM CC[C@H]1CCCC[C@H]1c1noc(-c2cc(NC(C)=O)ccc2[O-])n1 ZINC000436596110 1041355032 /nfs/dbraw/zinc/35/50/32/1041355032.db2.gz PJBRUDKWKSUTTO-GXTWGEPZSA-N -1 1 329.400 4.084 20 0 EIADMM C[C@]1(CCc2ccccc2)CCN(C(=O)c2cc(F)ccc2[O-])C1 ZINC000436585759 1041361455 /nfs/dbraw/zinc/36/14/55/1041361455.db2.gz QOLWQFWQSBNJTD-FQEVSTJZSA-N -1 1 327.399 4.016 20 0 EIADMM O=C(C[C@H]1CCCN1C(=O)c1cc2ccccc2cc1[O-])c1ccco1 ZINC000436584122 1041361611 /nfs/dbraw/zinc/36/16/11/1041361611.db2.gz LMKKLTJAZCVWMN-MRXNPFEDSA-N -1 1 349.386 4.016 20 0 EIADMM CC[C@@H]1CN(C(=O)c2cc(F)ccc2[O-])CC[C@@H]1c1ccccc1 ZINC000436587168 1041363839 /nfs/dbraw/zinc/36/38/39/1041363839.db2.gz ODIMUCOCEKTUOM-PBHICJAKSA-N -1 1 327.399 4.187 20 0 EIADMM O=C(NCc1ncoc1-c1ccccc1)c1cc2ccccc2cc1[O-] ZINC000436590841 1041366187 /nfs/dbraw/zinc/36/61/87/1041366187.db2.gz UMSHFMSHFHAHKY-UHFFFAOYSA-N -1 1 344.370 4.130 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1CCC[C@@H](Nc2ccccc2)C1 ZINC000436611127 1041373120 /nfs/dbraw/zinc/37/31/20/1041373120.db2.gz YNRQCYSDTZRMSW-LJQANCHMSA-N -1 1 346.430 4.262 20 0 EIADMM O=C(N[C@@H](c1ccco1)c1ccccc1)c1cc(Cl)ccc1[O-] ZINC000436656423 1041397972 /nfs/dbraw/zinc/39/79/72/1041397972.db2.gz GDXCPISBDXRMFY-QGZVFWFLSA-N -1 1 327.767 4.158 20 0 EIADMM Cc1nc(SCc2coc(-c3ccc(F)c(F)c3)n2)[n-]c(=O)c1C ZINC000538515242 1041398967 /nfs/dbraw/zinc/39/89/67/1041398967.db2.gz ORYPDOQYSVFAIT-UHFFFAOYSA-N -1 1 349.362 4.025 20 0 EIADMM Cc1nc(SCc2csc(-c3cccs3)n2)[n-]c(=O)c1C ZINC000538516150 1041400217 /nfs/dbraw/zinc/40/02/17/1041400217.db2.gz KTLPVWQTVPBKII-UHFFFAOYSA-N -1 1 335.479 4.276 20 0 EIADMM O=C(C(=O)N1CCC[C@H]1c1cccc2ccccc21)c1ccc([O-])cc1 ZINC000436680230 1041418990 /nfs/dbraw/zinc/41/89/90/1041418990.db2.gz JKTARGWBTGANNB-FQEVSTJZSA-N -1 1 345.398 4.092 20 0 EIADMM COc1c(F)cc(NC(=O)c2cc3ccccc3cc2[O-])cc1F ZINC000436684648 1041421736 /nfs/dbraw/zinc/42/17/36/1041421736.db2.gz DFRKSNVPWRCFBN-UHFFFAOYSA-N -1 1 329.302 4.085 20 0 EIADMM Cc1[nH]nc(-c2ccccc2)c1NC(=O)c1ccc2ccccc2c1[O-] ZINC000436707448 1041435378 /nfs/dbraw/zinc/43/53/78/1041435378.db2.gz RXJXWZXUVSTHGO-UHFFFAOYSA-N -1 1 343.386 4.496 20 0 EIADMM C[C@H](c1ccc(F)c(F)c1)N(C)C(=O)c1ccc(Cl)cc1[O-] ZINC000436724704 1041444114 /nfs/dbraw/zinc/44/41/14/1041444114.db2.gz TYSGAXYMQMWTRJ-SECBINFHSA-N -1 1 325.742 4.157 20 0 EIADMM CC(C)[C@H](NC(=O)c1ccc([O-])cc1F)c1ccc(Cl)cc1F ZINC000436724965 1041444253 /nfs/dbraw/zinc/44/42/53/1041444253.db2.gz TXHKMHXTFDOLNQ-INIZCTEOSA-N -1 1 339.769 4.451 20 0 EIADMM CC(C)Cn1ncc(NC(=O)c2ccc(C(C)C)cc2[O-])c1C1CC1 ZINC000436740879 1041448322 /nfs/dbraw/zinc/44/83/22/1041448322.db2.gz ZYWQPWZDLRIEEC-UHFFFAOYSA-N -1 1 341.455 4.498 20 0 EIADMM C[C@H]1C[C@@H](c2ccccc2)CN1C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436752917 1041464786 /nfs/dbraw/zinc/46/47/86/1041464786.db2.gz SQOWIQXKAWKXNR-GXTWGEPZSA-N -1 1 349.352 4.429 20 0 EIADMM C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436752919 1041465187 /nfs/dbraw/zinc/46/51/87/1041465187.db2.gz SQOWIQXKAWKXNR-OCCSQVGLSA-N -1 1 349.352 4.429 20 0 EIADMM O=C(c1ccc(Br)cc1[O-])N1CCC[C@H]1c1ccccc1 ZINC000436754000 1041465212 /nfs/dbraw/zinc/46/52/12/1041465212.db2.gz GSGQLADZNLBZCA-HNNXBMFYSA-N -1 1 346.224 4.132 20 0 EIADMM COc1ccc(CN(C)C(=O)c2ccc3ccccc3c2[O-])cc1C ZINC000436776986 1041470319 /nfs/dbraw/zinc/47/03/19/1041470319.db2.gz BDDFKCCVNOCGRH-UHFFFAOYSA-N -1 1 335.403 4.135 20 0 EIADMM O=C(c1ccc(C(F)(F)F)cc1[O-])N1CCC[C@H]1C1CCCC1 ZINC000436765755 1041473669 /nfs/dbraw/zinc/47/36/69/1041473669.db2.gz YMGKSVFGRWDGQE-AWEZNQCLSA-N -1 1 327.346 4.206 20 0 EIADMM CC[C@H](NC(=O)c1ccc(C(F)(F)F)cc1[O-])c1nc(C)cs1 ZINC000436764308 1041474016 /nfs/dbraw/zinc/47/40/16/1041474016.db2.gz QDHRUURXTLAQJK-NSHDSACASA-N -1 1 344.358 4.057 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1CCN(C2CC2)c2ccccc21 ZINC000436783639 1041478597 /nfs/dbraw/zinc/47/85/97/1041478597.db2.gz SQRTVGSEVXABKV-UHFFFAOYSA-N -1 1 344.414 4.175 20 0 EIADMM O=C(c1cc(Cl)ccc1[O-])N1CCC[C@@H](c2ccccc2)CC1 ZINC000436792256 1041483854 /nfs/dbraw/zinc/48/38/54/1041483854.db2.gz MTGQHJKKQNRIGU-OAHLLOKOSA-N -1 1 329.827 4.456 20 0 EIADMM O=C(Nc1ccc(-c2ncco2)cc1)c1cc2ccccc2cc1[O-] ZINC000436865920 1041524735 /nfs/dbraw/zinc/52/47/35/1041524735.db2.gz VDCJIGLOFXTCKE-UHFFFAOYSA-N -1 1 330.343 4.453 20 0 EIADMM Cc1ccc(Oc2ccc(NC(=O)c3ccc([O-])cc3F)cn2)cc1 ZINC000436871564 1041530342 /nfs/dbraw/zinc/53/03/42/1041530342.db2.gz QMEGLTGFNKGLMX-UHFFFAOYSA-N -1 1 338.338 4.279 20 0 EIADMM [O-]c1ccc(-c2noc(C3(Oc4ccc(Cl)cc4)CC3)n2)c(F)c1 ZINC000436872348 1041531922 /nfs/dbraw/zinc/53/19/22/1041531922.db2.gz KKDAIFDMLQECCZ-UHFFFAOYSA-N -1 1 346.745 4.303 20 0 EIADMM CC1(C)CN(C(=O)c2cc3ccccc3cc2[O-])[C@H]1c1ccncc1 ZINC000436878032 1041535576 /nfs/dbraw/zinc/53/55/76/1041535576.db2.gz BGNCUSOKRMQLSK-IBGZPJMESA-N -1 1 332.403 4.164 20 0 EIADMM [O-]c1ccc(-c2noc(-c3ccccc3N3CCCCC3)n2)cc1F ZINC000436878985 1041537208 /nfs/dbraw/zinc/53/72/08/1041537208.db2.gz LPUZGMMQRBXSNL-UHFFFAOYSA-N -1 1 339.370 4.239 20 0 EIADMM O=C(N[C@H]1CCCC[C@@H]1Cc1ccccc1)c1ccc([O-])cc1F ZINC000436880625 1041539216 /nfs/dbraw/zinc/53/92/16/1041539216.db2.gz KHBWVKZCAODJNB-BEFAXECRSA-N -1 1 327.399 4.063 20 0 EIADMM O=C(N[C@H]1CCCC[C@H]1Cc1ccccc1)c1ccc([O-])cc1F ZINC000436880628 1041539500 /nfs/dbraw/zinc/53/95/00/1041539500.db2.gz KHBWVKZCAODJNB-KXBFYZLASA-N -1 1 327.399 4.063 20 0 EIADMM CCOc1cc(-c2nc(-c3ccc(C)cc3)no2)cc(Cl)c1[O-] ZINC000904572852 1041542524 /nfs/dbraw/zinc/54/25/24/1041542524.db2.gz XLNMOYTXZMIIDM-UHFFFAOYSA-N -1 1 330.771 4.470 20 0 EIADMM O=C(c1cc(F)ccc1[O-])N1CCC[C@H](c2ccc(F)cc2)CC1 ZINC000436907301 1041547464 /nfs/dbraw/zinc/54/74/64/1041547464.db2.gz SEBRLDGEGVVXKN-ZDUSSCGKSA-N -1 1 331.362 4.080 20 0 EIADMM COCc1ccc(-c2noc(-c3ccc4ccccc4c3[O-])n2)cc1 ZINC000436908229 1041549198 /nfs/dbraw/zinc/54/91/98/1041549198.db2.gz ILGJYPRXPGGTRC-UHFFFAOYSA-N -1 1 332.359 4.409 20 0 EIADMM Cc1ccccc1-c1csc(NC(=O)c2c(F)ccc([O-])c2F)n1 ZINC000538834451 1041555506 /nfs/dbraw/zinc/55/55/06/1041555506.db2.gz VMKKKOJQYQENSL-UHFFFAOYSA-N -1 1 346.358 4.355 20 0 EIADMM CC(C)Oc1cc(-c2noc(-c3ccc4ccccc4c3[O-])n2)ccn1 ZINC000436922141 1041558811 /nfs/dbraw/zinc/55/88/11/1041558811.db2.gz YZIBGXAGAOZENK-UHFFFAOYSA-N -1 1 347.374 4.445 20 0 EIADMM Cc1ccc(C)c(S(=O)(=O)[N-]c2nc(C)c(Cl)cc2Cl)c1 ZINC000538856464 1041561936 /nfs/dbraw/zinc/56/19/36/1041561936.db2.gz RHHRRGCUIIMWDI-UHFFFAOYSA-N -1 1 345.251 4.114 20 0 EIADMM C[C@@H]1C[C@H](c2ccccc2)[C@@H](C)N1C(=O)c1cc(Cl)ccc1[O-] ZINC000436939555 1041567197 /nfs/dbraw/zinc/56/71/97/1041567197.db2.gz OTBNVFXIASVBLV-IOASZLSFSA-N -1 1 329.827 4.452 20 0 EIADMM C[C@@H](NC(=O)c1ccc([O-])cc1F)C1(c2ccccc2)CCCC1 ZINC000436974062 1041577633 /nfs/dbraw/zinc/57/76/33/1041577633.db2.gz ZYBLFHNPQBLCAD-CQSZACIVSA-N -1 1 327.399 4.162 20 0 EIADMM C[C@H](NC(=O)c1ccc([O-])cc1F)C1(c2ccccc2)CCCC1 ZINC000436974061 1041577848 /nfs/dbraw/zinc/57/78/48/1041577848.db2.gz ZYBLFHNPQBLCAD-AWEZNQCLSA-N -1 1 327.399 4.162 20 0 EIADMM CC(C)c1ccc([C@H]2CCCN2C(=O)C(=O)c2ccc([O-])cc2)cc1 ZINC000436989446 1041583612 /nfs/dbraw/zinc/58/36/12/1041583612.db2.gz ZZKYAIZYUSPSPY-LJQANCHMSA-N -1 1 337.419 4.062 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N(Cc1c(F)cccc1F)C1CC1 ZINC000436996978 1041586184 /nfs/dbraw/zinc/58/61/84/1041586184.db2.gz MDJMIFXQFPUQTB-UHFFFAOYSA-N -1 1 337.753 4.129 20 0 EIADMM CSc1ccc(S(=O)(=O)[N-]c2cc(F)ccc2C)cc1Cl ZINC000463523768 1041603370 /nfs/dbraw/zinc/60/33/70/1041603370.db2.gz DWRWSINKLAUPIV-UHFFFAOYSA-N -1 1 345.848 4.310 20 0 EIADMM CC[C@@H]1CCCN(Cc2csc(-c3ccc(C(=O)[O-])cc3)n2)C1 ZINC000516656939 1041692874 /nfs/dbraw/zinc/69/28/74/1041692874.db2.gz RJQZPXUHBICOLD-CYBMUJFWSA-N -1 1 330.453 4.130 20 0 EIADMM Cc1ccc(-c2cc(=NC(=O)c3c[nH]cc3-c3ccccc3)[nH][n-]2)s1 ZINC000517285195 1041939892 /nfs/dbraw/zinc/93/98/92/1041939892.db2.gz XOJYPZIKFZEATI-UHFFFAOYSA-N -1 1 348.431 4.116 20 0 EIADMM CCOc1cc(C(=O)N2CCCC3(CCCC3)C2)cc(Cl)c1[O-] ZINC000438681738 1042309061 /nfs/dbraw/zinc/30/90/61/1042309061.db2.gz CXMSGWVOOQOKNQ-UHFFFAOYSA-N -1 1 337.847 4.241 20 0 EIADMM CC(C)c1ccc(S(=O)(=O)[N-]c2ccccc2-c2cn[nH]c2)cc1 ZINC000438816234 1042355321 /nfs/dbraw/zinc/35/53/21/1042355321.db2.gz BBZJFARNDHCOQQ-UHFFFAOYSA-N -1 1 341.436 4.001 20 0 EIADMM CCCc1ccc(S(=O)(=O)[N-]c2ccc3scnc3c2)cc1 ZINC000509554176 1042363475 /nfs/dbraw/zinc/36/34/75/1042363475.db2.gz IXWOJHJBVXLYQN-UHFFFAOYSA-N -1 1 332.450 4.050 20 0 EIADMM O=C(c1ccc(O)cc1[O-])N1CCc2cc(-c3cccc(F)c3)ccc21 ZINC000439057343 1042484319 /nfs/dbraw/zinc/48/43/19/1042484319.db2.gz KFHFKOMWTJLUOB-UHFFFAOYSA-N -1 1 349.361 4.107 20 0 EIADMM C[C@H]1C[C@@H](c2ccc(F)cc2)CN1C(=O)c1cc(Cl)ccc1[O-] ZINC000303893847 1042526542 /nfs/dbraw/zinc/52/65/42/1042526542.db2.gz SBXDBSALTBGJAI-WCQYABFASA-N -1 1 333.790 4.203 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1CC[C@H](Cc2ccccc2)C1 ZINC000303901650 1042528731 /nfs/dbraw/zinc/52/87/31/1042528731.db2.gz QAFYOOBZUYSYTI-QGZVFWFLSA-N -1 1 331.415 4.250 20 0 EIADMM Cc1ccc(Cc2ccccn2)cc1NC(=O)c1ccc([O-])c(F)c1 ZINC000669942242 1042537420 /nfs/dbraw/zinc/53/74/20/1042537420.db2.gz HXEDQJTXQUQEAV-UHFFFAOYSA-N -1 1 336.366 4.078 20 0 EIADMM C[C@H](C(=O)[N-]OCc1ccc(C(F)(F)F)cc1)c1ccsc1 ZINC000152227791 1042721878 /nfs/dbraw/zinc/72/18/78/1042721878.db2.gz FTSIRBJGMWRFDS-JTQLQIEISA-N -1 1 329.343 4.118 20 0 EIADMM CCc1ccc(S(=O)(=O)[N-]c2ccc3oc(C(C)C)nc3c2)cc1 ZINC000032097702 1043020126 /nfs/dbraw/zinc/02/01/26/1043020126.db2.gz BRDUBZOTTWRALY-UHFFFAOYSA-N -1 1 344.436 4.314 20 0 EIADMM CCCc1ccccc1[N-]S(=O)(=O)c1ccc(F)c(Cl)c1 ZINC000032098392 1043031032 /nfs/dbraw/zinc/03/10/32/1043031032.db2.gz HJOPWRVIHJILBC-UHFFFAOYSA-N -1 1 327.808 4.232 20 0 EIADMM Cc1c(=O)[n-]c(SCc2c(F)cccc2F)nc1-c1ccccc1 ZINC000184881241 1043136482 /nfs/dbraw/zinc/13/64/82/1043136482.db2.gz ZHMSKSDQESNPNM-UHFFFAOYSA-N -1 1 344.386 4.316 20 0 EIADMM COc1ccc(C2(C(=O)Nc3ccc([O-])c(Cl)c3)CCC2)cc1 ZINC000509171289 1043177436 /nfs/dbraw/zinc/17/74/36/1043177436.db2.gz MBPWWSODQNYWPP-UHFFFAOYSA-N -1 1 331.799 4.115 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1c[nH]nc1-c1cccc(Cl)c1 ZINC000509179408 1043213462 /nfs/dbraw/zinc/21/34/62/1043213462.db2.gz BNXHQZDLNIXYJA-UHFFFAOYSA-N -1 1 348.189 4.341 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc(F)cc2C(F)(F)F)cc1C ZINC000442106352 1043495926 /nfs/dbraw/zinc/49/59/26/1043495926.db2.gz FWTMXGAVFSZGSA-UHFFFAOYSA-N -1 1 347.333 4.262 20 0 EIADMM CCc1nc(COC(=O)c2ccc(Cl)c(Cl)c2[O-])cs1 ZINC000730359482 1043502918 /nfs/dbraw/zinc/50/29/18/1043502918.db2.gz LIYWJZNUUFMBCU-UHFFFAOYSA-N -1 1 332.208 4.075 20 0 EIADMM COc1ccc(NC(=O)Nc2ccc([O-])c(Cl)c2)cc1Cl ZINC000190919711 1043748531 /nfs/dbraw/zinc/74/85/31/1043748531.db2.gz AIVPJWPDRILIMF-UHFFFAOYSA-N -1 1 327.167 4.352 20 0 EIADMM O=C(Nc1ccc(NC(=O)C2CC2)cc1)Nc1ccc([O-])c(Cl)c1 ZINC000190929071 1043748920 /nfs/dbraw/zinc/74/89/20/1043748920.db2.gz GIIDOCUOMXDUNS-UHFFFAOYSA-N -1 1 345.786 4.038 20 0 EIADMM O=C(Nc1cnn(-c2ccccc2F)c1)Nc1ccc([O-])c(Cl)c1 ZINC000190975731 1043755174 /nfs/dbraw/zinc/75/51/74/1043755174.db2.gz XALFKSIBRDYBIG-UHFFFAOYSA-N -1 1 346.749 4.014 20 0 EIADMM COc1cc(C(=O)Nc2ccc(OCC3CC3)cc2)cc(Cl)c1[O-] ZINC000442971867 1043931264 /nfs/dbraw/zinc/93/12/64/1043931264.db2.gz LHNQNMMQBQOMHV-UHFFFAOYSA-N -1 1 347.798 4.095 20 0 EIADMM CCC[C@H](C)[C@@H]1CCCN1C(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC000443042930 1043978187 /nfs/dbraw/zinc/97/81/87/1043978187.db2.gz CSLXPQVOBNNCJN-FZMZJTMJSA-N -1 1 325.836 4.095 20 0 EIADMM COc1cc(-c2nc(-c3cc(F)cc(F)c3)no2)cc(Cl)c1[O-] ZINC000443191934 1044080486 /nfs/dbraw/zinc/08/04/86/1044080486.db2.gz HHDDXECXWFBYHY-UHFFFAOYSA-N -1 1 338.697 4.049 20 0 EIADMM CCOc1cc(-c2nc(Cc3ccc(C)cc3)no2)cc(Cl)c1[O-] ZINC000443201610 1044091283 /nfs/dbraw/zinc/09/12/83/1044091283.db2.gz IHRNKOHPELNUDZ-UHFFFAOYSA-N -1 1 344.798 4.394 20 0 EIADMM O=C([N-]c1nnc(-c2cccc(Cl)c2)s1)c1ccc(Cl)o1 ZINC000068011300 1044098757 /nfs/dbraw/zinc/09/87/57/1044098757.db2.gz GPGVHWTXHCPHEI-UHFFFAOYSA-N -1 1 340.191 4.357 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N(CCc1ccccc1)C1CC1 ZINC000914490061 1044257701 /nfs/dbraw/zinc/25/77/01/1044257701.db2.gz XIHCYDNUYPEVED-UHFFFAOYSA-N -1 1 331.415 4.393 20 0 EIADMM C[C@H](Oc1ccc(F)cc1Cl)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000113460985 1044607500 /nfs/dbraw/zinc/60/75/00/1044607500.db2.gz MRGAJXLUIBUPST-QMMMGPOBSA-N -1 1 344.169 4.244 20 0 EIADMM O=C(Nc1ccc(F)cc1[O-])c1c[nH]c2ccc(Br)cc21 ZINC000676056061 1044620769 /nfs/dbraw/zinc/62/07/69/1044620769.db2.gz RNJVOJKTBXMRQI-UHFFFAOYSA-N -1 1 349.159 4.027 20 0 EIADMM CCCc1ccc(S(=O)(=O)[N-]c2ccc3ncsc3c2)cc1 ZINC000033612576 1044700161 /nfs/dbraw/zinc/70/01/61/1044700161.db2.gz CCPZZXAGMLHLBA-UHFFFAOYSA-N -1 1 332.450 4.050 20 0 EIADMM CCC1CCC(N(C)C(=O)c2ccc(Br)c([O-])c2)CC1 ZINC000231326362 1044843869 /nfs/dbraw/zinc/84/38/69/1044843869.db2.gz NKQPUMGWJRRJKN-UHFFFAOYSA-N -1 1 340.261 4.196 20 0 EIADMM O=C(c1ccc(O)cc1[O-])N(Cc1ccsc1)c1ccccc1 ZINC000624961320 1044899494 /nfs/dbraw/zinc/89/94/94/1044899494.db2.gz DAKFRJONVITYCG-UHFFFAOYSA-N -1 1 325.389 4.006 20 0 EIADMM C[C@H]1C[C@H](c2ccc(F)cc2)CN1C(=O)c1c([O-])cccc1Cl ZINC000736724921 1044965917 /nfs/dbraw/zinc/96/59/17/1044965917.db2.gz PZDOQAWAWQMIPB-AAEUAGOBSA-N -1 1 333.790 4.203 20 0 EIADMM Cc1c(=O)[n-]c(SCc2cnc3ccccn23)nc1-c1ccccc1 ZINC000097094771 1045005236 /nfs/dbraw/zinc/00/52/36/1045005236.db2.gz HIKDDLVLACFQTF-UHFFFAOYSA-N -1 1 348.431 4.098 20 0 EIADMM C[C@@H](c1ccc(F)c(F)c1)N1CCC(C(=O)c2ccc([O-])cc2)CC1 ZINC000125634888 1045031198 /nfs/dbraw/zinc/03/11/98/1045031198.db2.gz PGEDADRTYPMRFU-ZDUSSCGKSA-N -1 1 345.389 4.326 20 0 EIADMM CCOc1cc(C(=O)N[C@H](C)c2ccc(C)s2)cc(Cl)c1[O-] ZINC000762584965 1045304995 /nfs/dbraw/zinc/30/49/95/1045304995.db2.gz QTGYNHCVVKJSOO-SNVBAGLBSA-N -1 1 339.844 4.305 20 0 EIADMM O=C(Nc1ccc(Cl)cc1[O-])c1ccn(-c2cccc(Cl)c2)n1 ZINC000533618293 1045639720 /nfs/dbraw/zinc/63/97/20/1045639720.db2.gz BDTHETJWMITAIU-UHFFFAOYSA-N -1 1 348.189 4.137 20 0 EIADMM Cc1coc(-c2ccc(C)c(NC(=O)c3ccc([O-])c(F)c3)c2)n1 ZINC000768253908 1045763786 /nfs/dbraw/zinc/76/37/86/1045763786.db2.gz OMNMSNDHORIOGB-UHFFFAOYSA-N -1 1 326.327 4.055 20 0 EIADMM C[C@H](c1cc(F)ccc1F)N(C)C(=O)c1c([O-])cccc1Cl ZINC000769671746 1046042422 /nfs/dbraw/zinc/04/24/22/1046042422.db2.gz DLIUIOYVLMDKHI-SECBINFHSA-N -1 1 325.742 4.157 20 0 EIADMM COC(=O)Nc1cc(NC(=O)c2ccc(C(C)C)cc2[O-])ccc1F ZINC000769759287 1046058572 /nfs/dbraw/zinc/05/85/72/1046058572.db2.gz NAZVLONUIQSZDF-UHFFFAOYSA-N -1 1 346.358 4.085 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1cccc(OCC(F)(F)F)c1 ZINC000770157505 1046157404 /nfs/dbraw/zinc/15/74/04/1046157404.db2.gz PAWAATBMOYNSCM-UHFFFAOYSA-N -1 1 345.704 4.239 20 0 EIADMM O=C([N-][C@H](c1ccccc1)C(F)(F)F)C(F)(F)Cc1ccccc1 ZINC000793152980 1046158276 /nfs/dbraw/zinc/15/82/76/1046158276.db2.gz MYZYDRROKAIHFN-CQSZACIVSA-N -1 1 343.295 4.284 20 0 EIADMM CC[C@@H](C)Oc1ccccc1/C=C\C(=O)Nc1c([O-])cccc1F ZINC000770862219 1046276745 /nfs/dbraw/zinc/27/67/45/1046276745.db2.gz LMULTUKKAJLJPQ-YLGBQOPLSA-N -1 1 329.371 4.361 20 0 EIADMM O=C(Nc1ccccc1SCc1ccccc1)c1cncc([O-])c1 ZINC000785756703 1046747305 /nfs/dbraw/zinc/74/73/05/1046747305.db2.gz ZJYSZMOEWWMGDG-UHFFFAOYSA-N -1 1 336.416 4.332 20 0 EIADMM CN(C(=O)c1ccc(C(F)(F)F)cc1[O-])c1cccc2cccnc21 ZINC000670381290 1046886986 /nfs/dbraw/zinc/88/69/86/1046886986.db2.gz KXATYOYUMFDHTM-UHFFFAOYSA-N -1 1 346.308 4.236 20 0 EIADMM COCc1ccc(S(=O)(=O)[N-]c2ccccc2CCC(C)C)cc1 ZINC000537037741 1046907286 /nfs/dbraw/zinc/90/72/86/1046907286.db2.gz XRUBHHYNDPUUOZ-UHFFFAOYSA-N -1 1 347.480 4.222 20 0 EIADMM C[C@H]1[C@@H](Cc2ccccc2)CCN1C(=O)c1c([O-])cccc1Cl ZINC000746693135 1047028121 /nfs/dbraw/zinc/02/81/21/1047028121.db2.gz BRBQGNWRNYNFAY-DZGCQCFKSA-N -1 1 329.827 4.139 20 0 EIADMM Cc1nc(C(C)C)[n-]c(=O)c1C(=O)Nc1ccc(C2CCC2)cc1 ZINC000787683709 1047039616 /nfs/dbraw/zinc/03/96/16/1047039616.db2.gz APEVHKQBAQXVBF-UHFFFAOYSA-N -1 1 325.412 4.134 20 0 EIADMM CCN(Cc1ccc(Cl)c(Cl)c1)C(=O)c1ncc(C)cc1[O-] ZINC000460204997 1047163467 /nfs/dbraw/zinc/16/34/67/1047163467.db2.gz OSGJAGHITYOWAL-UHFFFAOYSA-N -1 1 339.222 4.065 20 0 EIADMM Cc1ccc(OC2CCN(C(=O)c3cc(Cl)ccc3[O-])CC2)cc1 ZINC000116653855 1047263747 /nfs/dbraw/zinc/26/37/47/1047263747.db2.gz AAZNIMSNNJDKAX-UHFFFAOYSA-N -1 1 345.826 4.038 20 0 EIADMM CC(C)=CCOc1cccc(CC(=O)Nc2cc(F)cc(F)c2[O-])c1 ZINC001142546032 1047594532 /nfs/dbraw/zinc/59/45/32/1047594532.db2.gz PCOXBJUMLKLBKU-UHFFFAOYSA-N -1 1 347.361 4.197 20 0 EIADMM Cc1cc(F)cc(S(=O)(=O)[N-]c2cccc(-c3nccs3)c2)c1 ZINC000476370732 1047707022 /nfs/dbraw/zinc/70/70/22/1047707022.db2.gz ALLDOOGADRCLCR-UHFFFAOYSA-N -1 1 348.424 4.058 20 0 EIADMM [O-]c1cccc(CNc2ccc(O[C@@H]3CCCC[C@H]3O)cc2)c1Cl ZINC000815128732 1048341157 /nfs/dbraw/zinc/34/11/57/1048341157.db2.gz LHISCJVPKZSFPI-SJLPKXTDSA-N -1 1 347.842 4.340 20 0 EIADMM COc1ccc([C@H]2CCN(C(=O)c3ccc4ccccc4c3[O-])C2)cc1 ZINC000132987255 1048557336 /nfs/dbraw/zinc/55/73/36/1048557336.db2.gz UVDGOKVKFPHBRW-KRWDZBQOSA-N -1 1 347.414 4.184 20 0 EIADMM CC(F)(F)C(=O)[N-][C@H](c1ccccc1Cl)c1cc(F)ccc1F ZINC000815702186 1048587996 /nfs/dbraw/zinc/58/79/96/1048587996.db2.gz PRKFGJMAFBYOQS-CQSZACIVSA-N -1 1 345.723 4.479 20 0 EIADMM O=C(NCCOc1ccc2ccccc2c1)c1c([O-])cccc1Cl ZINC000920432196 1048679517 /nfs/dbraw/zinc/67/95/17/1048679517.db2.gz PMSMNJHUYQONCC-UHFFFAOYSA-N -1 1 341.794 4.008 20 0 EIADMM CN(Cc1cccc(Br)c1)Cc1c(F)cc([O-])cc1F ZINC001144544709 1048712505 /nfs/dbraw/zinc/71/25/05/1048712505.db2.gz DKYQQOPJTYXMKA-UHFFFAOYSA-N -1 1 342.183 4.065 20 0 EIADMM COc1cccc([C@H]2CCCCN2Cc2c(F)cc([O-])cc2F)c1 ZINC001144554910 1048724697 /nfs/dbraw/zinc/72/46/97/1048724697.db2.gz LUTMJDSOPXOYLG-LJQANCHMSA-N -1 1 333.378 4.406 20 0 EIADMM C[C@H]1OC2(CCN(Cc3c(F)cc([O-])cc3F)CC2)c2ccccc21 ZINC001144567101 1048731874 /nfs/dbraw/zinc/73/18/74/1048731874.db2.gz CYNVXFLZQZIGKF-CYBMUJFWSA-N -1 1 345.389 4.253 20 0 EIADMM O=C(N[C@H](c1ccc(F)cc1)C1CCC1)c1c([O-])cccc1Cl ZINC001144622921 1048759126 /nfs/dbraw/zinc/75/91/26/1048759126.db2.gz IQOOSTDYNJOWQU-KRWDZBQOSA-N -1 1 333.790 4.456 20 0 EIADMM CCC[C@H]1CC[C@H](C(=O)Nc2cc(=O)n(-c3ccccc3)[n-]2)CC1 ZINC001144636596 1048766383 /nfs/dbraw/zinc/76/63/83/1048766383.db2.gz NQSNATLGHGFTDL-SHTZXODSSA-N -1 1 327.428 4.123 20 0 EIADMM [O-]c1cc(F)c(CN2CCC[C@H]2c2cc(F)ccc2F)cc1F ZINC001144666776 1048786214 /nfs/dbraw/zinc/78/62/14/1048786214.db2.gz PLHZSZLHXUSJFE-INIZCTEOSA-N -1 1 325.305 4.286 20 0 EIADMM C[C@H]([N-]C(=O)C(F)(F)c1ccc(F)cc1)c1c(F)cccc1F ZINC000920845486 1048803483 /nfs/dbraw/zinc/80/34/83/1048803483.db2.gz SPKFHXVWCKAUKE-VIFPVBQESA-N -1 1 329.268 4.073 20 0 EIADMM COc1ccc(OC(=O)c2cc3cc(Cl)sc3[n-]2)cc1OC ZINC000810600120 1048819703 /nfs/dbraw/zinc/81/97/03/1048819703.db2.gz TZZQNWWQFIGCGN-UHFFFAOYSA-N -1 1 337.784 4.119 20 0 EIADMM CCCCc1nnc([N-]C(=O)c2cc(F)c(Cl)cc2F)s1 ZINC000133960705 1048863505 /nfs/dbraw/zinc/86/35/05/1048863505.db2.gz SEUDOLLUONUXFF-UHFFFAOYSA-N -1 1 331.775 4.065 20 0 EIADMM O=C(NCCCCOc1ccccc1)c1ccc2ccccc2c1[O-] ZINC001135787666 1048886669 /nfs/dbraw/zinc/88/66/69/1048886669.db2.gz METPQRWUOCNWMO-UHFFFAOYSA-N -1 1 335.403 4.134 20 0 EIADMM CC[C@H](NC(=O)c1cc(Cl)ccc1[O-])c1cc(F)ccc1F ZINC001147211077 1049107776 /nfs/dbraw/zinc/10/77/76/1049107776.db2.gz NDUHZEYKTRDSTJ-AWEZNQCLSA-N -1 1 325.742 4.205 20 0 EIADMM CC(C)Cc1ccc([C@@H](NC(=O)c2ccc([O-])cn2)C(C)C)cc1 ZINC001136136052 1049147404 /nfs/dbraw/zinc/14/74/04/1049147404.db2.gz AZILAILXHIMINT-IBGZPJMESA-N -1 1 326.440 4.113 20 0 EIADMM CCN(C(=O)c1ccc(C(F)(F)F)c([O-])c1)c1cccc(OC)c1 ZINC001136169952 1049221580 /nfs/dbraw/zinc/22/15/80/1049221580.db2.gz ICJUTFJHLRYBJR-UHFFFAOYSA-N -1 1 339.313 4.086 20 0 EIADMM CC[C@H](Cc1ccc(C)cc1)N(CC)C(=O)c1ccc([O-])cc1F ZINC001147860072 1049230968 /nfs/dbraw/zinc/23/09/68/1049230968.db2.gz CIICBIVXWJCOIQ-MRXNPFEDSA-N -1 1 329.415 4.323 20 0 EIADMM CC(C)[C@@H](CNC(=O)Cc1ccc([O-])c(Cl)c1)c1ccccc1 ZINC001136187956 1049252911 /nfs/dbraw/zinc/25/29/11/1049252911.db2.gz RPPUEXAPVLFNBN-MRXNPFEDSA-N -1 1 331.843 4.144 20 0 EIADMM Cc1ccc(O[C@H](C)CNC(=O)c2ccc3ccccc3c2[O-])cc1 ZINC001148075765 1049257769 /nfs/dbraw/zinc/25/77/69/1049257769.db2.gz JOBCHSFRVZXRBX-OAHLLOKOSA-N -1 1 335.403 4.051 20 0 EIADMM O=C(Cc1ccc(C2CCC2)cc1)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC001136190745 1049269662 /nfs/dbraw/zinc/26/96/62/1049269662.db2.gz OILYRARYHJHAQU-UHFFFAOYSA-N -1 1 347.418 4.231 20 0 EIADMM CC[C@@H](Cc1ccccc1)N(C)C(=O)c1ccc2ccc(O)cc2c1[O-] ZINC001148232061 1049281273 /nfs/dbraw/zinc/28/12/73/1049281273.db2.gz DHZUCSIQQOFZRX-KRWDZBQOSA-N -1 1 349.430 4.344 20 0 EIADMM O=C(Nc1cc(Cl)c([O-])c2ccccc12)c1ccc2[nH]ccc2n1 ZINC001148251803 1049288548 /nfs/dbraw/zinc/28/85/48/1049288548.db2.gz BLEBWGSAVASVSG-UHFFFAOYSA-N -1 1 337.766 4.327 20 0 EIADMM CC(C)(C)/C=C\C(=O)Nc1c([O-])cc(Br)cc1Cl ZINC000819787974 1049377457 /nfs/dbraw/zinc/37/74/57/1049377457.db2.gz PXLXDSZJGNKSEM-PLNGDYQASA-N -1 1 332.625 4.349 20 0 EIADMM CC[C@@H](CNC(=O)c1ccc2ccccc2c1[O-])Oc1cccc(C)c1 ZINC001136278886 1049387219 /nfs/dbraw/zinc/38/72/19/1049387219.db2.gz KBCQYEUNXCFNTI-KRWDZBQOSA-N -1 1 349.430 4.441 20 0 EIADMM COc1ccc(C)nc1NC(=O)c1cccc(-c2ccccc2)c1[O-] ZINC001148867309 1049389915 /nfs/dbraw/zinc/38/99/15/1049389915.db2.gz PGVFDJBEKTWBQH-UHFFFAOYSA-N -1 1 334.375 4.024 20 0 EIADMM Cc1nc2ccccn2c1NC(=O)c1cccc(-c2ccccc2)c1[O-] ZINC001148861628 1049391016 /nfs/dbraw/zinc/39/10/16/1049391016.db2.gz SQLDFXGOOLHTCX-UHFFFAOYSA-N -1 1 343.386 4.268 20 0 EIADMM CC(=O)Oc1ccc(NC(=O)c2cccc(-c3ccccc3)c2[O-])cc1 ZINC001148868855 1049391267 /nfs/dbraw/zinc/39/12/67/1049391267.db2.gz DDHKHXIQFUHPEQ-UHFFFAOYSA-N -1 1 347.370 4.237 20 0 EIADMM Cc1nc(Cl)ncc1NC(=O)c1cccc(-c2ccccc2)c1[O-] ZINC001148861769 1049391881 /nfs/dbraw/zinc/39/18/81/1049391881.db2.gz XNHMLDISXMHISN-UHFFFAOYSA-N -1 1 339.782 4.063 20 0 EIADMM Cc1ccc([C@H](C)NC(=O)c2cccc(-c3ccccc3)c2[O-])nc1 ZINC001148873008 1049392665 /nfs/dbraw/zinc/39/26/65/1049392665.db2.gz PNJGBGNSDCETGZ-HNNXBMFYSA-N -1 1 332.403 4.254 20 0 EIADMM C[C@@H](CCCC(C)(C)O)NC(=O)c1cccc(-c2ccccc2)c1[O-] ZINC001148873315 1049393113 /nfs/dbraw/zinc/39/31/13/1049393113.db2.gz SNKFHBRGVBQZDT-HNNXBMFYSA-N -1 1 341.451 4.119 20 0 EIADMM O=C(c1cc(Cl)ccc1[O-])N1CCC[C@H]1Cc1ccc(F)cc1 ZINC001136347948 1049519230 /nfs/dbraw/zinc/51/92/30/1049519230.db2.gz PMEBROBFPNJMFH-HNNXBMFYSA-N -1 1 333.790 4.032 20 0 EIADMM CC(C)CCN(C(=O)c1ncc2ccccc2c1[O-])C1CCCC1 ZINC001136443981 1049633031 /nfs/dbraw/zinc/63/30/31/1049633031.db2.gz VWDIKYCNNRDPNL-UHFFFAOYSA-N -1 1 326.440 4.371 20 0 EIADMM O=C([N-]c1c2nsnc2ccc1Cl)c1ccoc1C(F)(F)F ZINC000813027158 1049662365 /nfs/dbraw/zinc/66/23/65/1049662365.db2.gz SYRROZVLEDNNMK-UHFFFAOYSA-N -1 1 347.705 4.209 20 0 EIADMM O=C(Nc1ccc2scnc2c1)c1ccc2ccc(O)cc2c1[O-] ZINC001136532393 1049724588 /nfs/dbraw/zinc/72/45/88/1049724588.db2.gz KLHHCXYAJYYZIZ-UHFFFAOYSA-N -1 1 336.372 4.113 20 0 EIADMM O=C(Nc1cccc(F)c1[O-])[C@@H]1CC[C@H]1c1ccc(Cl)cc1F ZINC001171636233 1049777261 /nfs/dbraw/zinc/77/72/61/1049777261.db2.gz FICXSVYMSOXRMH-CMPLNLGQSA-N -1 1 337.753 4.456 20 0 EIADMM COc1ccccc1CC(C)(C)NC(=O)c1cc2ccccc2cc1[O-] ZINC001136691003 1049832654 /nfs/dbraw/zinc/83/26/54/1049832654.db2.gz CJAWGDXZGYKLAR-UHFFFAOYSA-N -1 1 349.430 4.305 20 0 EIADMM CC(C)(C)c1ccccc1OCCNC(=O)c1cc(Cl)ccc1[O-] ZINC001136725747 1049850342 /nfs/dbraw/zinc/85/03/42/1049850342.db2.gz ZQLOSZYPOXGZBF-UHFFFAOYSA-N -1 1 347.842 4.152 20 0 EIADMM C[C@H](C#N)Oc1ccccc1NCc1cccc(Br)c1[O-] ZINC000181118802 1049993069 /nfs/dbraw/zinc/99/30/69/1049993069.db2.gz LMBMXXNAXRDFSC-LLVKDONJSA-N -1 1 347.212 4.058 20 0 EIADMM CCc1cc(C)cc(CC)c1[N-]S(=O)(=O)c1cccc(F)c1C ZINC001185836726 1050168605 /nfs/dbraw/zinc/16/86/05/1050168605.db2.gz VNDSBIQUVQHGEB-UHFFFAOYSA-N -1 1 335.444 4.368 20 0 EIADMM [O-]c1ccc(F)c(Nc2cc(O)ccc2Br)c1Cl ZINC001250233604 1050259621 /nfs/dbraw/zinc/25/96/21/1050259621.db2.gz UWMIVTSWYZSBED-UHFFFAOYSA-N -1 1 332.556 4.396 20 0 EIADMM O=C(Nc1cc2[nH]ccc2cc1Br)c1ccc([O-])c(F)c1 ZINC001186226830 1050262498 /nfs/dbraw/zinc/26/24/98/1050262498.db2.gz RDIPBCGNVSHOJW-UHFFFAOYSA-N -1 1 349.159 4.027 20 0 EIADMM CC(C)(NC(=O)c1ccc([O-])c(F)c1)c1ccc(C(F)(F)F)cc1 ZINC001186237160 1050264998 /nfs/dbraw/zinc/26/49/98/1050264998.db2.gz RBGKNMNZBIMURG-UHFFFAOYSA-N -1 1 341.304 4.215 20 0 EIADMM O=C(NCc1c(Cl)ccc(Cl)c1Cl)c1ccc([O-])c(F)c1 ZINC001186233707 1050265752 /nfs/dbraw/zinc/26/57/52/1050265752.db2.gz ONXRDFFKHVGJFZ-UHFFFAOYSA-N -1 1 348.588 4.422 20 0 EIADMM O=C(Nc1ccc(C2(C(F)(F)F)CC2)cc1)c1ccc([O-])cc1F ZINC001186310442 1050292203 /nfs/dbraw/zinc/29/22/03/1050292203.db2.gz BDUKPDVQRJMBAD-UHFFFAOYSA-N -1 1 339.288 4.378 20 0 EIADMM CC[C@@H](C)C[C@H](C)[N-]S(=O)(=O)c1ccc(Cl)c(F)c1Cl ZINC001187372832 1050529754 /nfs/dbraw/zinc/52/97/54/1050529754.db2.gz FENTVBVCVRDLSV-BDAKNGLRSA-N -1 1 342.263 4.236 20 0 EIADMM Cc1oncc1S(=O)(=O)[N-]c1c(Cl)cccc1-c1ccccc1 ZINC001187378992 1050529991 /nfs/dbraw/zinc/52/99/91/1050529991.db2.gz BHYFSTGEOUCZPX-UHFFFAOYSA-N -1 1 348.811 4.104 20 0 EIADMM COc1cc(Nc2cc(Cl)cc(Cl)c2[O-])cc(OC)c1OC ZINC001173906626 1050619395 /nfs/dbraw/zinc/61/93/95/1050619395.db2.gz SPNIVUCUTWABBC-UHFFFAOYSA-N -1 1 344.194 4.468 20 0 EIADMM COc1ccc(Cl)cc1NC(=O)Nc1ccc(Cl)cc1[O-] ZINC001187925509 1050649809 /nfs/dbraw/zinc/64/98/09/1050649809.db2.gz NAMCXZBAWDGDSI-UHFFFAOYSA-N -1 1 327.167 4.352 20 0 EIADMM CCc1c(Cl)cc(Nc2cccc(C(N)=O)c2)c([O-])c1Cl ZINC001174061368 1050697959 /nfs/dbraw/zinc/69/79/59/1050697959.db2.gz GMGRPDHDISMRPC-UHFFFAOYSA-N -1 1 325.195 4.104 20 0 EIADMM O=S(=O)([N-]c1ccc(C(F)(F)F)cc1C(F)(F)F)C1CCC1 ZINC001188130642 1050706312 /nfs/dbraw/zinc/70/63/12/1050706312.db2.gz MJHQWVBWLUWJRW-UHFFFAOYSA-N -1 1 347.280 4.018 20 0 EIADMM O=C(CSCc1ccc(F)cc1)Nc1cc(F)c([O-])cc1Cl ZINC001179656058 1050738200 /nfs/dbraw/zinc/73/82/00/1050738200.db2.gz NIKDZTRFLPTCNH-UHFFFAOYSA-N -1 1 343.782 4.196 20 0 EIADMM O=C(NC1CCCCC1)c1ccc(Nc2ccnc(Cl)c2[O-])cc1 ZINC001174081558 1050757551 /nfs/dbraw/zinc/75/75/51/1050757551.db2.gz HWLOYZNDZPAJSS-UHFFFAOYSA-N -1 1 345.830 4.247 20 0 EIADMM CNC(=O)c1cccc(Nc2cc(Cl)c(C)c(Cl)c2[O-])c1 ZINC001174142955 1050783609 /nfs/dbraw/zinc/78/36/09/1050783609.db2.gz NQINXIYKTUDDRQ-UHFFFAOYSA-N -1 1 325.195 4.111 20 0 EIADMM Cc1cccc(NC2CCN(Cc3ccc([O-])c(F)c3F)CC2)c1 ZINC001179897875 1050804776 /nfs/dbraw/zinc/80/47/76/1050804776.db2.gz ALODMLYMPIQGCF-UHFFFAOYSA-N -1 1 332.394 4.055 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1cccc(Oc2ccncc2)c1 ZINC000182871207 1050867509 /nfs/dbraw/zinc/86/75/09/1050867509.db2.gz VZGFPINRXHYZII-UHFFFAOYSA-N -1 1 340.766 4.485 20 0 EIADMM Cn1nc(C(F)(F)F)cc1Nc1c(Cl)ccc([O-])c1Cl ZINC001174325074 1050890058 /nfs/dbraw/zinc/89/00/58/1050890058.db2.gz AJUTWOZMQDZGKP-UHFFFAOYSA-N -1 1 326.105 4.195 20 0 EIADMM Cc1nc(SC[C@H]2CCC[C@@H](c3ccccc3)O2)[n-]c(=O)c1C ZINC001189061714 1050897143 /nfs/dbraw/zinc/89/71/43/1050897143.db2.gz RZBUAAYSLCWJGH-CVEARBPZSA-N -1 1 330.453 4.202 20 0 EIADMM Cc1ccc(-c2cc(CSc3nc(C)c(C)c(=O)[n-]3)on2)cc1 ZINC001189062055 1050898261 /nfs/dbraw/zinc/89/82/61/1050898261.db2.gz SKQKMKOUZIIQEQ-UHFFFAOYSA-N -1 1 327.409 4.055 20 0 EIADMM Cc1c(=O)[n-]c(SCc2ccc3c[nH]nc3c2)nc1-c1ccccc1 ZINC001189104248 1050910738 /nfs/dbraw/zinc/91/07/38/1050910738.db2.gz PPOBZSIWRRXDTM-UHFFFAOYSA-N -1 1 348.431 4.326 20 0 EIADMM O=c1oc2cc([O-])ccc2cc1Nc1ccc(C(F)(F)F)cc1F ZINC001174401310 1050920306 /nfs/dbraw/zinc/92/03/06/1050920306.db2.gz WAHKPBIBDMCWQI-UHFFFAOYSA-N -1 1 339.244 4.400 20 0 EIADMM CC(=O)c1cccc(S(=O)(=O)[N-]c2cc3ccccc3cc2C)c1 ZINC001189239476 1050933323 /nfs/dbraw/zinc/93/33/23/1050933323.db2.gz OUPBQLIRWSKVRS-UHFFFAOYSA-N -1 1 339.416 4.152 20 0 EIADMM COc1cc(C)cc([N-]S(=O)(=O)c2ccc(F)c3ccccc32)c1 ZINC001189386111 1050976582 /nfs/dbraw/zinc/97/65/82/1050976582.db2.gz VEXBJWNEGVMMLH-UHFFFAOYSA-N -1 1 345.395 4.097 20 0 EIADMM CCS(=O)(=O)c1ccc(Nc2c(Cl)ccc([O-])c2Cl)cc1 ZINC001174463099 1051008194 /nfs/dbraw/zinc/00/81/94/1051008194.db2.gz IEPQAKOFGNDXSU-UHFFFAOYSA-N -1 1 346.235 4.236 20 0 EIADMM O=C(Nc1ncc(-c2cccc(F)c2)s1)c1ccc(F)c([O-])c1 ZINC001180659466 1051056609 /nfs/dbraw/zinc/05/66/09/1051056609.db2.gz KMQNKNAHOMRMPV-UHFFFAOYSA-N -1 1 332.331 4.046 20 0 EIADMM CCC(CC)CCCN(C)C(=O)c1c(C)nc(C(C)(C)C)[n-]c1=O ZINC000620198392 1051062840 /nfs/dbraw/zinc/06/28/40/1051062840.db2.gz FNVVGKZCKFIUMN-UHFFFAOYSA-N -1 1 335.492 4.077 20 0 EIADMM CC(C)[C@@H](CNC(=O)c1ccc2ccccc2c1[O-])Nc1ccccc1 ZINC001181043726 1051136029 /nfs/dbraw/zinc/13/60/29/1051136029.db2.gz WAAIFALPZNBWNV-HXUWFJFHSA-N -1 1 348.446 4.412 20 0 EIADMM Cc1ccccc1C(=O)CSc1nc(-c2ccccc2)cc(=O)[n-]1 ZINC001190201726 1051136571 /nfs/dbraw/zinc/13/65/71/1051136571.db2.gz YYUGJULWPDFKPW-UHFFFAOYSA-N -1 1 336.416 4.133 20 0 EIADMM CCC(C)(C)c1ccc(S(=O)(=O)[N-]c2ccc3cnoc3c2)cc1 ZINC001190447110 1051189519 /nfs/dbraw/zinc/18/95/19/1051189519.db2.gz HQHRSXSCPDSBAC-UHFFFAOYSA-N -1 1 344.436 4.316 20 0 EIADMM O=S(=O)([N-]c1nc(Cl)ccc1Cl)c1ccc(C2CC2)cc1 ZINC001190471281 1051194768 /nfs/dbraw/zinc/19/47/68/1051194768.db2.gz AQKOUIUIFFVEAI-UHFFFAOYSA-N -1 1 343.235 4.067 20 0 EIADMM O=S(=O)([N-]c1cccc(-c2cnco2)c1)c1ccc(C2CC2)cc1 ZINC001190500085 1051196335 /nfs/dbraw/zinc/19/63/35/1051196335.db2.gz LYJCQNAOXCKOFE-UHFFFAOYSA-N -1 1 340.404 4.020 20 0 EIADMM COc1ccc(Nc2cc(Cl)c([O-])cc2Cl)c(OC)c1OC ZINC001174901896 1051237007 /nfs/dbraw/zinc/23/70/07/1051237007.db2.gz XHEROIPXAJLIGX-UHFFFAOYSA-N -1 1 344.194 4.468 20 0 EIADMM COCc1ccc(Nc2ccc(F)c(Br)c2[O-])cc1 ZINC001174923207 1051251471 /nfs/dbraw/zinc/25/14/71/1051251471.db2.gz ZBNGIKRJYIHSSX-UHFFFAOYSA-N -1 1 326.165 4.184 20 0 EIADMM CN(C)c1cccc(Nc2ccc(F)c(Br)c2[O-])c1 ZINC001174966798 1051277061 /nfs/dbraw/zinc/27/70/61/1051277061.db2.gz NRCZDLZEIOQMOG-UHFFFAOYSA-N -1 1 325.181 4.103 20 0 EIADMM CCS(=O)(=O)c1ccc([O-])c(Nc2ccc(C)c3ccccc23)c1 ZINC001174988125 1051306888 /nfs/dbraw/zinc/30/68/88/1051306888.db2.gz VIFIKASRASPVJN-UHFFFAOYSA-N -1 1 341.432 4.391 20 0 EIADMM O=C(N[C@H](c1ccccc1)c1cccc(F)c1)c1ccc([O-])cc1F ZINC000154981473 1051356426 /nfs/dbraw/zinc/35/64/26/1051356426.db2.gz PYAKHPXDSYAVED-LJQANCHMSA-N -1 1 339.341 4.190 20 0 EIADMM COc1cc(C(=O)Nc2ccnc(Cl)c2Cl)cc(Cl)c1[O-] ZINC001191129378 1051361306 /nfs/dbraw/zinc/36/13/06/1051361306.db2.gz MFGLJVZXMQEVJQ-UHFFFAOYSA-N -1 1 347.585 4.008 20 0 EIADMM COc1ccc(Nc2ccc(-n3ccc(=O)[n-]3)cc2)cc1C(F)(F)F ZINC001175073431 1051364417 /nfs/dbraw/zinc/36/44/17/1051364417.db2.gz UKGRZTLJXXHOCM-UHFFFAOYSA-N -1 1 349.312 4.349 20 0 EIADMM CCCCc1ccc(S(=O)(=O)[N-]c2ccc(C3CC3)nc2)cc1 ZINC001191232685 1051404579 /nfs/dbraw/zinc/40/45/79/1051404579.db2.gz COJWJEQBIHTOTJ-UHFFFAOYSA-N -1 1 330.453 4.102 20 0 EIADMM CCCCc1ccc(S(=O)(=O)[N-]c2ccc(Cl)nc2C)cc1 ZINC001191232694 1051404737 /nfs/dbraw/zinc/40/47/37/1051404737.db2.gz CYTFZGGREZEMBF-UHFFFAOYSA-N -1 1 338.860 4.187 20 0 EIADMM COc1ccc2cc(S(=O)(=O)[N-]c3ccc(F)cc3C)ccc2c1 ZINC001191931184 1051586601 /nfs/dbraw/zinc/58/66/01/1051586601.db2.gz FGSXWDLFJFDJPS-UHFFFAOYSA-N -1 1 345.395 4.097 20 0 EIADMM C=Cc1ccccc1[N-]S(=O)(=O)c1ccc2cc(OC)ccc2c1 ZINC001191968772 1051603890 /nfs/dbraw/zinc/60/38/90/1051603890.db2.gz FRWVMDGRLVRRMP-UHFFFAOYSA-N -1 1 339.416 4.292 20 0 EIADMM O=C(Nc1ccc(OC(F)F)cc1)Nc1cc([O-])c(Cl)cc1F ZINC001192176941 1051657710 /nfs/dbraw/zinc/65/77/10/1051657710.db2.gz WKLFYNWOYNEUNT-UHFFFAOYSA-N -1 1 346.692 4.430 20 0 EIADMM O=C(Nc1ccc(OC(F)F)cc1)Nc1cccc([O-])c1Cl ZINC001192182393 1051660131 /nfs/dbraw/zinc/66/01/31/1051660131.db2.gz OJQAGHXCONZARK-UHFFFAOYSA-N -1 1 328.702 4.291 20 0 EIADMM CCNC(=O)c1ccc(Nc2c(Cl)ccc([O-])c2Cl)cc1 ZINC001175632780 1051683271 /nfs/dbraw/zinc/68/32/71/1051683271.db2.gz XDEMIHXCRBJNNX-UHFFFAOYSA-N -1 1 325.195 4.192 20 0 EIADMM O=C(NC1(c2cccc3ccccc32)CC1)c1c(F)ccc([O-])c1F ZINC001192556239 1051757318 /nfs/dbraw/zinc/75/73/18/1051757318.db2.gz QSUBXGMJZOPMRA-UHFFFAOYSA-N -1 1 339.341 4.243 20 0 EIADMM C[C@H](NC(=O)c1c(F)ccc([O-])c1F)C12CC3CC(CC(C3)C1)C2 ZINC001192540584 1051764171 /nfs/dbraw/zinc/76/41/71/1051764171.db2.gz XVSNJFSOHKAYGC-INROXSABSA-N -1 1 335.394 4.005 20 0 EIADMM [O-]c1c(Br)ccc(Cl)c1Nc1cnn(C2CCC2)c1 ZINC001175763200 1051773153 /nfs/dbraw/zinc/77/31/53/1051773153.db2.gz YYJFRHFHQFZTFT-UHFFFAOYSA-N -1 1 342.624 4.473 20 0 EIADMM Cc1c2cc(Cl)ccc2oc1C(=O)Nc1nc(Cl)ccc1[O-] ZINC001183209604 1051811549 /nfs/dbraw/zinc/81/15/49/1051811549.db2.gz DSKRZOZBOFCKOP-UHFFFAOYSA-N -1 1 337.162 4.401 20 0 EIADMM Cc1cc(Nc2ccc(F)c(Br)c2[O-])cc(C)c1N ZINC001175937677 1051832794 /nfs/dbraw/zinc/83/27/94/1051832794.db2.gz FWMCTWSRXWBSKL-UHFFFAOYSA-N -1 1 325.181 4.236 20 0 EIADMM CC(C)(NC(=O)c1ccc(F)c([O-])c1)c1ccc(C(F)(F)F)cc1 ZINC001176054810 1051897338 /nfs/dbraw/zinc/89/73/38/1051897338.db2.gz GNLXHLGVOUOUIS-UHFFFAOYSA-N -1 1 341.304 4.215 20 0 EIADMM COc1cc(Nc2ccc(F)c(Br)c2[O-])c(F)cc1F ZINC001176111361 1051915450 /nfs/dbraw/zinc/91/54/50/1051915450.db2.gz OZHOIUXODDQYQC-UHFFFAOYSA-N -1 1 348.118 4.324 20 0 EIADMM CN(C)C(=O)c1ccc(Nc2cc(Cl)c([O-])cc2Cl)c(F)c1 ZINC001176203999 1051952577 /nfs/dbraw/zinc/95/25/77/1051952577.db2.gz CUYVUMQTWHCDBN-UHFFFAOYSA-N -1 1 343.185 4.284 20 0 EIADMM O=C(Nc1cccc(C(F)(F)F)c1[O-])C1CC2(C1)CC(F)(F)C2 ZINC001184203303 1051965570 /nfs/dbraw/zinc/96/55/70/1051965570.db2.gz CXXPBHRFRCWOTO-UHFFFAOYSA-N -1 1 335.272 4.175 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2cccc(F)c2C)c2ccccc12 ZINC001193825255 1052004469 /nfs/dbraw/zinc/00/44/69/1052004469.db2.gz UQDXZEVUBVLGJO-UHFFFAOYSA-N -1 1 329.396 4.397 20 0 EIADMM CCOc1cccc([N-]S(=O)(=O)c2ccc(C)c3ccccc32)c1 ZINC001193864659 1052018663 /nfs/dbraw/zinc/01/86/63/1052018663.db2.gz RAWMJTVNVZGKFM-UHFFFAOYSA-N -1 1 341.432 4.348 20 0 EIADMM C[C@@H](OC(=O)c1ccc([O-])cc1F)c1ccc(OC(F)F)cc1 ZINC000773573459 1052031519 /nfs/dbraw/zinc/03/15/19/1052031519.db2.gz NXAIEEMZAIZRBN-SECBINFHSA-N -1 1 326.270 4.051 20 0 EIADMM [O-]c1c(Cl)c(Cl)ccc1Nc1cnn(Cc2cccnc2)c1 ZINC001176459136 1052081385 /nfs/dbraw/zinc/08/13/85/1052081385.db2.gz WTTCBMHYIPPVLY-UHFFFAOYSA-N -1 1 335.194 4.082 20 0 EIADMM O=C(OCc1csc(-c2ccsc2)n1)c1ccc([O-])cc1F ZINC000773580501 1052136781 /nfs/dbraw/zinc/13/67/81/1052136781.db2.gz ITPQYMJJFMKKSS-UHFFFAOYSA-N -1 1 335.381 4.073 20 0 EIADMM Cc1c(O)cccc1[N-]S(=O)(=O)c1cccc2c(Cl)cccc21 ZINC001194431370 1052152855 /nfs/dbraw/zinc/15/28/55/1052152855.db2.gz JHJCSTPRKGDRCA-UHFFFAOYSA-N -1 1 347.823 4.308 20 0 EIADMM [O-]c1c(F)cc(F)c(Nc2cc(F)c(Cl)nc2Cl)c1F ZINC001176664658 1052157053 /nfs/dbraw/zinc/15/70/53/1052157053.db2.gz UAZNKSVOZOFBHG-UHFFFAOYSA-N -1 1 327.064 4.394 20 0 EIADMM [O-]c1c(F)cc(F)c(Nc2cc(-c3ccc(F)c(F)c3)no2)c1F ZINC001176663524 1052157975 /nfs/dbraw/zinc/15/79/75/1052157975.db2.gz IECOVRQXFDISOH-UHFFFAOYSA-N -1 1 342.223 4.486 20 0 EIADMM CCOC(=O)Nc1ccc(Nc2c(F)cc(F)c([O-])c2F)cc1 ZINC001176673751 1052161220 /nfs/dbraw/zinc/16/12/20/1052161220.db2.gz ZJTIWIIQDVLCLK-UHFFFAOYSA-N -1 1 326.274 4.122 20 0 EIADMM CCOC(=O)CCc1cccc(Nc2c(F)cc(F)c([O-])c2F)c1 ZINC001176674862 1052161233 /nfs/dbraw/zinc/16/12/33/1052161233.db2.gz YZCOIGBWKCQYCQ-UHFFFAOYSA-N -1 1 339.313 4.049 20 0 EIADMM Cc1cnn(-c2ccc(F)cc2)c1Nc1c(F)cc(F)c([O-])c1F ZINC001176662939 1052173205 /nfs/dbraw/zinc/17/32/05/1052173205.db2.gz DADZWKFHQSILPU-UHFFFAOYSA-N -1 1 337.276 4.186 20 0 EIADMM CC(C)c1ccccc1[N-]S(=O)(=O)c1ccc(-c2cnco2)cc1 ZINC001185186073 1052189230 /nfs/dbraw/zinc/18/92/30/1052189230.db2.gz QUIVVCSBHMBTKD-UHFFFAOYSA-N -1 1 342.420 4.266 20 0 EIADMM Cc1cc([N-]S(=O)(=O)c2ccc(-c3cnco3)cc2)cc(C)c1C ZINC001185227455 1052197779 /nfs/dbraw/zinc/19/77/79/1052197779.db2.gz OFIVRFPUIQMGKH-UHFFFAOYSA-N -1 1 342.420 4.068 20 0 EIADMM Cc1cc([N-]S(=O)(=O)c2ccc(-c3cnco3)cc2)ccc1Cl ZINC001185222274 1052198502 /nfs/dbraw/zinc/19/85/02/1052198502.db2.gz PBCPSYPPOSSAOZ-UHFFFAOYSA-N -1 1 348.811 4.104 20 0 EIADMM O=C(CSc1ccccc1Cl)NCc1ccc([O-])c(Cl)c1 ZINC001176988854 1052212643 /nfs/dbraw/zinc/21/26/43/1052212643.db2.gz SINQXPAZQKPJEX-UHFFFAOYSA-N -1 1 342.247 4.108 20 0 EIADMM Cc1ccc(-c2nc(C(=O)NCc3ccc([O-])c(Cl)c3)cs2)o1 ZINC001176988248 1052213646 /nfs/dbraw/zinc/21/36/46/1052213646.db2.gz INNZAEIFOFIIGY-UHFFFAOYSA-N -1 1 348.811 4.001 20 0 EIADMM O=C(Nc1cc([O-])c(Cl)cc1F)Nc1ccc(F)c(F)c1F ZINC001185330198 1052221644 /nfs/dbraw/zinc/22/16/44/1052221644.db2.gz VOOBCFIJDWBQTI-UHFFFAOYSA-N -1 1 334.656 4.246 20 0 EIADMM Cc1ccc(CNC(=O)Nc2cc(Cl)c(Cl)cc2[O-])cc1 ZINC001185403809 1052226124 /nfs/dbraw/zinc/22/61/24/1052226124.db2.gz ZYVBWIYGQDMZMW-UHFFFAOYSA-N -1 1 325.195 4.329 20 0 EIADMM CC(C)[C@@H]1CCCN(C(=O)c2ccc(C(F)(F)F)cc2[O-])CC1 ZINC000622374597 1052228239 /nfs/dbraw/zinc/22/82/39/1052228239.db2.gz UXZPEWHQVYDUPM-GFCCVEGCSA-N -1 1 329.362 4.309 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2ccc3scnc3c2)ccc1Cl ZINC001185525328 1052255626 /nfs/dbraw/zinc/25/56/26/1052255626.db2.gz XWZONGFWPLJBGZ-UHFFFAOYSA-N -1 1 338.841 4.059 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2cccc3cc(O)ccc32)ccc1Cl ZINC001185530109 1052257669 /nfs/dbraw/zinc/25/76/69/1052257669.db2.gz SZIFRUSRYKTPST-UHFFFAOYSA-N -1 1 347.823 4.308 20 0 EIADMM O=C(Nc1cccc(F)c1[O-])Nc1cc(C(F)(F)F)ccc1F ZINC001185616672 1052271003 /nfs/dbraw/zinc/27/10/03/1052271003.db2.gz GRGZLAHVDBUAIB-UHFFFAOYSA-N -1 1 332.228 4.333 20 0 EIADMM CN(C(=O)c1cncc([O-])c1)[C@@H](c1ccc(Cl)cc1)C1CCCC1 ZINC000622579232 1052332986 /nfs/dbraw/zinc/33/29/86/1052332986.db2.gz YZEHRJGARHMQRB-GOSISDBHSA-N -1 1 344.842 4.444 20 0 EIADMM CC(C)CN(C(=O)c1csc(=NC2CC2)[n-]1)c1cccc(Cl)c1 ZINC000622666247 1052367604 /nfs/dbraw/zinc/36/76/04/1052367604.db2.gz PPPKGNVKCLCJPR-UHFFFAOYSA-N -1 1 349.887 4.096 20 0 EIADMM O=C(c1ccc(C(F)(F)F)cc1[O-])N1CC[C@@H](C2CCCCC2)C1 ZINC000622750836 1052428987 /nfs/dbraw/zinc/42/89/87/1052428987.db2.gz RTTQIYKOXBJQRG-CYBMUJFWSA-N -1 1 341.373 4.453 20 0 EIADMM CCC(C)(C)CC(=O)N1CCC[C@H](c2n[n-]c(=S)n2C(C)C)C1 ZINC000073093119 1052697860 /nfs/dbraw/zinc/69/78/60/1052697860.db2.gz AYWRNNGXSHOJSC-ZDUSSCGKSA-N -1 1 338.521 4.054 20 0 EIADMM CCc1noc(C)c1[N-]C(=O)c1csc(-c2c(F)cccc2F)n1 ZINC000179335504 1052731088 /nfs/dbraw/zinc/73/10/88/1052731088.db2.gz OUZZQCTVMJBMAC-UHFFFAOYSA-N -1 1 349.362 4.199 20 0 EIADMM Cc1csc(-c2nc(=O)c3c([n-]2)sc(C)c3-c2ccccc2)n1 ZINC000183640841 1052980042 /nfs/dbraw/zinc/98/00/42/1052980042.db2.gz KUPVGSSNGCHECN-UHFFFAOYSA-N -1 1 339.445 4.392 20 0 EIADMM Cc1noc2ccc([N-]S(=O)(=O)c3cccc(C(C)C)c3)cc12 ZINC001195156806 1053309842 /nfs/dbraw/zinc/30/98/42/1053309842.db2.gz RMCSMDCDSXVPDL-UHFFFAOYSA-N -1 1 330.409 4.060 20 0 EIADMM CCCOc1ccc([N-]S(=O)(=O)c2c(C)cccc2Cl)cc1 ZINC001195308507 1053370497 /nfs/dbraw/zinc/37/04/97/1053370497.db2.gz PVGDWIZKWNKQQH-UHFFFAOYSA-N -1 1 339.844 4.238 20 0 EIADMM CC(C)Cc1ccc([C@@H](C)NC(=O)c2cc([O-])cnc2Cl)cc1 ZINC001195313906 1053375773 /nfs/dbraw/zinc/37/57/73/1053375773.db2.gz AHWNDZAVNOEQEA-GFCCVEGCSA-N -1 1 332.831 4.130 20 0 EIADMM CCOC(=O)NC(=S)[N-]c1ccc(/C=C/c2ccccc2)cc1 ZINC001195484741 1053419105 /nfs/dbraw/zinc/41/91/05/1053419105.db2.gz PQAZFYYUSXPPNP-CMDGGOBGSA-N -1 1 326.421 4.300 20 0 EIADMM CCOC(=O)NC(=S)[N-]c1cccc(Oc2ccc(F)cc2)c1 ZINC001195492380 1053422158 /nfs/dbraw/zinc/42/21/58/1053422158.db2.gz KRMKBEDCRBZBOB-UHFFFAOYSA-N -1 1 334.372 4.061 20 0 EIADMM CCCN(Cc1ccccc1)C(=O)c1ccc(Br)c([O-])c1 ZINC000384384096 1053446745 /nfs/dbraw/zinc/44/67/45/1053446745.db2.gz MNBKNZAXCKPSTG-UHFFFAOYSA-N -1 1 348.240 4.207 20 0 EIADMM [O-]c1cccc(NC(=S)NCc2cccc(Cl)c2)c1Cl ZINC001195981749 1053538218 /nfs/dbraw/zinc/53/82/18/1053538218.db2.gz GFSXEBNDGNIAFM-UHFFFAOYSA-N -1 1 327.236 4.186 20 0 EIADMM [O-]c1c(F)cc(F)cc1NC(=S)Nc1ccc(C(F)(F)F)cc1 ZINC001196197820 1053609108 /nfs/dbraw/zinc/60/91/08/1053609108.db2.gz WMHUAGLGBDFPEL-UHFFFAOYSA-N -1 1 348.296 4.498 20 0 EIADMM O=C([N-]c1ccnc(Cl)c1Cl)c1snc(Cl)c1Cl ZINC001196334616 1053643034 /nfs/dbraw/zinc/64/30/34/1053643034.db2.gz XMOHGFLDHYWIRJ-UHFFFAOYSA-N -1 1 343.022 4.404 20 0 EIADMM O=C([N-]c1cc(F)cc2cccnc21)c1snc(Cl)c1Cl ZINC001196342085 1053644669 /nfs/dbraw/zinc/64/46/69/1053644669.db2.gz NDQFHKPVHQECNG-UHFFFAOYSA-N -1 1 342.182 4.390 20 0 EIADMM [O-]c1c(F)cccc1NC(=S)Nc1ccc(Br)cc1 ZINC001196621269 1053716206 /nfs/dbraw/zinc/71/62/06/1053716206.db2.gz QCZJRJXENIFBGL-UHFFFAOYSA-N -1 1 341.205 4.103 20 0 EIADMM C[C@]1(CC(=O)Nc2cc(F)c([O-])cc2Cl)CC1(Cl)Cl ZINC000885678940 1053811581 /nfs/dbraw/zinc/81/15/81/1053811581.db2.gz YKBNZYJLPNFEJY-NSHDSACASA-N -1 1 326.582 4.097 20 0 EIADMM [O-]c1cc(F)c(F)cc1NC(=S)Nc1ccccc1C(F)(F)F ZINC001197263721 1053865127 /nfs/dbraw/zinc/86/51/27/1053865127.db2.gz ZSCBMCGXGANQMZ-UHFFFAOYSA-N -1 1 348.296 4.498 20 0 EIADMM [O-]c1cc(NC(=S)NCc2ccc(Cl)cc2)c(F)cc1Cl ZINC001197581283 1053933533 /nfs/dbraw/zinc/93/35/33/1053933533.db2.gz WXZZHNGJINABGQ-UHFFFAOYSA-N -1 1 345.226 4.325 20 0 EIADMM CC(C)(C)c1ccc([C@H](O)CCC(=O)Nc2c([O-])cccc2F)cc1 ZINC000855555896 1053944826 /nfs/dbraw/zinc/94/48/26/1053944826.db2.gz IPRPDYRRYLQMOD-MRXNPFEDSA-N -1 1 345.414 4.281 20 0 EIADMM O=C([N-]c1nnc(C(F)(F)F)s1)c1cc2cc(Cl)ccc2o1 ZINC000029289130 1054001110 /nfs/dbraw/zinc/00/11/10/1054001110.db2.gz PFEVICFDSLHVLX-UHFFFAOYSA-N -1 1 347.705 4.209 20 0 EIADMM Cc1ccc(NC(=S)Nc2cccc([O-])c2Br)cc1 ZINC001197934674 1054029601 /nfs/dbraw/zinc/02/96/01/1054029601.db2.gz YBWVGNOQLOYTIM-UHFFFAOYSA-N -1 1 337.242 4.272 20 0 EIADMM CN(Cc1ccc(F)cc1F)C(=O)c1cc2ccccc2cc1[O-] ZINC000031025705 1054053078 /nfs/dbraw/zinc/05/30/78/1054053078.db2.gz XOMINSXJJWHFRB-UHFFFAOYSA-N -1 1 327.330 4.096 20 0 EIADMM CC(C)(C)OC(=O)Nc1ccc(C(=O)NC2(C)CCCCC2)c([O-])c1 ZINC000857440903 1054240895 /nfs/dbraw/zinc/24/08/95/1054240895.db2.gz KNBBOTQWQKFGPP-UHFFFAOYSA-N -1 1 348.443 4.192 20 0 EIADMM O=c1cc(CSc2ccc3ccccc3n2)c2ccc([O-])cc2o1 ZINC000005627098 1054834636 /nfs/dbraw/zinc/83/46/36/1054834636.db2.gz NKXABDBHQXPTFZ-UHFFFAOYSA-N -1 1 335.384 4.339 20 0 EIADMM COc1cccc(NC(=O)Nc2cccc(C(F)(F)F)c2[O-])c1 ZINC001202280470 1055123042 /nfs/dbraw/zinc/12/30/42/1055123042.db2.gz GRBGCDMNNHNUAS-UHFFFAOYSA-N -1 1 326.274 4.064 20 0 EIADMM O=C1N[C@@H](c2cccc([O-])c2Cl)Nc2c3ccccc3sc21 ZINC000877855695 1055139770 /nfs/dbraw/zinc/13/97/70/1055139770.db2.gz TUABVKLPNQPRCX-HNNXBMFYSA-N -1 1 330.796 4.114 20 0 EIADMM CC(C)[C@@H]1c2ccccc2CC[N@@H+]1Cc1nnc(-c2ccccc2O)o1 ZINC000878195128 1055202534 /nfs/dbraw/zinc/20/25/34/1055202534.db2.gz NVAYWVNXVGSFJU-HXUWFJFHSA-N -1 1 349.434 4.198 20 0 EIADMM CCOc1ccc(SCC(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000111667170 1055226343 /nfs/dbraw/zinc/22/63/43/1055226343.db2.gz GGZNPXQUDYJYGW-UHFFFAOYSA-N -1 1 337.828 4.175 20 0 EIADMM CC(=O)n1ncc2ccc(Nc3c(Cl)ccc([O-])c3Cl)cc21 ZINC001212420595 1055726965 /nfs/dbraw/zinc/72/69/65/1055726965.db2.gz BPSUQNXEUQVAEE-UHFFFAOYSA-N -1 1 336.178 4.452 20 0 EIADMM Cc1nc(-c2cccc([N-]S(=O)(=O)c3ccc(C)cc3)c2)oc1C ZINC000108238068 1055992385 /nfs/dbraw/zinc/99/23/85/1055992385.db2.gz OWYSJEVHLSULDU-UHFFFAOYSA-N -1 1 342.420 4.068 20 0 EIADMM COc1ccccc1[C@H]1CC[C@H](C)CN1C(=O)c1ccc([O-])c(F)c1 ZINC000672141440 1056666655 /nfs/dbraw/zinc/66/66/55/1056666655.db2.gz JRARLLGITWHVEC-SUMWQHHRSA-N -1 1 343.398 4.153 20 0 EIADMM [O-]c1c(F)cc(Nc2cc(F)cnc2Br)cc1Cl ZINC001214482620 1056722446 /nfs/dbraw/zinc/72/24/46/1056722446.db2.gz FDYOOUBBSUBCJP-UHFFFAOYSA-N -1 1 335.535 4.225 20 0 EIADMM CC(C)(C)n1cc([N-]c2nn3cc(-c4ccccc4)nc3s2)cn1 ZINC000744171328 1059300628 /nfs/dbraw/zinc/30/06/28/1059300628.db2.gz LPNZEKZLHGVDTI-UHFFFAOYSA-N -1 1 338.440 4.153 20 0 EIADMM CCSc1ccccc1C(=O)OCCc1cc(C(C)=O)ccc1[O-] ZINC000744611573 1059590766 /nfs/dbraw/zinc/59/07/66/1059590766.db2.gz VYICFCCVTHUYIP-UHFFFAOYSA-N -1 1 344.432 4.106 20 0 EIADMM CC(=O)c1ccc([O-])c(CCOC(=O)C[C@@H](C)c2cccc(F)c2)c1 ZINC000745050358 1059708845 /nfs/dbraw/zinc/70/88/45/1059708845.db2.gz KNMQKGDUHWJEBI-CYBMUJFWSA-N -1 1 344.382 4.013 20 0 EIADMM CC[C@H](CC1CCCC1)C(=O)OCCc1cc(C(C)=O)ccc1[O-] ZINC000745040839 1059710474 /nfs/dbraw/zinc/71/04/74/1059710474.db2.gz XAYIFALVHXGXRJ-MRXNPFEDSA-N -1 1 332.440 4.287 20 0 EIADMM COC(=O)c1c[n-]c(S[C@H](C)c2ccc(C(F)(F)F)cc2)n1 ZINC000193540020 1032157639 /nfs/dbraw/zinc/15/76/39/1032157639.db2.gz NTFLCQLVTBXHEJ-MRVPVSSYSA-N -1 1 330.331 4.068 20 0 EIADMM Cc1cc(OCC(=O)Nc2ccc([O-])c(Cl)c2)ccc1Cl ZINC000532749130 1032286855 /nfs/dbraw/zinc/28/68/55/1032286855.db2.gz PGTILPWBZACDEH-UHFFFAOYSA-N -1 1 326.179 4.025 20 0 EIADMM Cc1ccccc1[C@@H]1C[C@@H](C)N(C(=O)c2c([O-])cccc2Cl)C1 ZINC000738543778 1032420693 /nfs/dbraw/zinc/42/06/93/1032420693.db2.gz KKFJZGYKMAUKGK-ZIAGYGMSSA-N -1 1 329.827 4.372 20 0 EIADMM O=C(C[C@@H]1CCCC[C@H]1O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000529538875 1032429283 /nfs/dbraw/zinc/42/92/83/1032429283.db2.gz MFBRKZOVRJIENM-MEDUHNTESA-N -1 1 333.815 4.079 20 0 EIADMM O=C([O-])[C@H]1C[C@@H](C2CCCCC2)CN1Cc1nc2ccccc2s1 ZINC000579735493 1018845150 /nfs/dbraw/zinc/84/51/50/1018845150.db2.gz FWZHKNUCTNYABS-GDBMZVCRSA-N -1 1 344.480 4.152 20 0 EIADMM CC(C)Sc1ccccc1[N-]S(=O)(=O)c1ccc(F)cc1 ZINC000471135723 1019082873 /nfs/dbraw/zinc/08/28/73/1019082873.db2.gz DEWXJPVLWHKPDO-UHFFFAOYSA-N -1 1 325.430 4.127 20 0 EIADMM O=C([O-])c1cccc(CNCc2cc(C(F)(F)F)ccc2Cl)c1 ZINC000683176587 1019106849 /nfs/dbraw/zinc/10/68/49/1019106849.db2.gz MFKAOHILOHCYSD-UHFFFAOYSA-N -1 1 343.732 4.347 20 0 EIADMM O=C(/C=C/c1ccc2ccc(Cl)cc2n1)Nc1c([O-])cccc1F ZINC000092550742 1019245672 /nfs/dbraw/zinc/24/56/72/1019245672.db2.gz YTRHRAMFFKPNRF-CMDGGOBGSA-N -1 1 342.757 4.385 20 0 EIADMM O=C(Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)c1ccc(Cl)c(Cl)c1 ZINC000510140467 1019894135 /nfs/dbraw/zinc/89/41/35/1019894135.db2.gz QJTFJZKBWUZHHW-UHFFFAOYSA-N -1 1 348.189 4.341 20 0 EIADMM C[C@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)c1cncc([O-])c1 ZINC000339897807 1020055998 /nfs/dbraw/zinc/05/59/98/1020055998.db2.gz VKQPWPOQYJFTMD-OAHLLOKOSA-N -1 1 332.403 4.287 20 0 EIADMM C[C@@H](Oc1ccccc1NC(=O)c1cncc([O-])c1)c1ccccc1 ZINC000339955004 1020196252 /nfs/dbraw/zinc/19/62/52/1020196252.db2.gz LAQZDZRDIRUWTC-CQSZACIVSA-N -1 1 334.375 4.180 20 0 EIADMM Cc1ccccc1-c1cnc(CSc2nc(C3CC3)cc(=O)[n-]2)o1 ZINC000683454555 1020852401 /nfs/dbraw/zinc/85/24/01/1020852401.db2.gz KXZNGILOTXXADO-UHFFFAOYSA-N -1 1 339.420 4.315 20 0 EIADMM Cc1nc2ccccc2c(C)c1Cc1nc(-c2ccc([O-])c(F)c2)no1 ZINC000683594197 1020954433 /nfs/dbraw/zinc/95/44/33/1020954433.db2.gz TXBZYGVBKCTMSH-UHFFFAOYSA-N -1 1 349.365 4.337 20 0 EIADMM O=C(N[C@@H](c1ccccc1)C(F)F)c1ccc(C(F)(F)F)c([O-])c1 ZINC000647100954 1021054125 /nfs/dbraw/zinc/05/41/25/1021054125.db2.gz FJVLTDXGKUYFBF-ZDUSSCGKSA-N -1 1 345.267 4.147 20 0 EIADMM Cc1noc(C2CC2)c1[N-]C(=O)c1coc(-c2c(F)cccc2F)n1 ZINC001266577117 1021663448 /nfs/dbraw/zinc/66/34/48/1021663448.db2.gz XETCFSLJONUVDV-UHFFFAOYSA-N -1 1 345.305 4.046 20 0 EIADMM O=C(Nc1cc([O-])c(F)cc1F)c1cccc2c3c([nH]c21)CCCC3 ZINC001625893086 1022082752 /nfs/dbraw/zinc/08/27/52/1022082752.db2.gz FQSCDUJZRDQQHV-UHFFFAOYSA-N -1 1 342.345 4.283 20 0 EIADMM Cc1nc(-c2ccc(C(=O)Nc3cc([O-])c(F)cc3F)cc2)cs1 ZINC001625894044 1022172589 /nfs/dbraw/zinc/17/25/89/1022172589.db2.gz PPEDBHNDXXVQOF-UHFFFAOYSA-N -1 1 346.358 4.355 20 0 EIADMM Cc1nc(-c2ccccc2)sc1[N-]S(=O)(=O)CCC(C)(C)C ZINC000580546183 1022189527 /nfs/dbraw/zinc/18/95/27/1022189527.db2.gz IWZFQWGJIKIHEU-UHFFFAOYSA-N -1 1 338.498 4.296 20 0 EIADMM CC(C)(C)CC[C@@H](NCc1ccc(CSC(F)F)o1)C(=O)[O-] ZINC000756379963 1022546519 /nfs/dbraw/zinc/54/65/19/1022546519.db2.gz DLNCHYJXYNTUMO-GFCCVEGCSA-N -1 1 335.416 4.105 20 0 EIADMM Cc1cc2[n-]c(-c3cc(Cl)c4c(c3)OCCCO4)nc(=O)c2s1 ZINC000656490841 1023042988 /nfs/dbraw/zinc/04/29/88/1023042988.db2.gz GZBFEGLUTJXEQU-UHFFFAOYSA-N -1 1 348.811 4.187 20 0 EIADMM Cc1c2cccc(Cl)c2[nH]c1C(=O)Nc1cc([O-])c(F)cc1F ZINC001625896159 1023063140 /nfs/dbraw/zinc/06/31/40/1023063140.db2.gz GCSLZMWPIBOUNX-UHFFFAOYSA-N -1 1 336.725 4.366 20 0 EIADMM CO[C@@H](CSc1nc(-c2ccccc2)c(C)c(=O)[n-]1)CC(C)C ZINC000416906498 1023069772 /nfs/dbraw/zinc/06/97/72/1023069772.db2.gz KVBKGNSVKFLRAY-OAHLLOKOSA-N -1 1 332.469 4.311 20 0 EIADMM CC(=O)OCCCc1cccc(NCc2cccc(Cl)c2[O-])c1 ZINC000188529070 1023126097 /nfs/dbraw/zinc/12/60/97/1023126097.db2.gz CEZDNBLQIFOWQG-UHFFFAOYSA-N -1 1 333.815 4.153 20 0 EIADMM CC(=O)c1ccc(C(=O)[N-]c2nc(-c3ccc(C)s3)ns2)s1 ZINC000589354258 1023128994 /nfs/dbraw/zinc/12/89/94/1023128994.db2.gz RJKLCBRJTFWQHH-UHFFFAOYSA-N -1 1 349.462 4.091 20 0 EIADMM C[C@@H](c1c(F)cccc1F)N1CCC(C(=O)c2ccc([O-])cc2)CC1 ZINC000613578207 1023135448 /nfs/dbraw/zinc/13/54/48/1023135448.db2.gz DTISONPTIHGOOE-ZDUSSCGKSA-N -1 1 345.389 4.326 20 0 EIADMM COc1ccccc1C/C(C)=C\C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000588412931 1023230276 /nfs/dbraw/zinc/23/02/76/1023230276.db2.gz RVVWVEMMBJOADG-BENRWUELSA-N -1 1 331.799 4.182 20 0 EIADMM O=C(NCC(c1ccccc1)c1ccccc1)c1ccc([O-])cc1F ZINC000181039973 1023234807 /nfs/dbraw/zinc/23/48/07/1023234807.db2.gz QHRYNRWQYNQRFH-UHFFFAOYSA-N -1 1 335.378 4.093 20 0 EIADMM CCOc1cc(C(=O)NC23CC4CC(CC(C4)C2)C3)cc(Cl)c1[O-] ZINC000215886782 1023268424 /nfs/dbraw/zinc/26/84/24/1023268424.db2.gz BSQBVRJBAYMKNT-UHFFFAOYSA-N -1 1 349.858 4.143 20 0 EIADMM C[C@@H]1CC[C@H](C(=O)[O-])[C@H](C)[N@H+]1Cc1cc(Cl)ccc1OC(F)F ZINC000659797782 1023279945 /nfs/dbraw/zinc/27/99/45/1023279945.db2.gz QYRPDEOTVUVPIN-NRUUGDAUSA-N -1 1 347.789 4.015 20 0 EIADMM C[C@@H]1CC[C@H](C(=O)[O-])[C@H](C)N1Cc1cc(Cl)ccc1OC(F)F ZINC000659797782 1023279953 /nfs/dbraw/zinc/27/99/53/1023279953.db2.gz QYRPDEOTVUVPIN-NRUUGDAUSA-N -1 1 347.789 4.015 20 0 EIADMM O=C([O-])C[C@H](NCc1ccc(C2CC2)cc1)c1ccc(F)cc1F ZINC000417564682 1023358526 /nfs/dbraw/zinc/35/85/26/1023358526.db2.gz OVNDHEFNAIKAOX-SFHVURJKSA-N -1 1 331.362 4.148 20 0 EIADMM CCCc1ccc(S(=O)(=O)[N-]c2ccc(-c3cnco3)cc2)cc1 ZINC000511639547 1023368359 /nfs/dbraw/zinc/36/83/59/1023368359.db2.gz LQDSDPGRFDXHJQ-UHFFFAOYSA-N -1 1 342.420 4.095 20 0 EIADMM CC(C)=CCSC[C@H](NCc1c(Cl)cccc1Cl)C(=O)[O-] ZINC000417620001 1023375504 /nfs/dbraw/zinc/37/55/04/1023375504.db2.gz CGPTXGFODFDFNJ-AWEZNQCLSA-N -1 1 348.295 4.236 20 0 EIADMM CCc1ccc(-c2ccc(CN[C@@H](C(=O)[O-])[C@@H](C)C3CC3)o2)cc1 ZINC000417640965 1023392413 /nfs/dbraw/zinc/39/24/13/1023392413.db2.gz NWXRBYNEWUFDQL-ORAYPTAESA-N -1 1 327.424 4.098 20 0 EIADMM O=C(CCc1ccccc1C(F)(F)F)Nc1cc([O-])c(F)cc1F ZINC001625897270 1023445634 /nfs/dbraw/zinc/44/56/34/1023445634.db2.gz WYJMUQNCMGGIEU-UHFFFAOYSA-N -1 1 345.267 4.261 20 0 EIADMM CC(C)Cc1ccc(C(=O)Nc2ccc(-c3cc(=O)[nH][n-]3)cc2)cc1 ZINC000613663721 1023468237 /nfs/dbraw/zinc/46/82/37/1023468237.db2.gz AHZYGALKYOMOBH-UHFFFAOYSA-N -1 1 335.407 4.233 20 0 EIADMM O=C(Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)c1ccc2ccccc2c1 ZINC000613663760 1023468832 /nfs/dbraw/zinc/46/88/32/1023468832.db2.gz FCXFEHSUCRGTIX-UHFFFAOYSA-N -1 1 329.359 4.188 20 0 EIADMM O=C(CCCC1CCCCC1)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC000613667739 1023494650 /nfs/dbraw/zinc/49/46/50/1023494650.db2.gz FWUCFKMYETZZJT-UHFFFAOYSA-N -1 1 327.428 4.471 20 0 EIADMM C[C@@H]1CCN(Cc2csc(-c3ccc(C(=O)[O-])cc3)n2)[C@H](C)C1 ZINC000656756354 1023499270 /nfs/dbraw/zinc/49/92/70/1023499270.db2.gz DIYFQAAPIJPLFJ-CHWSQXEVSA-N -1 1 330.453 4.129 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2ccc(Cl)c(F)c2)cc(C)c1F ZINC000460438439 1023551309 /nfs/dbraw/zinc/55/13/09/1023551309.db2.gz TVEOEFUOCHPSBQ-UHFFFAOYSA-N -1 1 331.771 4.036 20 0 EIADMM CCc1ccccc1[N-]S(=O)(=O)c1ccc(C)c(C(F)(F)F)c1 ZINC000500306310 1023678643 /nfs/dbraw/zinc/67/86/43/1023678643.db2.gz RVJHTQGYLNDVBT-UHFFFAOYSA-N -1 1 343.370 4.377 20 0 EIADMM CC1(C)CCCN(Cc2csc(-c3ccc(C(=O)[O-])cc3)n2)C1 ZINC000581829941 1023746602 /nfs/dbraw/zinc/74/66/02/1023746602.db2.gz QCVPCFHONRRQRL-UHFFFAOYSA-N -1 1 330.453 4.130 20 0 EIADMM Cc1ccccc1[C@H](C)CC(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC000341630747 1023992422 /nfs/dbraw/zinc/99/24/22/1023992422.db2.gz UHUKIHGZHFQYHK-CQSZACIVSA-N -1 1 335.407 4.223 20 0 EIADMM Cc1ccc(C(C)(C)CN(C)C(=O)c2c(F)ccc([O-])c2F)cc1 ZINC000518619164 1024510945 /nfs/dbraw/zinc/51/09/45/1024510945.db2.gz IWXNCMIRBLOCDF-UHFFFAOYSA-N -1 1 333.378 4.029 20 0 EIADMM CSc1ccc([N-]S(=O)(=O)c2ccc(Cl)cc2C)cc1 ZINC000048653717 1024676373 /nfs/dbraw/zinc/67/63/73/1024676373.db2.gz NZJKDGJBAGMAAH-UHFFFAOYSA-N -1 1 327.858 4.171 20 0 EIADMM Cc1cc(C)c(S(=O)(=O)[N-]c2c(F)cccc2NC(C)C)s1 ZINC000431142064 1024693255 /nfs/dbraw/zinc/69/32/55/1024693255.db2.gz ZDQCHQMJPKVKMK-UHFFFAOYSA-N -1 1 342.461 4.125 20 0 EIADMM C[C@H]1CCC[C@H](C)N1Cc1csc(-c2ccc(C(=O)[O-])cc2)n1 ZINC000652367187 1024752064 /nfs/dbraw/zinc/75/20/64/1024752064.db2.gz WYUPFHOMZQKZIG-STQMWFEESA-N -1 1 330.453 4.271 20 0 EIADMM CC(=O)c1ccc(Cl)c([N-]S(=O)(=O)c2sc(C)cc2C)c1 ZINC000431174218 1024778969 /nfs/dbraw/zinc/77/89/69/1024778969.db2.gz ADIDGIYPMDPSTQ-UHFFFAOYSA-N -1 1 343.857 4.022 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N1CCCCC[C@H]1[C@@H]1CCCCC1=O ZINC000092429906 1024806076 /nfs/dbraw/zinc/80/60/76/1024806076.db2.gz YQNZSAIMAVGEAL-HOCLYGCPSA-N -1 1 349.858 4.190 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N1CCCCC[C@@H]1[C@H]1CCCCC1=O ZINC000092429908 1024806294 /nfs/dbraw/zinc/80/62/94/1024806294.db2.gz YQNZSAIMAVGEAL-GDBMZVCRSA-N -1 1 349.858 4.190 20 0 EIADMM CN(Cc1csc(-c2ccc(C(=O)[O-])cc2)n1)CC1CCCC1 ZINC000652404606 1024809995 /nfs/dbraw/zinc/80/99/95/1024809995.db2.gz JRVZMLFVIOZPAP-UHFFFAOYSA-N -1 1 330.453 4.130 20 0 EIADMM C[C@H](c1cccs1)N(C)C(=O)c1ccc(Br)c([O-])c1 ZINC000133162705 1024831653 /nfs/dbraw/zinc/83/16/53/1024831653.db2.gz ZFSKECWRUAAMBS-SECBINFHSA-N -1 1 340.242 4.049 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1C[C@H]2CCC(=O)c3cccc1c32 ZINC000184381406 1024847011 /nfs/dbraw/zinc/84/70/11/1024847011.db2.gz SDEBVKQFNMWSSH-OAHLLOKOSA-N -1 1 343.382 4.266 20 0 EIADMM Cc1ccc(-c2nc(CN3CCC[C@H](C(C)(C)C(=O)[O-])C3)cs2)o1 ZINC000652497801 1024861252 /nfs/dbraw/zinc/86/12/52/1024861252.db2.gz JELYEJLBCWCGHY-ZDUSSCGKSA-N -1 1 348.468 4.034 20 0 EIADMM O=C([O-])C[C@@H]1CCCCN1Cc1ccc(Cl)c(C(F)(F)F)c1 ZINC000662214425 1024965355 /nfs/dbraw/zinc/96/53/55/1024965355.db2.gz MHHWZESHGKLNCB-NSHDSACASA-N -1 1 335.753 4.188 20 0 EIADMM COc1ccc(CN(C(=O)c2cc3ccccc3cc2[O-])C2CC2)cc1 ZINC000215686431 1025208433 /nfs/dbraw/zinc/20/84/33/1025208433.db2.gz SETLEWJALKHINX-UHFFFAOYSA-N -1 1 347.414 4.359 20 0 EIADMM Cc1oc(-c2ccccc2)nc1C(=O)[N-]c1nc(C(C)(C)C)ns1 ZINC000068074347 1025359476 /nfs/dbraw/zinc/35/94/76/1025359476.db2.gz GTYSYUZIOOODEI-UHFFFAOYSA-N -1 1 342.424 4.051 20 0 EIADMM Cc1cc(Cl)ccc1S(=O)(=O)[N-]c1ccc2ncsc2c1 ZINC000519121619 1025514888 /nfs/dbraw/zinc/51/48/88/1025514888.db2.gz VNOPLDFOIBLBHT-UHFFFAOYSA-N -1 1 338.841 4.059 20 0 EIADMM Cc1ccc([C@@H](C)[N@@H+](C)Cc2nc(=O)c3sccc3[n-]2)c(C)c1 ZINC000299005019 1025669488 /nfs/dbraw/zinc/66/94/88/1025669488.db2.gz MZNQCXVOXOEOJG-CYBMUJFWSA-N -1 1 327.453 4.207 20 0 EIADMM O=S(=O)([N-]c1ccc(F)cc1Cl)c1cccc(Cl)c1F ZINC000048652815 1026028807 /nfs/dbraw/zinc/02/88/07/1026028807.db2.gz RIXATFPGSMLVGI-UHFFFAOYSA-N -1 1 338.162 4.072 20 0 EIADMM O=C(Cc1ccc(C(F)(F)F)cc1)Nc1ccc([O-])c(Cl)c1 ZINC000111667785 1026313337 /nfs/dbraw/zinc/31/33/37/1026313337.db2.gz VDOHCJLMEGLFFD-UHFFFAOYSA-N -1 1 329.705 4.246 20 0 EIADMM Cc1oc(-c2cccs2)nc1CC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000111666530 1026313966 /nfs/dbraw/zinc/31/39/66/1026313966.db2.gz TVIQOZMGZBPVEE-UHFFFAOYSA-N -1 1 348.811 4.252 20 0 EIADMM Cc1oc(-c2ccsc2)nc1CC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000111666436 1026315748 /nfs/dbraw/zinc/31/57/48/1026315748.db2.gz WXGIYRQZJMTKNB-UHFFFAOYSA-N -1 1 348.811 4.252 20 0 EIADMM O=C([O-])c1cccc(CN2CCC(c3ccsc3)CC2)c1Cl ZINC000563282380 1026328068 /nfs/dbraw/zinc/32/80/68/1026328068.db2.gz KKWXMPDNWLOXSL-UHFFFAOYSA-N -1 1 335.856 4.479 20 0 EIADMM O=C([O-])c1ccc(C[N@H+]2CC[C@@H](C(F)(F)F)C3(CCC3)C2)s1 ZINC000563282393 1026328159 /nfs/dbraw/zinc/32/81/59/1026328159.db2.gz KTSGJGQMODDENM-GFCCVEGCSA-N -1 1 333.375 4.001 20 0 EIADMM Cc1ccc(-c2ncc(CN[C@@H](CC(=O)[O-])c3ccsc3)s2)o1 ZINC000426672855 1026427715 /nfs/dbraw/zinc/42/77/15/1026427715.db2.gz UIQAVDLBTUXBIB-ZDUSSCGKSA-N -1 1 348.449 4.079 20 0 EIADMM CC(C)Cn1ncc(NC(=O)Nc2ccc([O-])c(Cl)c2)c1C1CC1 ZINC000582319532 1026446492 /nfs/dbraw/zinc/44/64/92/1026446492.db2.gz RHBSNGVADMVUBM-UHFFFAOYSA-N -1 1 348.834 4.420 20 0 EIADMM O=C([O-])C[C@H](NCc1ccc(-c2ccccc2)o1)c1ccsc1 ZINC000426686933 1026476092 /nfs/dbraw/zinc/47/60/92/1026476092.db2.gz HSSVZOZSTOYAJM-INIZCTEOSA-N -1 1 327.405 4.314 20 0 EIADMM O=C([O-])Cc1ccccc1CNCc1c(Cl)oc2ccccc21 ZINC000426681121 1026482540 /nfs/dbraw/zinc/48/25/40/1026482540.db2.gz VCOCAUQKAAWRPM-UHFFFAOYSA-N -1 1 329.783 4.003 20 0 EIADMM O=C([O-])C[C@H](NCc1csc2ccccc12)c1ccc(F)cc1F ZINC000426824193 1026581319 /nfs/dbraw/zinc/58/13/19/1026581319.db2.gz GVSXGWSXURJCJS-INIZCTEOSA-N -1 1 347.386 4.485 20 0 EIADMM CC(C)(C)CC[N-]S(=O)(=O)c1c(Cl)cccc1C(F)(F)F ZINC000606904138 1026621727 /nfs/dbraw/zinc/62/17/27/1026621727.db2.gz UVMZNBSIAGIGHV-UHFFFAOYSA-N -1 1 343.798 4.073 20 0 EIADMM CCCOc1ccccc1NC(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684870893 1026634017 /nfs/dbraw/zinc/63/40/17/1026634017.db2.gz PDOYKWICKMKYCG-UHFFFAOYSA-N -1 1 339.313 4.452 20 0 EIADMM CN(Cc1ccc(Br)o1)Cc1cccc([O-])c1Cl ZINC000507186670 1026680128 /nfs/dbraw/zinc/68/01/28/1026680128.db2.gz GICXTFXUWREPBF-UHFFFAOYSA-N -1 1 330.609 4.033 20 0 EIADMM COc1c(Br)cc(F)cc1Nc1c([O-])cc(F)cc1F ZINC001211712480 1026728970 /nfs/dbraw/zinc/72/89/70/1026728970.db2.gz JSRLCFWIVBOBEX-UHFFFAOYSA-N -1 1 348.118 4.324 20 0 EIADMM [O-]c1cccc(CN2CCn3cccc3[C@H]2c2ccccc2)c1Cl ZINC000507296189 1026733479 /nfs/dbraw/zinc/73/34/79/1026733479.db2.gz UBHLZHLBIDRYLC-HXUWFJFHSA-N -1 1 338.838 4.452 20 0 EIADMM CCN(C(=O)c1ncc(C)cc1[O-])C(c1ccccc1)c1ccccc1 ZINC000427178776 1026756657 /nfs/dbraw/zinc/75/66/57/1026756657.db2.gz NCODNRAKZAIODJ-UHFFFAOYSA-N -1 1 346.430 4.347 20 0 EIADMM COCC1(c2noc(-c3cc(SC)ccc3[O-])n2)CCCCC1 ZINC000664888940 1026896154 /nfs/dbraw/zinc/89/61/54/1026896154.db2.gz YKRGVXCOKCVTDD-UHFFFAOYSA-N -1 1 334.441 4.012 20 0 EIADMM O=C(Nc1c([O-])cc(Br)cc1Cl)[C@@H]1CC=CCC1 ZINC000519723688 1026959824 /nfs/dbraw/zinc/95/98/24/1026959824.db2.gz DWMVULOVTIZMRP-MRVPVSSYSA-N -1 1 330.609 4.103 20 0 EIADMM CCc1nc(SCc2cc(C)ccc2OC(F)F)[n-]c(=O)c1C ZINC000563439699 1026962077 /nfs/dbraw/zinc/96/20/77/1026962077.db2.gz NQSDYRSMTHUYTF-UHFFFAOYSA-N -1 1 340.395 4.255 20 0 EIADMM CCOc1cc(-c2noc([C@H]3CCCS3)n2)cc(Cl)c1[O-] ZINC000277836550 1027041747 /nfs/dbraw/zinc/04/17/47/1027041747.db2.gz FLOINPOTRBBTAF-LLVKDONJSA-N -1 1 326.805 4.062 20 0 EIADMM CCC[C@]1(C)CCCN(C(=O)c2cc(Br)ccc2[O-])C1 ZINC000440922333 1027120375 /nfs/dbraw/zinc/12/03/75/1027120375.db2.gz FSJAINGZIVNZLU-MRXNPFEDSA-N -1 1 340.261 4.197 20 0 EIADMM Cc1nc(-c2ccc(NCC(C(C)C)C(C)C)nc2)[n-]c(=O)c1C ZINC000302832591 1027410119 /nfs/dbraw/zinc/41/01/19/1027410119.db2.gz ROUBUFIKBQCIAQ-UHFFFAOYSA-N -1 1 328.460 4.201 20 0 EIADMM CN(C)C(=O)c1cc(Nc2c(Cl)ccc([O-])c2Cl)ccc1F ZINC001211858043 1027560059 /nfs/dbraw/zinc/56/00/59/1027560059.db2.gz JGIBXKKEIBURKY-UHFFFAOYSA-N -1 1 343.185 4.284 20 0 EIADMM Cc1ccc(F)c(CN(C)C(=O)c2ccc(C(F)(F)F)cc2[O-])c1 ZINC000444427583 1027580424 /nfs/dbraw/zinc/58/04/24/1027580424.db2.gz ARDNXXTVYJNZCV-UHFFFAOYSA-N -1 1 341.304 4.131 20 0 EIADMM COc1cc(C(=O)N(Cc2ccco2)C2CCCC2)cc(Cl)c1[O-] ZINC000153641668 1027812794 /nfs/dbraw/zinc/81/27/94/1027812794.db2.gz SXKCVKJAKOCVRP-UHFFFAOYSA-N -1 1 349.814 4.232 20 0 EIADMM COc1cc(C(=O)N2CC[C@H](C)C[C@H]2c2ccco2)cc(Cl)c1[O-] ZINC000153928008 1028066073 /nfs/dbraw/zinc/06/60/73/1028066073.db2.gz XMHDYIGAPMTWEH-FZMZJTMJSA-N -1 1 349.814 4.261 20 0 EIADMM C[C@@H](C(=O)OC(C)(C)C)c1noc(-c2ccc3ccccc3c2[O-])n1 ZINC000281024280 1028349345 /nfs/dbraw/zinc/34/93/45/1028349345.db2.gz ZPPSORFEWMKYPT-LLVKDONJSA-N -1 1 340.379 4.041 20 0 EIADMM CCOc1cc(-c2noc(-c3cc(C)ccc3O)n2)cc(Cl)c1[O-] ZINC000445431766 1028529916 /nfs/dbraw/zinc/52/99/16/1028529916.db2.gz QEEUQSBCZNTCCD-UHFFFAOYSA-N -1 1 346.770 4.175 20 0 EIADMM CCOc1cc(-c2noc(-c3ccc(C)c(O)c3)n2)cc(Cl)c1[O-] ZINC000445419256 1028535131 /nfs/dbraw/zinc/53/51/31/1028535131.db2.gz QWQJJRBUIYFEFY-UHFFFAOYSA-N -1 1 346.770 4.175 20 0 EIADMM C[C@@H](Oc1ccc(F)cc1)c1nc(-c2ccc([O-])cc2Cl)no1 ZINC000445450786 1028541137 /nfs/dbraw/zinc/54/11/37/1028541137.db2.gz WQKOKTUENPAZSH-SECBINFHSA-N -1 1 334.734 4.375 20 0 EIADMM Cc1cccc(OCCCc2nc(-c3ccc([O-])cc3Cl)no2)c1 ZINC000445450613 1028541826 /nfs/dbraw/zinc/54/18/26/1028541826.db2.gz ZFBNFSYEJAHJKB-UHFFFAOYSA-N -1 1 344.798 4.416 20 0 EIADMM COc1ccc(C[C@H](C)c2nc(-c3ccc([O-])cc3Cl)no2)cc1 ZINC000445451016 1028543227 /nfs/dbraw/zinc/54/32/27/1028543227.db2.gz ZNTYEFMYOBKHCB-NSHDSACASA-N -1 1 344.798 4.450 20 0 EIADMM COc1cccc([C@H]2C[C@@H]2c2nc(-c3ccc([O-])cc3Cl)no2)c1 ZINC000445443171 1028567352 /nfs/dbraw/zinc/56/73/52/1028567352.db2.gz FQJGLGOVRTUIKY-CABCVRRESA-N -1 1 342.782 4.375 20 0 EIADMM COc1ccccc1SCc1nc(-c2ccc([O-])cc2Cl)no1 ZINC000445443604 1028568421 /nfs/dbraw/zinc/56/84/21/1028568421.db2.gz CNEQHIGSTZXOFW-UHFFFAOYSA-N -1 1 348.811 4.397 20 0 EIADMM [O-]c1ccc(-c2noc(CCc3ccc4[nH]ccc4c3)n2)c(Cl)c1 ZINC000445445646 1028572948 /nfs/dbraw/zinc/57/29/48/1028572948.db2.gz JUYGKCWRADFJJN-UHFFFAOYSA-N -1 1 339.782 4.362 20 0 EIADMM CCO[C@@H](Cc1nc(-c2ccc([O-])cc2Cl)no1)C1=CCCC1 ZINC000445444856 1028575587 /nfs/dbraw/zinc/57/55/87/1028575587.db2.gz HHEWSUCHKSMTAR-HNNXBMFYSA-N -1 1 334.803 4.154 20 0 EIADMM [O-]c1ccc(-c2noc(-c3csc(-c4ccoc4)n3)n2)c(Cl)c1 ZINC000445447676 1028576963 /nfs/dbraw/zinc/57/69/63/1028576963.db2.gz PETDVFMMZUOFOB-UHFFFAOYSA-N -1 1 345.767 4.479 20 0 EIADMM [O-]c1ccc(-c2noc(CCCOc3cccc(F)c3)n2)c(Cl)c1 ZINC000445447327 1028583070 /nfs/dbraw/zinc/58/30/70/1028583070.db2.gz HFYPZNCXGGSKQU-UHFFFAOYSA-N -1 1 348.761 4.246 20 0 EIADMM CSCc1cc(-c2nc(-c3ccc([O-])c(F)c3)no2)ccc1F ZINC000445471812 1028599310 /nfs/dbraw/zinc/59/93/10/1028599310.db2.gz OIDYNLBIPVKOLW-UHFFFAOYSA-N -1 1 334.347 4.250 20 0 EIADMM O=C(CCc1nc(-c2ccc([O-])cc2F)no1)c1ccc(Cl)cc1 ZINC000445454617 1028607849 /nfs/dbraw/zinc/60/78/49/1028607849.db2.gz GVVXRKLZCFDFEC-UHFFFAOYSA-N -1 1 346.745 4.050 20 0 EIADMM [O-]c1ccc(-c2noc([C@@H]3C[C@H]3c3cc(F)ccc3F)n2)c(F)c1 ZINC000445457677 1028613410 /nfs/dbraw/zinc/61/34/10/1028613410.db2.gz ZGKXEWFZFOFNTA-WCQYABFASA-N -1 1 332.281 4.131 20 0 EIADMM CSc1ccc(O[C@H](C)c2nc(-c3ccc([O-])cc3F)no2)cc1 ZINC000445459426 1028616154 /nfs/dbraw/zinc/61/61/54/1028616154.db2.gz AUWOINSBZIIECL-SNVBAGLBSA-N -1 1 346.383 4.443 20 0 EIADMM [O-]c1ccc(-c2noc(-c3ccc(Oc4ccccc4)nc3)n2)cc1F ZINC000445478782 1028624152 /nfs/dbraw/zinc/62/41/52/1028624152.db2.gz SISROVDZHHEYRO-UHFFFAOYSA-N -1 1 349.321 4.436 20 0 EIADMM Cc1ccc(OCCCc2nc(-c3ccc([O-])c(F)c3)no2)cc1C ZINC000445479160 1028627156 /nfs/dbraw/zinc/62/71/56/1028627156.db2.gz UZLRILSROMKPNJ-UHFFFAOYSA-N -1 1 342.370 4.210 20 0 EIADMM CCSc1ccc(Cc2nc(-c3ccc([O-])c(F)c3)no2)cc1 ZINC000445479013 1028627492 /nfs/dbraw/zinc/62/74/92/1028627492.db2.gz UOQSSUFIGFLZJU-UHFFFAOYSA-N -1 1 330.384 4.284 20 0 EIADMM [O-]c1ccc(-c2noc([C@@H]3CCSc4ccccc43)n2)cc1F ZINC000445481195 1028631502 /nfs/dbraw/zinc/63/15/02/1028631502.db2.gz KYEDZRNHJWENMR-GFCCVEGCSA-N -1 1 328.368 4.209 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cccc(Br)c3)n2)cc1F ZINC000445484155 1028634338 /nfs/dbraw/zinc/63/43/38/1028634338.db2.gz XRQHGRKKSKZDED-UHFFFAOYSA-N -1 1 335.132 4.011 20 0 EIADMM CCOc1cc(C(=O)N[C@@H]2C[C@@H]2C2CCCCC2)cc(Cl)c1[O-] ZINC000545146388 1028766397 /nfs/dbraw/zinc/76/63/97/1028766397.db2.gz CUQZYBOANLKPKJ-UKRRQHHQSA-N -1 1 337.847 4.143 20 0 EIADMM [O-]c1cnc(Cl)c(-c2nc(-c3cc(F)c(Cl)c(F)c3)no2)c1 ZINC001213698051 1028801073 /nfs/dbraw/zinc/80/10/73/1028801073.db2.gz MCQURTSWRLPUOP-UHFFFAOYSA-N -1 1 344.104 4.089 20 0 EIADMM COc1ccc(-c2nc(C(C)(C)c3ccccc3Cl)no2)c([O-])c1 ZINC000445684679 1028842046 /nfs/dbraw/zinc/84/20/46/1028842046.db2.gz WBVGIGVHOGRNID-UHFFFAOYSA-N -1 1 344.798 4.430 20 0 EIADMM C[C@H](NC(=O)c1c(F)ccc([O-])c1F)c1cc(Cl)ccc1Cl ZINC000583839939 1029260918 /nfs/dbraw/zinc/26/09/18/1029260918.db2.gz DBQOCBIMTCMQDX-ZETCQYMHSA-N -1 1 346.160 4.468 20 0 EIADMM Cc1nc(-c2ccc(NCC[C@@H]3CCC(F)(F)C3)nc2)[n-]c(=O)c1C ZINC000897239991 1029605741 /nfs/dbraw/zinc/60/57/41/1029605741.db2.gz VMMRUSLYZMRBRM-ZDUSSCGKSA-N -1 1 348.397 4.098 20 0 EIADMM CCSCc1cccc([N-]S(=O)(=O)c2cc(F)ccc2C)c1 ZINC000525527332 1029665668 /nfs/dbraw/zinc/66/56/68/1029665668.db2.gz VRZALSDIJWJGTL-UHFFFAOYSA-N -1 1 339.457 4.188 20 0 EIADMM Cc1nc(-c2ccc(NC[C@H]3CCCC[C@H]3C)nc2)[n-]c(=O)c1C ZINC000301349191 1029713172 /nfs/dbraw/zinc/71/31/72/1029713172.db2.gz IFNAZKZENICOCK-IUODEOHRSA-N -1 1 326.444 4.099 20 0 EIADMM CCCOc1ccccc1NC(=O)c1cc(Cl)c([O-])c(OCC)c1 ZINC000193055525 1029722163 /nfs/dbraw/zinc/72/21/63/1029722163.db2.gz JEYCFEAIOIRKRV-UHFFFAOYSA-N -1 1 349.814 4.485 20 0 EIADMM COc1ccc2cc(CN(C)Cc3cc(C)c(C(=O)[O-])o3)ccc2c1 ZINC000584415894 1029837288 /nfs/dbraw/zinc/83/72/88/1029837288.db2.gz CEGYCUXXTKBJGW-UHFFFAOYSA-N -1 1 339.391 4.080 20 0 EIADMM CC[C@@H]1c2ccccc2CN1c1ccc(-c2nc(C)c(C)c(=O)[n-]2)cn1 ZINC000897353386 1029985538 /nfs/dbraw/zinc/98/55/38/1029985538.db2.gz AKEQQHBXFNSPQK-GOSISDBHSA-N -1 1 346.434 4.332 20 0 EIADMM Cc1cccc(S(=O)(=O)[N-]c2ccc(C)c(C(F)(F)F)c2)c1 ZINC000107330067 1030031094 /nfs/dbraw/zinc/03/10/94/1030031094.db2.gz WRECZZZLSPDGHQ-UHFFFAOYSA-N -1 1 329.343 4.123 20 0 EIADMM COc1cc(C(=O)Nc2cccc3c2OC(C)(C)C3)cc(Cl)c1[O-] ZINC000530564312 1030543103 /nfs/dbraw/zinc/54/31/03/1030543103.db2.gz YXYOPAXVEOBBJC-UHFFFAOYSA-N -1 1 347.798 4.020 20 0 EIADMM COc1ccc(CC[C@@H](C)NC(=O)c2ccc3ccccc3c2[O-])cc1 ZINC001625961527 1030765780 /nfs/dbraw/zinc/76/57/80/1030765780.db2.gz RFDUYCCDUJKSAP-OAHLLOKOSA-N -1 1 349.430 4.305 20 0 EIADMM Cc1ccc(-c2cccnc2)cc1[N-]S(=O)(=O)c1ccccc1C ZINC000475831975 1030858076 /nfs/dbraw/zinc/85/80/76/1030858076.db2.gz OPDREKOOARWHGX-UHFFFAOYSA-N -1 1 338.432 4.166 20 0 EIADMM O=C(c1ncc2ccccc2c1[O-])N1CCCCC[C@H]1c1ccncc1 ZINC000666417500 1030894749 /nfs/dbraw/zinc/89/47/49/1030894749.db2.gz JMCNERUTDKVTTR-SFHVURJKSA-N -1 1 347.418 4.093 20 0 EIADMM COc1cc(C(=O)N[C@@H]2CCCc3c(F)cccc32)cc(Cl)c1[O-] ZINC000452572987 1031143732 /nfs/dbraw/zinc/14/37/32/1031143732.db2.gz JSMBFWFSNALKIY-OAHLLOKOSA-N -1 1 349.789 4.001 20 0 EIADMM O=C(CCOCC(F)(F)F)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000628232813 1031253103 /nfs/dbraw/zinc/25/31/03/1031253103.db2.gz OZVZSBUVPNWBJT-UHFFFAOYSA-N -1 1 347.720 4.106 20 0 EIADMM Cc1nc(-c2ccc(F)cc2)sc1C(=O)Nc1ccc(F)cc1[O-] ZINC000531755742 1031534909 /nfs/dbraw/zinc/53/49/09/1031534909.db2.gz DPMSCHAVQIPTGO-UHFFFAOYSA-N -1 1 346.358 4.355 20 0 EIADMM CC(C)c1ccc(S(=O)(=O)[N-]c2cccc3ccncc32)cc1 ZINC000531781441 1031595411 /nfs/dbraw/zinc/59/54/11/1031595411.db2.gz KLOCNSGXLSCKNN-UHFFFAOYSA-N -1 1 326.421 4.159 20 0 EIADMM O=C(CSCc1cccc(Cl)c1)Nc1ccc(F)cc1[O-] ZINC000532013002 1031974962 /nfs/dbraw/zinc/97/49/62/1031974962.db2.gz YLQHIEIFSYMHFW-UHFFFAOYSA-N -1 1 325.792 4.057 20 0 EIADMM Cc1ccc(-c2ncco2)cc1[N-]S(=O)(=O)c1ccc(Cl)cc1 ZINC000134682746 1032007645 /nfs/dbraw/zinc/00/76/45/1032007645.db2.gz XOUGPEZKAFJVTQ-UHFFFAOYSA-N -1 1 348.811 4.104 20 0 EIADMM CCc1cccc(S(=O)(=O)[N-]c2cc(-c3ncco3)ccc2C)c1 ZINC000134675043 1032008287 /nfs/dbraw/zinc/00/82/87/1032008287.db2.gz YFQVOSZVKURWLF-UHFFFAOYSA-N -1 1 342.420 4.013 20 0 EIADMM C[C@@H](NCc1cccc([O-])c1Cl)c1nc(-c2cccc(F)c2)no1 ZINC000645159699 1033899278 /nfs/dbraw/zinc/89/92/78/1033899278.db2.gz DGCMYTJWQQGLPK-SNVBAGLBSA-N -1 1 347.777 4.086 20 0 EIADMM O=[P@]([O-])(O)C1(Nc2cccc(C3CCC3)c2)Cc2ccccc2C1 ZINC001167940104 1034793449 /nfs/dbraw/zinc/79/34/49/1034793449.db2.gz ZYLCEKGJFIOGFV-UHFFFAOYSA-N -1 1 343.363 4.039 20 0 EIADMM Cc1nc(-c2nc(=O)c3c([n-]2)sc(C)c3-c2ccc(F)cc2)co1 ZINC000345214002 1035157396 /nfs/dbraw/zinc/15/73/96/1035157396.db2.gz VPVVDGRFRQMPDZ-UHFFFAOYSA-N -1 1 341.367 4.475 20 0 EIADMM O=C(NC1CCCC1)c1ccc(NCc2cccc([O-])c2Cl)cc1 ZINC000419741055 1035405826 /nfs/dbraw/zinc/40/58/26/1035405826.db2.gz LSTBMHPUXMRDGE-UHFFFAOYSA-N -1 1 344.842 4.330 20 0 EIADMM CN(Cc1cccc2ccccc21)C(=O)Cc1ccc([O-])c(Cl)c1 ZINC001626003788 1035591678 /nfs/dbraw/zinc/59/16/78/1035591678.db2.gz HKXSPAXWDJVSCE-UHFFFAOYSA-N -1 1 339.822 4.400 20 0 EIADMM [O-]c1ccc(-c2nc(-c3ccsc3C(F)(F)F)no2)c(F)c1 ZINC000904924151 1035672882 /nfs/dbraw/zinc/67/28/82/1035672882.db2.gz MSHXHVJPZOKGEC-UHFFFAOYSA-N -1 1 330.262 4.329 20 0 EIADMM C[C@@H](N(C)Cc1csc(-c2cccc(C(=O)[O-])c2)n1)C(C)(C)C ZINC000568890537 1035820633 /nfs/dbraw/zinc/82/06/33/1035820633.db2.gz KYUKLLNDAXAHHQ-GFCCVEGCSA-N -1 1 332.469 4.375 20 0 EIADMM CC(C)Sc1ccc([C@@H](C)NCc2ccc(C(=O)[O-])cn2)cc1 ZINC000905724918 1035875953 /nfs/dbraw/zinc/87/59/53/1035875953.db2.gz PLYPTMJNUIQFLR-CYBMUJFWSA-N -1 1 330.453 4.131 20 0 EIADMM CCS(=O)(=O)[N-]c1cc(-c2cscc2C(F)F)ccc1OC ZINC000906195736 1036163230 /nfs/dbraw/zinc/16/32/30/1036163230.db2.gz PJBFOSWHJQJQPT-UHFFFAOYSA-N -1 1 347.408 4.123 20 0 EIADMM O=C(Nc1nc(C(F)(F)F)cs1)Nc1ccc([O-])c(Cl)c1 ZINC000486163057 1036525999 /nfs/dbraw/zinc/52/59/99/1036525999.db2.gz CJSHASZWDPIKJP-UHFFFAOYSA-N -1 1 337.710 4.165 20 0 EIADMM O=C(N=c1cc(-c2cccs2)[n-][nH]1)c1occc1-c1ccccc1 ZINC000589690727 1036866732 /nfs/dbraw/zinc/86/67/32/1036866732.db2.gz SFQTVEPOLALSQT-UHFFFAOYSA-N -1 1 335.388 4.072 20 0 EIADMM COc1ccc2c(c1)CCCN(C(=O)c1cc3ccccc3cc1[O-])C2 ZINC000590815687 1037183319 /nfs/dbraw/zinc/18/33/19/1037183319.db2.gz BFJVBRALLPGTOS-UHFFFAOYSA-N -1 1 347.414 4.143 20 0 EIADMM O=C(Nc1cc([O-])c(F)cc1F)[C@H](Cc1cccnc1)C1CCCC1 ZINC000909973319 1037217434 /nfs/dbraw/zinc/21/74/34/1037217434.db2.gz WOJNXFSBIXSHDS-CQSZACIVSA-N -1 1 346.377 4.053 20 0 EIADMM CCCc1c(C(=O)Nc2cc([O-])c(F)cc2F)cnn1C1CCCC1 ZINC000909986015 1037225792 /nfs/dbraw/zinc/22/57/92/1037225792.db2.gz WQOIOUGHNJXXAP-UHFFFAOYSA-N -1 1 349.381 4.187 20 0 EIADMM CC(C)(C)C1CCN(Cc2coc(-c3ccc(C(=O)[O-])cc3)n2)CC1 ZINC000573097429 1037347740 /nfs/dbraw/zinc/34/77/40/1037347740.db2.gz MQPSPBSMBYJJKJ-UHFFFAOYSA-N -1 1 342.439 4.298 20 0 EIADMM Cc1ccc(-c2cc(=NC(=O)c3cccc(C(F)F)c3)[nH][n-]2)s1 ZINC000591451281 1037436040 /nfs/dbraw/zinc/43/60/40/1037436040.db2.gz MFTMTIDGXCCGPG-UHFFFAOYSA-N -1 1 333.363 4.058 20 0 EIADMM [O-]c1ccc(Oc2ccccc2)cc1-c1nc(C2CCOCC2)no1 ZINC000273413554 1037455753 /nfs/dbraw/zinc/45/57/53/1037455753.db2.gz NEXDTUVICQARPU-UHFFFAOYSA-N -1 1 338.363 4.129 20 0 EIADMM CCc1cc(=O)[n-]c(S[C@@H](C)c2ccc(Br)cc2)n1 ZINC000488262461 1037463268 /nfs/dbraw/zinc/46/32/68/1037463268.db2.gz KZOIOXJPASPABG-VIFPVBQESA-N -1 1 339.258 4.360 20 0 EIADMM CN(CCCC(=O)[O-])Cc1c(Cl)cccc1Oc1ccccc1 ZINC000414643506 1037606480 /nfs/dbraw/zinc/60/64/80/1037606480.db2.gz XMOAJLBOCGUXHX-UHFFFAOYSA-N -1 1 333.815 4.429 20 0 EIADMM CCc1ccc(-c2nc(CN3C[C@@H](C(=O)[O-])CC[C@@H]3C)cs2)cc1 ZINC000573723025 1037679866 /nfs/dbraw/zinc/67/98/66/1037679866.db2.gz QJIKUBAFWTYWKH-BBRMVZONSA-N -1 1 344.480 4.058 20 0 EIADMM O=C(Nc1c([O-])cccc1F)c1cc2c(s1)-c1ccccc1OC2 ZINC000605434617 1037788445 /nfs/dbraw/zinc/78/84/45/1037788445.db2.gz ANEAKVMMBYUBRR-UHFFFAOYSA-N -1 1 341.363 4.405 20 0 EIADMM Cc1ccc(C(C)C)c(O[C@H](C)C(=O)Nc2c([O-])cccc2F)c1 ZINC000605440524 1037790104 /nfs/dbraw/zinc/79/01/04/1037790104.db2.gz TYWSIDJZXWRCNS-CYBMUJFWSA-N -1 1 331.387 4.369 20 0 EIADMM COc1cccc(CN[C@H](CC(=O)[O-])c2ccc(C(C)C)cc2)c1F ZINC000669471850 1037923395 /nfs/dbraw/zinc/92/33/95/1037923395.db2.gz VNIDGSHXJXLYGN-QGZVFWFLSA-N -1 1 345.414 4.263 20 0 EIADMM C[C@H]1c2ccc(F)cc2CCN1C(=O)c1ccc2ccccc2c1[O-] ZINC000606317314 1038004701 /nfs/dbraw/zinc/00/47/01/1038004701.db2.gz MFHBVDBRQZOIPU-ZDUSSCGKSA-N -1 1 335.378 4.444 20 0 EIADMM O=C(CC/C=C\c1ccccc1)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC000606530687 1038146613 /nfs/dbraw/zinc/14/66/13/1038146613.db2.gz JNYMQNGKLDFOIR-YWEYNIOJSA-N -1 1 333.391 4.214 20 0 EIADMM Cn1cc(/C=C/C(=O)c2ccc([O-])cc2)c(-c2cc3ccccc3o2)n1 ZINC000063274715 1038181493 /nfs/dbraw/zinc/18/14/93/1038181493.db2.gz LVQZEJFFBAQYDJ-DHZHZOJOSA-N -1 1 344.370 4.435 20 0 EIADMM [O-]c1c(F)cc(CN2C3CCCC2CCC3)cc1Br ZINC001232638046 1038201974 /nfs/dbraw/zinc/20/19/74/1038201974.db2.gz YXHDRORYLNYWBH-UHFFFAOYSA-N -1 1 328.225 4.201 20 0 EIADMM Cc1ccc(F)cc1S(=O)(=O)[N-]c1ccc(OC(C)(C)C)cc1 ZINC000607616019 1038240030 /nfs/dbraw/zinc/24/00/30/1038240030.db2.gz NYJUMQUQHFIFMB-UHFFFAOYSA-N -1 1 337.416 4.112 20 0 EIADMM CC=Cc1ccc(NC(=O)c2c(C)nc(C(C)(C)C)[n-]c2=O)cc1 ZINC000489967800 1038291148 /nfs/dbraw/zinc/29/11/48/1038291148.db2.gz SGOVCILRFCSUCL-VOTSOKGWSA-N -1 1 325.412 4.074 20 0 EIADMM O=C(CSc1nnc(-c2ccccc2Cl)o1)c1ccc([O-])cc1 ZINC000594364716 1038304292 /nfs/dbraw/zinc/30/42/92/1038304292.db2.gz AUHQMFVKISLCQF-UHFFFAOYSA-N -1 1 346.795 4.071 20 0 EIADMM CC(C)C[C@@H]1CCCCN1C(=O)c1ccc(Br)c([O-])c1 ZINC000490427594 1038623213 /nfs/dbraw/zinc/62/32/13/1038623213.db2.gz AHRDACVRUSATCK-ZDUSSCGKSA-N -1 1 340.261 4.196 20 0 EIADMM C[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1c([O-])cccc1F ZINC000608365323 1038803190 /nfs/dbraw/zinc/80/31/90/1038803190.db2.gz CYENEUAQVZKJIP-SNVBAGLBSA-N -1 1 341.304 4.367 20 0 EIADMM CCCCc1ccc(C(=O)CCC(=O)Nc2c([O-])cccc2F)cc1 ZINC000608365842 1038805252 /nfs/dbraw/zinc/80/52/52/1038805252.db2.gz KLODSGTXXWSRQH-UHFFFAOYSA-N -1 1 343.398 4.476 20 0 EIADMM Cc1c(F)cccc1-c1ccc(CN2CCC[C@H](C)[C@@H]2C(=O)[O-])o1 ZINC000424417968 1038842878 /nfs/dbraw/zinc/84/28/78/1038842878.db2.gz MWZDPZJTFORSQV-KPZWWZAWSA-N -1 1 331.387 4.079 20 0 EIADMM O=c1cc(C(F)(F)F)nc(CNc2ccc(Cl)cc2Cl)[n-]1 ZINC000552271572 1039347697 /nfs/dbraw/zinc/34/76/97/1039347697.db2.gz LKLBKNCPRKLIHB-UHFFFAOYSA-N -1 1 338.116 4.120 20 0 EIADMM O=C(Nc1ccc(-c2nccs2)cc1)c1c(F)ccc([O-])c1F ZINC000552561148 1039642211 /nfs/dbraw/zinc/64/22/11/1039642211.db2.gz YEMBRRFWEBXNEK-UHFFFAOYSA-N -1 1 332.331 4.046 20 0 EIADMM C[C@@H](N=c1ccc(N2CCC[C@H]2c2ccco2)n[n-]1)c1ccccc1 ZINC000425230660 1039890475 /nfs/dbraw/zinc/89/04/75/1039890475.db2.gz RMPUFPCTKBYRHK-WBVHZDCISA-N -1 1 334.423 4.006 20 0 EIADMM COc1ccc(C(=O)Nc2ccc(F)cc2[O-])c(OC2CCCC2)c1 ZINC000478863229 1039971506 /nfs/dbraw/zinc/97/15/06/1039971506.db2.gz JEDBRUUJXJPBEZ-UHFFFAOYSA-N -1 1 345.370 4.114 20 0 EIADMM O=C(Nc1ccc(F)c(C(F)(F)F)c1)c1c(F)ccc([O-])c1F ZINC000553259777 1040072835 /nfs/dbraw/zinc/07/28/35/1040072835.db2.gz HZBSMAIKZDHMGQ-UHFFFAOYSA-N -1 1 335.203 4.081 20 0 EIADMM CCOc1cc(C(=O)N[C@H]2CCCC[C@@H]2CC)cc(Cl)c1[O-] ZINC000567977220 1040266361 /nfs/dbraw/zinc/26/63/61/1040266361.db2.gz IFBMXIDBTNDRSS-FZMZJTMJSA-N -1 1 325.836 4.143 20 0 EIADMM Cc1cc(F)cc(C(=O)Nc2cc(C)cc(Br)c2[O-])c1 ZINC000482547075 1040348793 /nfs/dbraw/zinc/34/87/93/1040348793.db2.gz CLUPOBNYEWKIAU-UHFFFAOYSA-N -1 1 338.176 4.163 20 0 EIADMM Cc1c(Cl)cccc1[N-]S(=O)(=O)c1ccc2ncsc2c1 ZINC000479525036 1040423655 /nfs/dbraw/zinc/42/36/55/1040423655.db2.gz JEATVPKHTYJTRC-UHFFFAOYSA-N -1 1 338.841 4.059 20 0 EIADMM O=C(c1c(F)ccc([O-])c1F)N1CCC[C@H](c2ccccc2)CC1 ZINC000539447554 1040450432 /nfs/dbraw/zinc/45/04/32/1040450432.db2.gz YTWHSPQCIOCCET-AWEZNQCLSA-N -1 1 331.362 4.080 20 0 EIADMM C[C@H](Sc1nc(C2CC2)cc(=O)[n-]1)c1nccn1-c1ccccc1 ZINC000553769863 1040502093 /nfs/dbraw/zinc/50/20/93/1040502093.db2.gz KMZFRCZAVGYQNF-LBPRGKRZSA-N -1 1 338.436 4.099 20 0 EIADMM Cc1oc([C@H](C)N(C)CCOc2ccccc2Cl)cc1C(=O)[O-] ZINC000519412901 1040602828 /nfs/dbraw/zinc/60/28/28/1040602828.db2.gz SGFVZZOZQQNIEW-NSHDSACASA-N -1 1 337.803 4.011 20 0 EIADMM Nc1ccc(F)c(Nc2c([O-])c(Br)ccc2Cl)c1 ZINC001211841674 1040619026 /nfs/dbraw/zinc/61/90/26/1040619026.db2.gz MJBTXEUICGYDKL-UHFFFAOYSA-N -1 1 331.572 4.273 20 0 EIADMM O=C(CCC1CCC1)Nc1c([O-])cc(Br)cc1Cl ZINC000515318821 1040665770 /nfs/dbraw/zinc/66/57/70/1040665770.db2.gz ROIPVOOHHYETLP-UHFFFAOYSA-N -1 1 332.625 4.327 20 0 EIADMM CCOc1cc(C(=O)N2c3ccccc3C[C@@H]2C)cc(Cl)c1[O-] ZINC000192795802 1040733789 /nfs/dbraw/zinc/73/37/89/1040733789.db2.gz VNYGHBDFLYBSSX-NSHDSACASA-N -1 1 331.799 4.036 20 0 EIADMM Cc1ccc(-c2cc(=NC(=O)c3scc(C)c3Cl)[nH][n-]2)s1 ZINC000484048105 1041101689 /nfs/dbraw/zinc/10/16/89/1041101689.db2.gz QOIOYLMIBYLSGY-UHFFFAOYSA-N -1 1 337.857 4.144 20 0 EIADMM Cc1nc(-c2ccc(NCCCC3CCCCC3)nc2)[n-]c(=O)c1C ZINC000462930309 1041110420 /nfs/dbraw/zinc/11/04/20/1041110420.db2.gz RAGVYONWOVMARO-UHFFFAOYSA-N -1 1 340.471 4.055 20 0 EIADMM CC[C@H]1CCCC[C@@H]1Nc1ccc(-c2nc(C)c(C)c(=O)[n-]2)cn1 ZINC000462929696 1041110664 /nfs/dbraw/zinc/11/06/64/1041110664.db2.gz ODWQVUOLZTUWJT-HOCLYGCPSA-N -1 1 326.444 4.242 20 0 EIADMM Cc1nc(-c2ccc(NCCCCC3CCCC3)nc2)[n-]c(=O)c1C ZINC000462946005 1041126705 /nfs/dbraw/zinc/12/67/05/1041126705.db2.gz UPLAWMLKYQZGDB-UHFFFAOYSA-N -1 1 340.471 4.055 20 0 EIADMM [O-]c1ccc(Oc2ccccc2)cc1-c1nc(Cc2cccnc2)no1 ZINC000436515569 1041300058 /nfs/dbraw/zinc/30/00/58/1041300058.db2.gz SEFJUCVJZSWVNZ-UHFFFAOYSA-N -1 1 345.358 4.220 20 0 EIADMM CCS[C@@H]1CCCCN(C(=O)c2cc3ccccc3cc2[O-])C1 ZINC000436548668 1041323083 /nfs/dbraw/zinc/32/30/83/1041323083.db2.gz UCGDUGXFDZIVGB-MRXNPFEDSA-N -1 1 329.465 4.293 20 0 EIADMM COC(=O)c1c[n-]c(SCc2sc3ccccc3c2Cl)n1 ZINC000484577666 1041330629 /nfs/dbraw/zinc/33/06/29/1041330629.db2.gz RPBAHJNZTIGWSR-UHFFFAOYSA-N -1 1 338.841 4.357 20 0 EIADMM Cc1ccc(-c2nnco2)cc1NC(=O)c1ccc(C(C)C)cc1[O-] ZINC000436560397 1041340648 /nfs/dbraw/zinc/34/06/48/1041340648.db2.gz FIEUOOXCXGNCDX-UHFFFAOYSA-N -1 1 337.379 4.126 20 0 EIADMM O=C(c1ccc(C(F)(F)F)cc1[O-])N1Cc2ccccc2C2(CC2)C1 ZINC000436564267 1041344502 /nfs/dbraw/zinc/34/45/02/1041344502.db2.gz RGWJPEAKJJXEJS-UHFFFAOYSA-N -1 1 347.336 4.099 20 0 EIADMM C[C@@H]1CN(C)c2ccccc2N(C(=O)c2ccc3ccccc3c2[O-])C1 ZINC000436597301 1041353929 /nfs/dbraw/zinc/35/39/29/1041353929.db2.gz URXWFOKLRQUPFR-OAHLLOKOSA-N -1 1 346.430 4.278 20 0 EIADMM CC(=O)Nc1cc(NC(=O)c2ccc(C(C)C)cc2[O-])ccc1C ZINC000436598223 1041358279 /nfs/dbraw/zinc/35/82/79/1041358279.db2.gz ZBRUWMMIHWAKKZ-UHFFFAOYSA-N -1 1 326.396 4.035 20 0 EIADMM O=C(c1cc(F)ccc1[O-])N1CCC[C@@]2(CCCc3ccccc32)C1 ZINC000436587200 1041362601 /nfs/dbraw/zinc/36/26/01/1041362601.db2.gz WIAMPEVBHHVYIT-NRFANRHFSA-N -1 1 339.410 4.042 20 0 EIADMM O=C(Nc1nc(C(F)(F)F)cs1)c1ccc2ccccc2c1[O-] ZINC000436677017 1041415850 /nfs/dbraw/zinc/41/58/50/1041415850.db2.gz VPNIPKFIEKKLFW-UHFFFAOYSA-N -1 1 338.310 4.273 20 0 EIADMM O=C(Nc1ccc([C@@H]2CCOC2)cc1)c1cc2ccccc2cc1[O-] ZINC000436696519 1041429166 /nfs/dbraw/zinc/42/91/66/1041429166.db2.gz HPQDXQLLQRTNKY-QGZVFWFLSA-N -1 1 333.387 4.302 20 0 EIADMM COc1cc(C(=O)N(C)[C@H](C)C2CCCCC2)cc(Cl)c1[O-] ZINC000554842997 1041442073 /nfs/dbraw/zinc/44/20/73/1041442073.db2.gz GZLDMUMNTVBPEU-LLVKDONJSA-N -1 1 325.836 4.095 20 0 EIADMM O=C(c1cc(Cl)ccc1[O-])N1CCCn2c(cc3ccccc32)C1 ZINC000436734315 1041446305 /nfs/dbraw/zinc/44/63/05/1041446305.db2.gz BGYRMWJDCNCVEB-UHFFFAOYSA-N -1 1 340.810 4.046 20 0 EIADMM CC1(C)CN(C(=O)c2ccc(C(F)(F)F)cc2[O-])[C@@H]2CCC[C@H]21 ZINC000436738632 1041449235 /nfs/dbraw/zinc/44/92/35/1041449235.db2.gz UAWPPYFYTKOQRE-CHWSQXEVSA-N -1 1 327.346 4.062 20 0 EIADMM O=C(Nc1ccccc1Oc1ccccc1)C(=O)c1ccc([O-])cc1 ZINC000436731753 1041453719 /nfs/dbraw/zinc/45/37/19/1041453719.db2.gz ATYZSAQUDRBVEU-UHFFFAOYSA-N -1 1 333.343 4.006 20 0 EIADMM Cn1cccc1[C@H]1CCCCCN1C(=O)c1ccc(Cl)cc1[O-] ZINC000436758659 1041455396 /nfs/dbraw/zinc/45/53/96/1041455396.db2.gz ZNOJJCFPNITSSB-MRXNPFEDSA-N -1 1 332.831 4.142 20 0 EIADMM CSc1ccc([O-])c(-c2nc(Cc3ccccc3Cl)no2)c1 ZINC000904373850 1041458002 /nfs/dbraw/zinc/45/80/02/1041458002.db2.gz AZKHXJLKSSGTEB-UHFFFAOYSA-N -1 1 332.812 4.408 20 0 EIADMM O=C(c1ccc(C(F)(F)F)cc1[O-])N1CCC[C@H]2CCCC[C@@H]21 ZINC000436763090 1041459837 /nfs/dbraw/zinc/45/98/37/1041459837.db2.gz ISNKVFXMIMRWEL-RISCZKNCSA-N -1 1 327.346 4.206 20 0 EIADMM CCSCC[C@H](C)N(C)C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436750027 1041462218 /nfs/dbraw/zinc/46/22/18/1041462218.db2.gz DOJZKWVWCBRTOL-JTQLQIEISA-N -1 1 335.391 4.015 20 0 EIADMM O=C(N[C@H](c1ccccc1)[C@@H]1CCOC1)c1cc2ccccc2cc1[O-] ZINC000436750665 1041463613 /nfs/dbraw/zinc/46/36/13/1041463613.db2.gz OPCQVNUKUNYUEQ-WIYYLYMNSA-N -1 1 347.414 4.053 20 0 EIADMM C[C@]1(c2ccccc2)CCN(C(=O)c2ccc(C(F)(F)F)cc2[O-])C1 ZINC000436749445 1041463776 /nfs/dbraw/zinc/46/37/76/1041463776.db2.gz AXRQKLTVNCDCCF-SFHVURJKSA-N -1 1 349.352 4.215 20 0 EIADMM C[C@@H]1[C@@H](c2ccccc2)CCN1C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436751753 1041463972 /nfs/dbraw/zinc/46/39/72/1041463972.db2.gz NQYLHULBDOOYOP-DOMZBBRYSA-N -1 1 349.352 4.429 20 0 EIADMM C[C@H]1CCN(C(=O)c2ccc(C(F)(F)F)cc2[O-])CC12CCC2 ZINC000436774213 1041468682 /nfs/dbraw/zinc/46/86/82/1041468682.db2.gz SOSARSHIVRTYGV-NSHDSACASA-N -1 1 327.346 4.063 20 0 EIADMM CC[C@]1(C(=O)[O-])CCCN(Cc2cc(Cl)c(OC)cc2Cl)C1 ZINC000904402424 1041469456 /nfs/dbraw/zinc/46/94/56/1041469456.db2.gz XKYQBHUUMJQWIA-INIZCTEOSA-N -1 1 346.254 4.079 20 0 EIADMM CN(Cc1ccc(Cl)cc1)C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436764546 1041474161 /nfs/dbraw/zinc/47/41/61/1041474161.db2.gz RYNDXTVPQUXZSD-UHFFFAOYSA-N -1 1 343.732 4.337 20 0 EIADMM O=C(c1ccc(C(F)(F)F)cc1[O-])N1CCC[C@@H]1c1ccccc1 ZINC000436764340 1041474178 /nfs/dbraw/zinc/47/41/78/1041474178.db2.gz QRYDEIQYAAFWRO-OAHLLOKOSA-N -1 1 335.325 4.388 20 0 EIADMM C[C@H](c1ccccc1F)N(C)C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436765278 1041475496 /nfs/dbraw/zinc/47/54/96/1041475496.db2.gz WNCOXRCKEPJJMG-SNVBAGLBSA-N -1 1 341.304 4.383 20 0 EIADMM CC[C@@H]1CN(C(=O)c2ccc([O-])cc2F)c2cccc(Cl)c2O1 ZINC000436828342 1041496162 /nfs/dbraw/zinc/49/61/62/1041496162.db2.gz HTUBAOPUFKNLQY-LLVKDONJSA-N -1 1 335.762 4.003 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N1CCC[C@H]1Cc1ccc(F)cc1 ZINC000436822885 1041501433 /nfs/dbraw/zinc/50/14/33/1041501433.db2.gz XNYCOJMLKWLRRB-HNNXBMFYSA-N -1 1 333.790 4.032 20 0 EIADMM CC[C@@H](c1ccccc1OC)N(C)C(=O)c1cc(Cl)ccc1[O-] ZINC000436848388 1041514722 /nfs/dbraw/zinc/51/47/22/1041514722.db2.gz OHIJJCKRGGZBAZ-HNNXBMFYSA-N -1 1 333.815 4.278 20 0 EIADMM COc1ccc(C(=O)Nc2cccc(-c3ccccc3OC)c2)c([O-])c1 ZINC000436866142 1041523522 /nfs/dbraw/zinc/52/35/22/1041523522.db2.gz XBHBHAGVAGPBIC-UHFFFAOYSA-N -1 1 349.386 4.329 20 0 EIADMM CCOc1c(F)cccc1-c1nc(-c2ccc([O-])cc2Cl)no1 ZINC000436870888 1041530066 /nfs/dbraw/zinc/53/00/66/1041530066.db2.gz RBFQUMOEGASMGD-UHFFFAOYSA-N -1 1 334.734 4.300 20 0 EIADMM COc1ccc(-c2nc(-c3ccc([O-])c(F)c3)no2)cc1C1CC1 ZINC000436872614 1041531237 /nfs/dbraw/zinc/53/12/37/1041531237.db2.gz KSGRZLHRTPDVIS-UHFFFAOYSA-N -1 1 326.327 4.134 20 0 EIADMM CCOc1c(Cl)cccc1Cc1nc(-c2ccc([O-])c(F)c2)no1 ZINC000436875676 1041533057 /nfs/dbraw/zinc/53/30/57/1041533057.db2.gz VZDXJNWYOYXZCW-UHFFFAOYSA-N -1 1 348.761 4.224 20 0 EIADMM [O-]c1ccc(-c2noc(/C=C\c3cc(F)c(F)c(F)c3)n2)c(F)c1 ZINC000436877527 1041537615 /nfs/dbraw/zinc/53/76/15/1041537615.db2.gz HAQDQLKEFPXNJS-RJRFIUFISA-N -1 1 336.244 4.169 20 0 EIADMM C[C@@H](Cc1ccc(Cl)cc1Cl)NC(=O)c1ccc([O-])cc1F ZINC000436881569 1041539320 /nfs/dbraw/zinc/53/93/20/1041539320.db2.gz SXVOLTQAVIWCPC-VIFPVBQESA-N -1 1 342.197 4.199 20 0 EIADMM C[C@@H](Cc1nc(-c2ccc([O-])c(F)c2)no1)c1c[nH]c2ccccc21 ZINC000436881911 1041539566 /nfs/dbraw/zinc/53/95/66/1041539566.db2.gz ZBUJYSWRRWSTPG-NSHDSACASA-N -1 1 337.354 4.409 20 0 EIADMM O=C(NCc1ccc(-c2ccncc2)cc1)c1ccc(Cl)cc1[O-] ZINC000436891607 1041545064 /nfs/dbraw/zinc/54/50/64/1041545064.db2.gz XVMJJZWOVNRRKQ-UHFFFAOYSA-N -1 1 338.794 4.038 20 0 EIADMM [O-]c1ccc(F)cc1-c1nc(-c2cc(F)ccc2C(F)(F)F)no1 ZINC000436898844 1041551953 /nfs/dbraw/zinc/55/19/53/1041551953.db2.gz AHTZMLZZPMKOAM-UHFFFAOYSA-N -1 1 342.223 4.406 20 0 EIADMM CC[C@H]1CN(C(=O)c2c(F)ccc([O-])c2F)CC[C@@H]1c1ccccc1 ZINC000540586810 1041556680 /nfs/dbraw/zinc/55/66/80/1041556680.db2.gz RKQWIZAJPDNIPB-ZFWWWQNUSA-N -1 1 345.389 4.326 20 0 EIADMM C[C@@H]1C[C@H](c2ccccc2)[C@@H](C)N1C(=O)c1ccc(Cl)cc1[O-] ZINC000436927850 1041562313 /nfs/dbraw/zinc/56/23/13/1041562313.db2.gz AAWQBWMIUQFTKN-XNJGSVPQSA-N -1 1 329.827 4.452 20 0 EIADMM CC(C)(C)OC1CC(CCNC(=O)c2ccc3ccccc3c2[O-])C1 ZINC000436951031 1041563315 /nfs/dbraw/zinc/56/33/15/1041563315.db2.gz QUOANHJTGQKBBU-UHFFFAOYSA-N -1 1 341.451 4.259 20 0 EIADMM CN(C(=O)c1ccc(C(F)(F)F)cc1[O-])c1ccc2cc[nH]c2c1 ZINC000437005604 1041589973 /nfs/dbraw/zinc/58/99/73/1041589973.db2.gz YONBTKHKDDJISH-UHFFFAOYSA-N -1 1 334.297 4.169 20 0 EIADMM CN(Cc1cc(F)cc(F)c1)C(=O)c1cc2ccccc2cc1[O-] ZINC000437001042 1041594827 /nfs/dbraw/zinc/59/48/27/1041594827.db2.gz JPLTUODJAATYRR-UHFFFAOYSA-N -1 1 327.330 4.096 20 0 EIADMM Cc1ccc(F)cc1S(=O)(=O)[N-]c1cccc(CC(F)(F)F)c1 ZINC000438755078 1042334669 /nfs/dbraw/zinc/33/46/69/1042334669.db2.gz DVOLXLLESZLWCW-UHFFFAOYSA-N -1 1 347.333 4.040 20 0 EIADMM CCCOc1ccc([N-]S(=O)(=O)c2cccc(F)c2C)c(C)c1 ZINC000438796632 1042354090 /nfs/dbraw/zinc/35/40/90/1042354090.db2.gz RHMBFEMYQUXFJZ-UHFFFAOYSA-N -1 1 337.416 4.032 20 0 EIADMM CC(C)n1ncc2ccc([N-]S(=O)(=O)c3ccc(Cl)cc3)cc21 ZINC000509543802 1042365747 /nfs/dbraw/zinc/36/57/47/1042365747.db2.gz WFVHYYCLVOZHRN-UHFFFAOYSA-N -1 1 349.843 4.071 20 0 EIADMM CC(C)(C)c1csc(CNC(=O)c2cc3ccccc3cc2[O-])n1 ZINC000303239024 1042376174 /nfs/dbraw/zinc/37/61/74/1042376174.db2.gz IFWYTVVTODOSJH-UHFFFAOYSA-N -1 1 340.448 4.229 20 0 EIADMM O=S(=O)([N-]c1cccc(-c2cccs2)c1)c1ccc(F)cc1 ZINC000509576134 1042385973 /nfs/dbraw/zinc/38/59/73/1042385973.db2.gz DHQMWBKOCCVVAI-UHFFFAOYSA-N -1 1 333.409 4.355 20 0 EIADMM O=S(=O)([N-]c1ccccc1CC(F)(F)F)c1cccc(Cl)c1 ZINC000172901466 1042511723 /nfs/dbraw/zinc/51/17/23/1042511723.db2.gz RHXXXQCJTNPLHK-UHFFFAOYSA-N -1 1 349.761 4.246 20 0 EIADMM Cc1cc(Cl)ccc1S(=O)(=O)[N-]c1cccc(C(F)F)c1 ZINC000509612246 1042689943 /nfs/dbraw/zinc/68/99/43/1042689943.db2.gz XOQFIKOVTPBZLB-UHFFFAOYSA-N -1 1 331.771 4.387 20 0 EIADMM O=C(Nc1ccccc1-c1cn[nH]c1)c1ccc(C(F)(F)F)cc1[O-] ZINC000439755824 1042762594 /nfs/dbraw/zinc/76/25/94/1042762594.db2.gz KDFQZFYNBKFNOW-UHFFFAOYSA-N -1 1 347.296 4.053 20 0 EIADMM CC(C)CN(C(=O)c1ccc([O-])cc1F)[C@H]1CCCc2cccnc21 ZINC000133863596 1042874478 /nfs/dbraw/zinc/87/44/78/1042874478.db2.gz XDTREFQWADXKCS-SFHVURJKSA-N -1 1 342.414 4.102 20 0 EIADMM CCc1c(C(=O)Nc2ccc([O-])c(Cl)c2)cnn1CCC(C)C ZINC000427622093 1043006911 /nfs/dbraw/zinc/00/69/11/1043006911.db2.gz PYNNQXSYUHFIOG-UHFFFAOYSA-N -1 1 335.835 4.103 20 0 EIADMM Cc1ccc(CC(=O)Nc2cc(C)cc(Br)c2[O-])s1 ZINC000182927417 1043035159 /nfs/dbraw/zinc/03/51/59/1043035159.db2.gz XEDSBXRYXJBTTJ-UHFFFAOYSA-N -1 1 340.242 4.014 20 0 EIADMM Cc1cc(Br)c([O-])c(NC(=O)C2CCC(F)(F)CC2)c1 ZINC000182910441 1043035652 /nfs/dbraw/zinc/03/56/52/1043035652.db2.gz OIACAZSDYRQTHY-UHFFFAOYSA-N -1 1 348.187 4.227 20 0 EIADMM CCc1ccc([C@@H]2CCCN(C(=O)c3ccc([O-])c(F)c3)C2)cc1 ZINC000672298402 1043075674 /nfs/dbraw/zinc/07/56/74/1043075674.db2.gz PWWFUYWPPRKGDJ-QGZVFWFLSA-N -1 1 327.399 4.114 20 0 EIADMM CCc1nc(CSc2nc(-c3ccccc3)c(C)c(=O)[n-]2)cs1 ZINC000185055630 1043154247 /nfs/dbraw/zinc/15/42/47/1043154247.db2.gz RRMLNXPILFJELR-UHFFFAOYSA-N -1 1 343.477 4.057 20 0 EIADMM [O-]c1c(F)cc(Nc2ccc(O)c(Br)c2)cc1Cl ZINC001214488932 1043190954 /nfs/dbraw/zinc/19/09/54/1043190954.db2.gz QNGREOUOSQSTRJ-UHFFFAOYSA-N -1 1 332.556 4.396 20 0 EIADMM CCOc1cc(C(=O)Nc2ccc(F)c(Cl)c2)cc(Cl)c1[O-] ZINC000215954443 1043201337 /nfs/dbraw/zinc/20/13/37/1043201337.db2.gz YJICDSVXSJWYGG-UHFFFAOYSA-N -1 1 344.169 4.489 20 0 EIADMM Cc1ccccc1S(=O)(=O)[N-]c1cccc(SC(F)F)c1 ZINC000727363449 1043210007 /nfs/dbraw/zinc/21/00/07/1043210007.db2.gz PNPPYEWACNUFNF-UHFFFAOYSA-N -1 1 329.393 4.111 20 0 EIADMM Cc1cccc(F)c1[N-]S(=O)(=O)c1cccc(Cl)c1Cl ZINC000185930247 1043233511 /nfs/dbraw/zinc/23/35/11/1043233511.db2.gz BDSJUHHAFQKFEN-UHFFFAOYSA-N -1 1 334.199 4.242 20 0 EIADMM COc1ccccc1CC(C)(C)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000509186443 1043243981 /nfs/dbraw/zinc/24/39/81/1043243981.db2.gz RTSYJMDDXHXSMR-UHFFFAOYSA-N -1 1 333.815 4.262 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2ccc(-c3ccccc3)cc2)cc1O ZINC000028461773 1043391988 /nfs/dbraw/zinc/39/19/88/1043391988.db2.gz JEIJSDOYJYSHNP-UHFFFAOYSA-N -1 1 339.416 4.168 20 0 EIADMM CCCn1ncc(-c2nc(-c3ccc([O-])cc3Cl)no2)c1C1CC1 ZINC000520890193 1043426464 /nfs/dbraw/zinc/42/64/64/1043426464.db2.gz JRRGCCWYGRWFDH-UHFFFAOYSA-N -1 1 344.802 4.247 20 0 EIADMM [O-]c1cccnc1-c1nc(-c2ccc(-c3ccc(F)cc3)cc2)no1 ZINC001212480988 1043433639 /nfs/dbraw/zinc/43/36/39/1043433639.db2.gz UBGJBJJCLMHQNT-UHFFFAOYSA-N -1 1 333.322 4.310 20 0 EIADMM CC(C)c1noc([C@@H](C)OC(=O)c2ccc(Cl)c(Cl)c2[O-])n1 ZINC000730360386 1043504193 /nfs/dbraw/zinc/50/41/93/1043504193.db2.gz UEOBTKHLKIBFFD-SSDOTTSWSA-N -1 1 345.182 4.123 20 0 EIADMM CSc1ccncc1[N-]C(=O)c1cc(-c2ccc(Cl)cc2)on1 ZINC000674255523 1043504457 /nfs/dbraw/zinc/50/44/57/1043504457.db2.gz BTFDVXNGMAWMAI-UHFFFAOYSA-N -1 1 345.811 4.364 20 0 EIADMM CCCCN(C(=O)c1ccc(NC(=O)OC(C)(C)C)cc1[O-])C1CC1 ZINC000494556699 1043593900 /nfs/dbraw/zinc/59/39/00/1043593900.db2.gz YETCZAJZUQOYAA-UHFFFAOYSA-N -1 1 348.443 4.144 20 0 EIADMM CN(Cc1ccc(Cl)cc1Cl)C(=O)c1cc(F)ccc1[O-] ZINC000674323576 1043595628 /nfs/dbraw/zinc/59/56/28/1043595628.db2.gz FWCREGWCORWYML-UHFFFAOYSA-N -1 1 328.170 4.110 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2ccsc2Cl)sc1Cl ZINC000190347831 1043703017 /nfs/dbraw/zinc/70/30/17/1043703017.db2.gz HBOMCGGNTBEKCA-UHFFFAOYSA-N -1 1 328.267 4.226 20 0 EIADMM C[C@@H]1CO[C@H](c2ccccc2)[C@H](C)N1C(=O)c1cc(Cl)ccc1[O-] ZINC000732017015 1043869827 /nfs/dbraw/zinc/86/98/27/1043869827.db2.gz LDHHRTGYWBFVII-VBHSOAQHSA-N -1 1 345.826 4.036 20 0 EIADMM O=C(Nc1ccc(C(F)(F)F)nc1)Nc1ccc([O-])c(Cl)c1 ZINC000192239693 1043895887 /nfs/dbraw/zinc/89/58/87/1043895887.db2.gz KCILLONUJFLYIU-UHFFFAOYSA-N -1 1 331.681 4.103 20 0 EIADMM COc1cc(C(=O)N[C@H](C)c2cccc(C)c2C)cc(Cl)c1[O-] ZINC000442981977 1043949358 /nfs/dbraw/zinc/94/93/58/1043949358.db2.gz KBTHTTQJJQSTJI-GFCCVEGCSA-N -1 1 333.815 4.162 20 0 EIADMM COc1cc(C(=O)N2CCCC[C@@H]2CC(C)C)cc(Cl)c1[O-] ZINC000443052545 1043991977 /nfs/dbraw/zinc/99/19/77/1043991977.db2.gz UTSGCTHOKDVUQL-CYBMUJFWSA-N -1 1 325.836 4.095 20 0 EIADMM CCOc1cc(-c2nc(-c3ccc(F)cc3)no2)cc(Cl)c1[O-] ZINC000443102014 1044017394 /nfs/dbraw/zinc/01/73/94/1044017394.db2.gz GBBATIQLQXJWSH-UHFFFAOYSA-N -1 1 334.734 4.300 20 0 EIADMM COc1ccc(-c2noc(-c3cc(Cl)c([O-])c(OC)c3)n2)cc1C ZINC000443216644 1044104757 /nfs/dbraw/zinc/10/47/57/1044104757.db2.gz QCUJZSUNQBOZFM-UHFFFAOYSA-N -1 1 346.770 4.088 20 0 EIADMM CCOc1cc(-c2nc(-c3ccccc3OC)no2)cc(Cl)c1[O-] ZINC000191157343 1044224741 /nfs/dbraw/zinc/22/47/41/1044224741.db2.gz MRISZVAFXWRDOY-UHFFFAOYSA-N -1 1 346.770 4.170 20 0 EIADMM CCOc1cc(C(=O)N[C@H]2CCC[C@@H](C)CC2)cc(Cl)c1[O-] ZINC000443385439 1044250489 /nfs/dbraw/zinc/25/04/89/1044250489.db2.gz PGUYFIOTQONGPH-YPMHNXCESA-N -1 1 325.836 4.143 20 0 EIADMM Cc1ccc(Oc2ccc(NC(=O)c3ccc(F)c([O-])c3)cn2)cc1 ZINC001625934573 1044261967 /nfs/dbraw/zinc/26/19/67/1044261967.db2.gz UWOUAVCLCYPUTQ-UHFFFAOYSA-N -1 1 338.338 4.279 20 0 EIADMM Cc1ccc2oc(SCc3cc(=O)oc4cc([O-])ccc34)nc2c1 ZINC000733750630 1044303408 /nfs/dbraw/zinc/30/34/08/1044303408.db2.gz IDNDFJRGKGNFRE-UHFFFAOYSA-N -1 1 339.372 4.241 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1cccc(C(F)(F)F)c1F ZINC000176575074 1044676125 /nfs/dbraw/zinc/67/61/25/1044676125.db2.gz WOCYUEAWSRJKRN-UHFFFAOYSA-N -1 1 333.668 4.456 20 0 EIADMM COc1ccc(Cc2noc(-c3ccc4ccccc4c3[O-])n2)cc1 ZINC000327269367 1044810557 /nfs/dbraw/zinc/81/05/57/1044810557.db2.gz DCHAOSUYGWONOZ-UHFFFAOYSA-N -1 1 332.359 4.195 20 0 EIADMM Cc1c(Cl)cc(F)c([N-]C(=O)c2nc(Cl)ccc2F)c1F ZINC000761956056 1044835253 /nfs/dbraw/zinc/83/52/53/1044835253.db2.gz DUNGCVQQQGHSKJ-UHFFFAOYSA-N -1 1 335.112 4.366 20 0 EIADMM O=S(=O)([N-]c1cc(C2CCCC2)n[nH]1)c1cccc2ccccc21 ZINC000474417249 1044944145 /nfs/dbraw/zinc/94/41/45/1044944145.db2.gz UQVSIXPAFIERDJ-UHFFFAOYSA-N -1 1 341.436 4.021 20 0 EIADMM C[C@@H]1C[C@@H](c2ccc(F)cc2)CN1C(=O)c1c([O-])cccc1Cl ZINC000736724924 1044965503 /nfs/dbraw/zinc/96/55/03/1044965503.db2.gz PZDOQAWAWQMIPB-DGCLKSJQSA-N -1 1 333.790 4.203 20 0 EIADMM Cc1cc(N2CCCC[C@H]2C)ccc1NC(=O)c1cc(F)ccc1[O-] ZINC001137540918 1045183684 /nfs/dbraw/zinc/18/36/84/1045183684.db2.gz ZHBNVZSNCUGUCV-CQSZACIVSA-N -1 1 342.414 4.471 20 0 EIADMM CC[C@@H]([N-]C(=O)C(F)(F)c1ccc(F)cc1)c1cc(F)ccc1F ZINC000740799543 1045224873 /nfs/dbraw/zinc/22/48/73/1045224873.db2.gz PYCLIKUFDBIFMY-OAHLLOKOSA-N -1 1 343.295 4.463 20 0 EIADMM C[C@H](NC(=O)c1c([O-])cnc2c(F)cccc21)c1ccc(Cl)cc1 ZINC001626019421 1045276994 /nfs/dbraw/zinc/27/69/94/1045276994.db2.gz YXSQYXACOKFJKE-JTQLQIEISA-N -1 1 344.773 4.224 20 0 EIADMM CCOc1cc(C(=O)Nc2ccnn2C2CCCC2)cc(Cl)c1[O-] ZINC000762594468 1045308501 /nfs/dbraw/zinc/30/85/01/1045308501.db2.gz XIMRJQGTWSWNNW-UHFFFAOYSA-N -1 1 349.818 4.008 20 0 EIADMM CCOc1cc(C(=O)N2CCC(CC(C)C)CC2)cc(Cl)c1[O-] ZINC000762624171 1045314205 /nfs/dbraw/zinc/31/42/05/1045314205.db2.gz UYVDLSNCNQGCTF-UHFFFAOYSA-N -1 1 339.863 4.343 20 0 EIADMM CC(C)c1cccnc1[N-]S(=O)(=O)/C=C/c1cccc(Cl)c1 ZINC000768864459 1045857075 /nfs/dbraw/zinc/85/70/75/1045857075.db2.gz RFOHRYGLIQISHC-CSKARUKUSA-N -1 1 336.844 4.271 20 0 EIADMM COc1cc(C(=O)Nc2cccc(N(C)C(C)C)c2)cc(Cl)c1[O-] ZINC000153802471 1045868228 /nfs/dbraw/zinc/86/82/28/1045868228.db2.gz LQBHIQPSUDDFSV-UHFFFAOYSA-N -1 1 348.830 4.151 20 0 EIADMM COC(=O)Cc1ccccc1Nc1cc(Cl)cc(Cl)c1[O-] ZINC001213060413 1045890743 /nfs/dbraw/zinc/89/07/43/1045890743.db2.gz ZYWNPFSBDRIMPE-UHFFFAOYSA-N -1 1 326.179 4.158 20 0 EIADMM COc1ccccc1[C@H]1CCCN1C(=O)c1c([O-])cccc1Cl ZINC000769751351 1046054619 /nfs/dbraw/zinc/05/46/19/1046054619.db2.gz GYTQCHUYZRYTNS-CQSZACIVSA-N -1 1 331.799 4.032 20 0 EIADMM Cc1cscc1NC(=O)c1ccc(NC(=O)OC(C)(C)C)cc1[O-] ZINC000770087948 1046142607 /nfs/dbraw/zinc/14/26/07/1046142607.db2.gz UOKDVIJYLKHUQU-UHFFFAOYSA-N -1 1 348.424 4.361 20 0 EIADMM O=C([N-][C@H](C1CCCC1)C(F)(F)F)C(F)(F)Cc1ccccc1 ZINC000793625229 1046315976 /nfs/dbraw/zinc/31/59/76/1046315976.db2.gz OCKLKAUDKPMXLL-CYBMUJFWSA-N -1 1 335.316 4.102 20 0 EIADMM CCNc1ccc(Cl)cc1C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000793708373 1046327593 /nfs/dbraw/zinc/32/75/93/1046327593.db2.gz BOXOSDINOKSZID-UHFFFAOYSA-N -1 1 325.195 4.383 20 0 EIADMM CCOc1cc(-c2noc(-c3ncc(C)cc3C)n2)cc(Cl)c1[O-] ZINC000771109949 1046331969 /nfs/dbraw/zinc/33/19/69/1046331969.db2.gz VDFBGELVXJHRPV-UHFFFAOYSA-N -1 1 345.786 4.173 20 0 EIADMM Cc1ccccc1[C@H]1CN(Cc2cccc([O-])c2Cl)[C@@H](C)CO1 ZINC000508708464 1046352646 /nfs/dbraw/zinc/35/26/46/1046352646.db2.gz AUJUOJMCOPSAPZ-KBXCAEBGSA-N -1 1 331.843 4.316 20 0 EIADMM C[C@H]1CN(Cc2cccc([O-])c2Cl)C[C@@H](c2ccc(F)cc2)O1 ZINC000508720154 1046393556 /nfs/dbraw/zinc/39/35/56/1046393556.db2.gz PRVHEAOBEXRREM-SJCJKPOMSA-N -1 1 335.806 4.147 20 0 EIADMM CCc1ccc(S(=O)(=O)[N-]c2cccc(-c3nc(C)co3)c2)cc1 ZINC000126835070 1046570536 /nfs/dbraw/zinc/57/05/36/1046570536.db2.gz FILOYSPBWUHIMJ-UHFFFAOYSA-N -1 1 342.420 4.013 20 0 EIADMM CSc1cccc([N-]S(=O)(=O)c2cc(F)cc(Cl)c2)c1C ZINC000536989982 1046882323 /nfs/dbraw/zinc/88/23/23/1046882323.db2.gz GXWXEMBTURDYQF-UHFFFAOYSA-N -1 1 345.848 4.310 20 0 EIADMM Cc1nocc1[N-]C(=O)c1ccc(COc2ccc(C)cc2C)o1 ZINC001130354024 1047011899 /nfs/dbraw/zinc/01/18/99/1047011899.db2.gz AACVXUUSSOMOEZ-UHFFFAOYSA-N -1 1 326.352 4.024 20 0 EIADMM [O-]c1ccc(F)cc1-c1nc(-c2cc(Br)cs2)no1 ZINC000128813830 1047090653 /nfs/dbraw/zinc/09/06/53/1047090653.db2.gz XEJFJGTURXCGBG-UHFFFAOYSA-N -1 1 341.161 4.072 20 0 EIADMM COc1cc(C(=O)NC[C@@H](c2ccccc2)C(C)C)cc(Cl)c1[O-] ZINC000460212784 1047192860 /nfs/dbraw/zinc/19/28/60/1047192860.db2.gz ORWOJODLTIOIPV-OAHLLOKOSA-N -1 1 347.842 4.224 20 0 EIADMM CCOc1ccc([N-]S(=O)(=O)c2cccc3ccccc32)cc1F ZINC000325831578 1047328579 /nfs/dbraw/zinc/32/85/79/1047328579.db2.gz PLMRPXCSOATNBP-UHFFFAOYSA-N -1 1 345.395 4.178 20 0 EIADMM CSc1c(F)cccc1[N-]C(=O)c1cc(-c2ccccc2)on1 ZINC001130857784 1047417639 /nfs/dbraw/zinc/41/76/39/1047417639.db2.gz KQQAOTBXFKGSBX-UHFFFAOYSA-N -1 1 328.368 4.455 20 0 EIADMM CCc1c(C(=O)Nc2ccc([O-])c(Cl)c2)cnn1-c1ccccc1 ZINC000129577803 1047435872 /nfs/dbraw/zinc/43/58/72/1047435872.db2.gz LXKNOSQLXPYZMQ-UHFFFAOYSA-N -1 1 341.798 4.046 20 0 EIADMM CC(C)C[C@@H]([N-]S(=O)(=O)c1c(F)cccc1F)c1cccs1 ZINC000072002544 1047820865 /nfs/dbraw/zinc/82/08/65/1047820865.db2.gz DDNXFJNGFADSQX-CYBMUJFWSA-N -1 1 345.436 4.092 20 0 EIADMM CC(C)C[C@H]([N-]S(=O)(=O)c1c(F)cccc1F)c1cccs1 ZINC000072002543 1047820898 /nfs/dbraw/zinc/82/08/98/1047820898.db2.gz DDNXFJNGFADSQX-ZDUSSCGKSA-N -1 1 345.436 4.092 20 0 EIADMM C[C@@H]1c2c(F)cccc2CCN1C(=O)c1ccc2ccccc2c1[O-] ZINC001136939374 1047926695 /nfs/dbraw/zinc/92/66/95/1047926695.db2.gz XNSGXEAOMFUCIS-CYBMUJFWSA-N -1 1 335.378 4.444 20 0 EIADMM Cc1ccc([C@@H]2CCC[C@H]2N(C)C(=O)c2ccc(F)c([O-])c2)cc1 ZINC001136989528 1048036796 /nfs/dbraw/zinc/03/67/96/1048036796.db2.gz JKDDAAFEMRIPOG-FUHWJXTLSA-N -1 1 327.399 4.248 20 0 EIADMM O=C(Nc1c([O-])cc(Br)cc1Cl)c1cccc(F)c1 ZINC000556846019 1048070264 /nfs/dbraw/zinc/07/02/64/1048070264.db2.gz VYBWURZJHRPXMM-UHFFFAOYSA-N -1 1 344.567 4.200 20 0 EIADMM Cc1nc(C)c(C[N-]C(=O)C(F)(F)c2cccc(Cl)c2Cl)o1 ZINC000844145456 1048212495 /nfs/dbraw/zinc/21/24/95/1048212495.db2.gz ZMTAENNGDDPSMA-UHFFFAOYSA-N -1 1 349.164 4.006 20 0 EIADMM O=C(N=c1cc(-c2ccc(Cl)s2)[n-][nH]1)c1sccc1Cl ZINC000556943961 1048288754 /nfs/dbraw/zinc/28/87/54/1048288754.db2.gz UHQQGBRJTBSUEA-UHFFFAOYSA-N -1 1 344.248 4.181 20 0 EIADMM [O-]c1cccc(CNc2ccc(O[C@@H]3CCCC[C@@H]3O)cc2)c1Cl ZINC000815128731 1048340573 /nfs/dbraw/zinc/34/05/73/1048340573.db2.gz LHISCJVPKZSFPI-FUHWJXTLSA-N -1 1 347.842 4.340 20 0 EIADMM [O-]c1cccc(CNc2cc3c(cc2Cl)OCCCO3)c1Cl ZINC000815133534 1048361818 /nfs/dbraw/zinc/36/18/18/1048361818.db2.gz LXVNLEMRSPMLQT-UHFFFAOYSA-N -1 1 340.206 4.472 20 0 EIADMM O=C(Nc1cccc(SC(F)F)c1)c1c(F)ccc([O-])c1F ZINC000809660049 1048445663 /nfs/dbraw/zinc/44/56/63/1048445663.db2.gz AHMVGENJNLZGSQ-UHFFFAOYSA-N -1 1 331.290 4.237 20 0 EIADMM Cc1cc(Cl)ccc1S(=O)(=O)[N-]c1cccc(-c2ncco2)c1 ZINC000132820274 1048505919 /nfs/dbraw/zinc/50/59/19/1048505919.db2.gz PBSACFWMYSTARS-UHFFFAOYSA-N -1 1 348.811 4.104 20 0 EIADMM CC(C)c1cc([N-]C(=O)c2c(F)cc(C(F)(F)F)cc2F)no1 ZINC001135190662 1048594160 /nfs/dbraw/zinc/59/41/60/1048594160.db2.gz PXTZYZWDVOCYTD-UHFFFAOYSA-N -1 1 334.244 4.347 20 0 EIADMM CC(C)c1ccc(CCNC(=O)Cc2ccc([O-])c(Cl)c2)cc1 ZINC001135295691 1048644717 /nfs/dbraw/zinc/64/47/17/1048644717.db2.gz GRLZWSXLGKGEIL-UHFFFAOYSA-N -1 1 331.843 4.070 20 0 EIADMM CCC[C@@H](NC(=O)c1ccc(C(F)(F)F)cc1[O-])C1CCCC1 ZINC001299225601 1048660542 /nfs/dbraw/zinc/66/05/42/1048660542.db2.gz VDBPHAVZWVPJID-CQSZACIVSA-N -1 1 329.362 4.500 20 0 EIADMM O=C(NCCc1cccc2ccccc21)c1c([O-])cccc1Cl ZINC000920447862 1048676816 /nfs/dbraw/zinc/67/68/16/1048676816.db2.gz VWQOBHHQGPBPQV-UHFFFAOYSA-N -1 1 325.795 4.171 20 0 EIADMM O=C(NCc1ccccc1OC1CCCC1)c1c([O-])cccc1Cl ZINC000920454491 1048677428 /nfs/dbraw/zinc/67/74/28/1048677428.db2.gz MPPJJWJHRDJFKU-UHFFFAOYSA-N -1 1 345.826 4.297 20 0 EIADMM O=C(c1cc(Cl)ccc1[O-])N1CC[C@H](CSc2ccccc2)C1 ZINC000075199795 1048701879 /nfs/dbraw/zinc/70/18/79/1048701879.db2.gz KZKVVMBCDCRDLU-ZDUSSCGKSA-N -1 1 347.867 4.300 20 0 EIADMM Cc1cnc(C(=O)N(Cc2ccc(F)cc2)C2CCCCC2)c([O-])c1 ZINC001144543807 1048721355 /nfs/dbraw/zinc/72/13/55/1048721355.db2.gz DDDZCTGMDVMDIO-UHFFFAOYSA-N -1 1 342.414 4.210 20 0 EIADMM O=C(NCC(c1ccccc1)c1ccccc1)c1cc(F)ccc1[O-] ZINC001135464177 1048740337 /nfs/dbraw/zinc/74/03/37/1048740337.db2.gz CBAHEONHSHDNIF-UHFFFAOYSA-N -1 1 335.378 4.093 20 0 EIADMM [O-]c1cc(F)c(CN2CCn3cccc3[C@@H]2c2ccccc2)cc1F ZINC001144646649 1048769096 /nfs/dbraw/zinc/76/90/96/1048769096.db2.gz FQXHGRMSDQZSTO-FQEVSTJZSA-N -1 1 340.373 4.077 20 0 EIADMM [O-]c1cc(F)c(CN2Cc3nc(-c4ccccc4)sc3C2)cc1F ZINC001144663337 1048782507 /nfs/dbraw/zinc/78/25/07/1048782507.db2.gz CPFMOUVCKSAUPC-UHFFFAOYSA-N -1 1 344.386 4.310 20 0 EIADMM C[C@@H]([N-]C(=O)C(F)(F)c1ccc(F)cc1)c1ccc(F)c(F)c1 ZINC000920840657 1048801180 /nfs/dbraw/zinc/80/11/80/1048801180.db2.gz JPTAQQZFUKFUAN-SECBINFHSA-N -1 1 329.268 4.073 20 0 EIADMM O=C(Nc1ccc(N2CCCCCC2)cc1)c1ccc(F)c([O-])c1 ZINC001135637288 1048832756 /nfs/dbraw/zinc/83/27/56/1048832756.db2.gz MSKGVIDUQWXDGU-UHFFFAOYSA-N -1 1 328.387 4.164 20 0 EIADMM O=C([O-])c1occc1CN1CCC[C@H]1c1ccccc1C(F)(F)F ZINC000846243453 1048847105 /nfs/dbraw/zinc/84/71/05/1048847105.db2.gz BXBQKXIXCWLPDO-AWEZNQCLSA-N -1 1 339.313 4.334 20 0 EIADMM Cc1ccc(OCCC(=O)Nc2cccc(C(F)(F)F)c2[O-])cc1 ZINC001144759964 1048854399 /nfs/dbraw/zinc/85/43/99/1048854399.db2.gz MWRDKVCMZQAUIF-UHFFFAOYSA-N -1 1 339.313 4.127 20 0 EIADMM CSc1cccc(NC(=O)c2ccc3ccc(O)cc3c2[O-])c1 ZINC001135795497 1048888842 /nfs/dbraw/zinc/88/88/42/1048888842.db2.gz WMRVJGKLMFNJOO-UHFFFAOYSA-N -1 1 325.389 4.225 20 0 EIADMM Cc1ccccc1[C@@H](NC(=O)c1ncc2ccccc2c1[O-])C(C)C ZINC001145054082 1048983124 /nfs/dbraw/zinc/98/31/24/1048983124.db2.gz HCMQCGLWUGVARY-SFHVURJKSA-N -1 1 334.419 4.376 20 0 EIADMM O=C(NCc1cc(Cl)cc(Cl)c1)c1ncc2ccccc2c1[O-] ZINC001147135858 1049096874 /nfs/dbraw/zinc/09/68/74/1049096874.db2.gz AMPBQFVNPCIATR-UHFFFAOYSA-N -1 1 347.201 4.177 20 0 EIADMM O=C(Nc1ccccc1N1CCCC1)c1cc2ccccc2cc1[O-] ZINC001136132826 1049142896 /nfs/dbraw/zinc/14/28/96/1049142896.db2.gz DZEMARDURLNUEY-UHFFFAOYSA-N -1 1 332.403 4.398 20 0 EIADMM C[C@@H](NC(=O)c1ccc(F)c([O-])c1)c1cccc(Cl)c1Cl ZINC001147410529 1049147684 /nfs/dbraw/zinc/14/76/84/1049147684.db2.gz MBXRYKSTBLUPAV-MRVPVSSYSA-N -1 1 328.170 4.329 20 0 EIADMM O=C(N[C@H]1CCC[C@@H]1Cc1ccccc1)c1cc(Cl)ccc1[O-] ZINC001147496499 1049167048 /nfs/dbraw/zinc/16/70/48/1049167048.db2.gz ZFXONCNBJULPNB-PBHICJAKSA-N -1 1 329.827 4.187 20 0 EIADMM Cc1ccc([C@H]2[C@H](C)CCCN2C(=O)c2ccc(F)c([O-])c2)cc1 ZINC001147795740 1049217373 /nfs/dbraw/zinc/21/73/73/1049217373.db2.gz IAOFYKYZBQNIHZ-AUUYWEPGSA-N -1 1 327.399 4.453 20 0 EIADMM Cc1ccc([C@H]2[C@@H](C)CCCN2C(=O)c2ccc(F)c([O-])c2)cc1 ZINC001147795741 1049218196 /nfs/dbraw/zinc/21/81/96/1049218196.db2.gz IAOFYKYZBQNIHZ-IFXJQAMLSA-N -1 1 327.399 4.453 20 0 EIADMM CC[C@@H](NC(=O)c1ccc(F)c([O-])c1)c1ccccc1OC(F)F ZINC001136191607 1049269220 /nfs/dbraw/zinc/26/92/20/1049269220.db2.gz UJWMSYKOCLJRDZ-CYBMUJFWSA-N -1 1 339.313 4.014 20 0 EIADMM O=S(=O)(/C=C/c1ccccc1Cl)[N-]c1cc(C2CC2)ccn1 ZINC000811837761 1049286618 /nfs/dbraw/zinc/28/66/18/1049286618.db2.gz COKKNIKOHVATQI-CSKARUKUSA-N -1 1 334.828 4.025 20 0 EIADMM CCc1cccc(CC)c1NC(=O)c1ccc(-n2[n-]c(C)cc2=O)cc1 ZINC001148337524 1049302202 /nfs/dbraw/zinc/30/22/02/1049302202.db2.gz MPPLQKQGNTUWHG-UHFFFAOYSA-N -1 1 349.434 4.176 20 0 EIADMM O=C(N[C@H](c1ccccc1)c1ccc(F)cc1)c1cccc([O-])c1F ZINC001136223167 1049317307 /nfs/dbraw/zinc/31/73/07/1049317307.db2.gz GLMGZUVPTHBZBG-LJQANCHMSA-N -1 1 339.341 4.190 20 0 EIADMM COCCCOc1cccc(NC(=O)c2ccc(C(C)C)cc2[O-])c1 ZINC001148787941 1049369960 /nfs/dbraw/zinc/36/99/60/1049369960.db2.gz WXFSJZDWDYFEOV-UHFFFAOYSA-N -1 1 343.423 4.183 20 0 EIADMM C[C@@]1(CF)CC(F)(F)CN1C(=O)c1cccc(-c2ccccc2)c1[O-] ZINC001148867028 1049390533 /nfs/dbraw/zinc/39/05/33/1049390533.db2.gz KRDFDUYQIQAPCQ-SFHVURJKSA-N -1 1 349.352 4.269 20 0 EIADMM O=C(Nc1cnc2occc2c1)c1cccc(-c2ccccc2)c1[O-] ZINC001148867543 1049390788 /nfs/dbraw/zinc/39/07/88/1049390788.db2.gz XYRTVBXJQJBFIT-UHFFFAOYSA-N -1 1 330.343 4.453 20 0 EIADMM O=C(c1ccc2ccc(O)cc2c1[O-])N1CCC[C@H]1C1CCCC1 ZINC001136347002 1049519855 /nfs/dbraw/zinc/51/98/55/1049519855.db2.gz HEPRRGIFFCEYBK-SFHVURJKSA-N -1 1 325.408 4.046 20 0 EIADMM CC(C)Oc1ccc([C@H](C)NC(=O)Cc2ccc([O-])c(Cl)c2)cc1 ZINC001136408676 1049590957 /nfs/dbraw/zinc/59/09/57/1049590957.db2.gz WOSKIDZZVFUQEO-ZDUSSCGKSA-N -1 1 347.842 4.253 20 0 EIADMM CC(C)(C)Oc1ccc(CNC(=O)c2ccc(Cl)cc2[O-])cc1 ZINC001136413131 1049598150 /nfs/dbraw/zinc/59/81/50/1049598150.db2.gz GRWCWDAAZRATQV-UHFFFAOYSA-N -1 1 333.815 4.153 20 0 EIADMM CCc1cccc(S(=O)(=O)[N-]c2ccccc2CC(F)(F)F)c1 ZINC000080940553 1049609685 /nfs/dbraw/zinc/60/96/85/1049609685.db2.gz SJLDFHKXZSRNPS-UHFFFAOYSA-N -1 1 343.370 4.155 20 0 EIADMM O=C(N[C@H](c1ccccc1)[C@H]1CCCO1)c1ccc2ccccc2c1[O-] ZINC001136524625 1049715523 /nfs/dbraw/zinc/71/55/23/1049715523.db2.gz IREJJLYPLXWCIE-WOJBJXKFSA-N -1 1 347.414 4.196 20 0 EIADMM CC[C@@H](NC(=O)c1cc(Br)ccc1[O-])c1ccc(C)cc1 ZINC001136536177 1049729732 /nfs/dbraw/zinc/72/97/32/1049729732.db2.gz SLLFUYKMNMXCMI-OAHLLOKOSA-N -1 1 348.240 4.344 20 0 EIADMM O=C(Nc1cccc(F)c1[O-])[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F ZINC001171636241 1049777585 /nfs/dbraw/zinc/77/75/85/1049777585.db2.gz FICXSVYMSOXRMH-ZYHUDNBSSA-N -1 1 337.753 4.456 20 0 EIADMM O=C(Nc1cccc(F)c1[O-])[C@H]1CC[C@H]1c1ccc(Cl)cc1F ZINC001171636236 1049777600 /nfs/dbraw/zinc/77/76/00/1049777600.db2.gz FICXSVYMSOXRMH-JQWIXIFHSA-N -1 1 337.753 4.456 20 0 EIADMM O=C(Nc1ccc(Cl)cc1-n1cccc1)c1ccc([O-])c(F)c1 ZINC001136658531 1049816063 /nfs/dbraw/zinc/81/60/63/1049816063.db2.gz ZVMLGVNFLKAFTK-UHFFFAOYSA-N -1 1 330.746 4.228 20 0 EIADMM O=C(N[C@H](c1ccc(Cl)cc1)C1CCC1)c1ccc([O-])c(F)c1 ZINC001136712537 1049842349 /nfs/dbraw/zinc/84/23/49/1049842349.db2.gz FVAPDYGEYWRLMJ-KRWDZBQOSA-N -1 1 333.790 4.456 20 0 EIADMM CC[C@@H](C)[C@@H](C)N(C(=O)c1ccc2ccc(O)cc2c1[O-])C1CC1 ZINC001136714622 1049844453 /nfs/dbraw/zinc/84/44/53/1049844453.db2.gz RMYPVGXZOVBJNR-CHWSQXEVSA-N -1 1 327.424 4.290 20 0 EIADMM Cc1c(=O)[n-]n(-c2ccccc2)c1N[C@@H]1CSc2ccccc2C1 ZINC001172195177 1049868316 /nfs/dbraw/zinc/86/83/16/1049868316.db2.gz ZQKPWLTUCZXFNY-HNNXBMFYSA-N -1 1 337.448 4.015 20 0 EIADMM CSc1cc(Cl)ccc1[N-]C(=O)c1nnc(C(C)(C)C)s1 ZINC000617252442 1049970181 /nfs/dbraw/zinc/97/01/81/1049970181.db2.gz VZMVNEYYFVCVSO-UHFFFAOYSA-N -1 1 341.889 4.463 20 0 EIADMM CCCCC1CCC(C[N-]S(=O)(=O)c2cc(F)ccc2F)CC1 ZINC001185870708 1050175300 /nfs/dbraw/zinc/17/53/00/1050175300.db2.gz YVPFNKNCXXJROJ-UHFFFAOYSA-N -1 1 345.455 4.240 20 0 EIADMM Cc1cc(F)ccc1[C@H](C)NC(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC001177322809 1050193300 /nfs/dbraw/zinc/19/33/00/1050193300.db2.gz XHYAIPSZJGETCS-JTQLQIEISA-N -1 1 341.304 4.350 20 0 EIADMM CC1(C)CCC(CC(=O)Nc2ccc(-n3ccc(=O)[n-]3)cc2)CC1 ZINC001185974580 1050205171 /nfs/dbraw/zinc/20/51/71/1050205171.db2.gz CIPMHDFHXXKONN-UHFFFAOYSA-N -1 1 327.428 4.123 20 0 EIADMM CCCCc1ccc(-c2noc(-c3ncc(C(F)(F)F)[n-]3)n2)cc1 ZINC001212688662 1050217101 /nfs/dbraw/zinc/21/71/01/1050217101.db2.gz NUWWPBLGPIUKEL-UHFFFAOYSA-N -1 1 336.317 4.488 20 0 EIADMM CCCCc1ccc(-c2noc(-c3nc(C(F)(F)F)c[n-]3)n2)cc1 ZINC001212688662 1050217111 /nfs/dbraw/zinc/21/71/11/1050217111.db2.gz NUWWPBLGPIUKEL-UHFFFAOYSA-N -1 1 336.317 4.488 20 0 EIADMM COc1ccc(-c2ccccc2NC(=O)c2ccc([O-])c(F)c2)cc1 ZINC001186226953 1050266207 /nfs/dbraw/zinc/26/62/07/1050266207.db2.gz VRUPDIBBCLPQGF-UHFFFAOYSA-N -1 1 337.350 4.459 20 0 EIADMM CCCOC1CCC(Nc2c(C)c(=O)[n-]n2-c2ccccc2)CC1 ZINC001173096897 1050288200 /nfs/dbraw/zinc/28/82/00/1050288200.db2.gz UZDYVGMOSPTZDT-UHFFFAOYSA-N -1 1 329.444 4.036 20 0 EIADMM Cc1ccc(-c2ccc(-c3noc(-c4ccncc4[O-])n3)cc2)cc1 ZINC001212722729 1050418577 /nfs/dbraw/zinc/41/85/77/1050418577.db2.gz XXLVRSCTOVZBDG-UHFFFAOYSA-N -1 1 329.359 4.480 20 0 EIADMM O=C(NCc1ccc(C(F)(F)F)cc1)Nc1cccc([O-])c1Cl ZINC001186815850 1050425728 /nfs/dbraw/zinc/42/57/28/1050425728.db2.gz MKGXNYGPGFNORH-UHFFFAOYSA-N -1 1 344.720 4.386 20 0 EIADMM C/C(=C\C1CCC(C)CC1)C(=O)NCCc1c(F)cc([O-])cc1F ZINC001178785212 1050552870 /nfs/dbraw/zinc/55/28/70/1050552870.db2.gz PXXNGFUXSMDJBN-UKTHLTGXSA-N -1 1 337.410 4.102 20 0 EIADMM [O-]C(c1cccc(Nc2ccoc2)c1)(C(F)(F)F)C(F)(F)F ZINC001173937776 1050654992 /nfs/dbraw/zinc/65/49/92/1050654992.db2.gz KWRLVSDLPYGGHD-UHFFFAOYSA-N -1 1 325.208 4.335 20 0 EIADMM CCOc1cc(C(=O)N[C@@H]2CC[C@@H]2c2ccccc2)cc(Cl)c1[O-] ZINC000619218974 1050710893 /nfs/dbraw/zinc/71/08/93/1050710893.db2.gz MBRBIGFCQLIQNS-GDBMZVCRSA-N -1 1 345.826 4.120 20 0 EIADMM CCCc1cc(=O)[n-]c(SCCSc2ccc(F)cc2F)n1 ZINC001188161687 1050711691 /nfs/dbraw/zinc/71/16/91/1050711691.db2.gz CEBUOVVCEROXAQ-UHFFFAOYSA-N -1 1 342.436 4.297 20 0 EIADMM COC(=O)[N-]C(=S)N(c1ccccc1N)c1ccc(C)cc1Cl ZINC001174045924 1050721914 /nfs/dbraw/zinc/72/19/14/1050721914.db2.gz QOZUSPNMKYUNJS-UHFFFAOYSA-N -1 1 349.843 4.010 20 0 EIADMM CC1CCN(c2ccc(F)cc2NC(=O)c2ccc(F)c([O-])c2)CC1 ZINC001179609402 1050731584 /nfs/dbraw/zinc/73/15/84/1050731584.db2.gz PYILNHWCFUEHGW-UHFFFAOYSA-N -1 1 346.377 4.159 20 0 EIADMM O=C(Nc1cc(F)c([O-])cc1Cl)[C@H]1SCCc2sccc21 ZINC001179660273 1050740862 /nfs/dbraw/zinc/74/08/62/1050740862.db2.gz NSDCDHONAYNVSL-ZDUSSCGKSA-N -1 1 343.832 4.215 20 0 EIADMM CC(C)(C)c1nnc([N-]c2ccc(C(=O)NC3CCCCC3)cc2)o1 ZINC001174080695 1050755626 /nfs/dbraw/zinc/75/56/26/1050755626.db2.gz GBMTXBPYPLDZNS-UHFFFAOYSA-N -1 1 342.443 4.173 20 0 EIADMM O=C(NC1CCCCC1)c1ccc(Nc2cc([O-])c(F)c(F)c2)cc1 ZINC001174081924 1050757868 /nfs/dbraw/zinc/75/78/68/1050757868.db2.gz WMWWLZKXLSZPAH-UHFFFAOYSA-N -1 1 346.377 4.477 20 0 EIADMM CN(C)C(=O)c1cccc(Nc2cc(Cl)c([O-])cc2Cl)c1 ZINC001174086963 1050761579 /nfs/dbraw/zinc/76/15/79/1050761579.db2.gz WVVHOGXNBQJTIK-UHFFFAOYSA-N -1 1 325.195 4.144 20 0 EIADMM CCCCNC(=O)c1ccc(Nc2cc([O-])c(Cl)cc2F)cc1 ZINC001174123127 1050763931 /nfs/dbraw/zinc/76/39/31/1050763931.db2.gz CGDRERWOBCSYSN-UHFFFAOYSA-N -1 1 336.794 4.458 20 0 EIADMM O=C(Nc1nc2ccccc2s1)c1ccc([O-])c(C(F)(F)F)c1 ZINC001188564095 1050793420 /nfs/dbraw/zinc/79/34/20/1050793420.db2.gz QWURHRSNWKQLTI-UHFFFAOYSA-N -1 1 338.310 4.273 20 0 EIADMM CCS[C@H]1CCC[C@@H](NC(=O)c2ccc(C(F)(F)F)c([O-])c2)C1 ZINC000619582468 1050825081 /nfs/dbraw/zinc/82/50/81/1050825081.db2.gz ILUINLMNCZJKSQ-NEPJUHHUSA-N -1 1 347.402 4.205 20 0 EIADMM CC(=O)NCc1ccc(Nc2cc(Cl)c([O-])cc2Cl)cc1 ZINC001174231749 1050857254 /nfs/dbraw/zinc/85/72/54/1050857254.db2.gz LZMMIDDQRCZPMB-UHFFFAOYSA-N -1 1 325.195 4.079 20 0 EIADMM O=C(Nc1cccc(C(F)(F)F)c1[O-])c1cccc(-c2cc[nH]n2)c1 ZINC001189023102 1050889814 /nfs/dbraw/zinc/88/98/14/1050889814.db2.gz XPKLPVIQDSFEQQ-UHFFFAOYSA-N -1 1 347.296 4.053 20 0 EIADMM CC(=O)NCc1cccc(Nc2c(Cl)ccc([O-])c2Cl)c1 ZINC001174369344 1050932089 /nfs/dbraw/zinc/93/20/89/1050932089.db2.gz NJAFODBNKQPGCI-UHFFFAOYSA-N -1 1 325.195 4.079 20 0 EIADMM Cc1cccc(C2=CCN(C(=O)c3c(F)ccc([O-])c3F)CC2)c1C ZINC001180324699 1050968147 /nfs/dbraw/zinc/96/81/47/1050968147.db2.gz OEUAWXVZOTWXLV-UHFFFAOYSA-N -1 1 343.373 4.217 20 0 EIADMM [O-]c1cccc(CN2CCc3ccc(Br)cc32)c1Cl ZINC001180752931 1051069893 /nfs/dbraw/zinc/06/98/93/1051069893.db2.gz WEZXGRYVDOFUNK-UHFFFAOYSA-N -1 1 338.632 4.371 20 0 EIADMM [O-]c1ccc(Cl)c(Nc2cnn([C@H]3CCCCO3)c2)c1Cl ZINC001174613240 1051110818 /nfs/dbraw/zinc/11/08/18/1051110818.db2.gz WJNNGOCBNAULMX-GFCCVEGCSA-N -1 1 328.199 4.338 20 0 EIADMM [O-]c1cccc(CN2CCN(C3CC3)c3ccc(F)cc32)c1Cl ZINC001181041680 1051133813 /nfs/dbraw/zinc/13/38/13/1051133813.db2.gz AZKHQNSWINNBKP-UHFFFAOYSA-N -1 1 332.806 4.174 20 0 EIADMM CC1(C)CCC[C@H](CSc2nc(-c3ccccc3)cc(=O)[n-]2)O1 ZINC001190209816 1051136868 /nfs/dbraw/zinc/13/68/68/1051136868.db2.gz JSZDKEPNQTUTDF-CQSZACIVSA-N -1 1 330.453 4.289 20 0 EIADMM CCC(C)(C)c1ccc(S(=O)(=O)[N-]c2cccc(OC)c2C)cc1 ZINC001190446012 1051178369 /nfs/dbraw/zinc/17/83/69/1051178369.db2.gz ZTHYWQAKNZSHHR-UHFFFAOYSA-N -1 1 347.480 4.492 20 0 EIADMM CCOc1cc(C(=O)Nc2cncc(C(F)F)c2)cc(Cl)c1[O-] ZINC001174887248 1051204607 /nfs/dbraw/zinc/20/46/07/1051204607.db2.gz YEFROQRKIJTCLG-UHFFFAOYSA-N -1 1 342.729 4.029 20 0 EIADMM O=C(Nc1cc(F)c([O-])c(F)c1)Nc1ccccc1OC(F)(F)F ZINC001190683917 1051256468 /nfs/dbraw/zinc/25/64/68/1051256468.db2.gz NVEBXVRHOQNJDW-UHFFFAOYSA-N -1 1 348.227 4.213 20 0 EIADMM O=C(Nc1ccc(OC(F)(F)F)cc1)Nc1c([O-])cccc1F ZINC001190737832 1051266192 /nfs/dbraw/zinc/26/61/92/1051266192.db2.gz RUKVLPQMINWQHX-UHFFFAOYSA-N -1 1 330.237 4.074 20 0 EIADMM O=S(=O)([N-]c1ccc(-c2ccccc2)c(Cl)c1)c1ccncc1 ZINC001190897568 1051300422 /nfs/dbraw/zinc/30/04/22/1051300422.db2.gz GFLRDYSEXLNPNU-UHFFFAOYSA-N -1 1 344.823 4.203 20 0 EIADMM CC(C)COc1cc(F)cc(Nc2cc3ccc([O-])cc3oc2=O)c1 ZINC001175059620 1051309988 /nfs/dbraw/zinc/30/99/88/1051309988.db2.gz MWVGSDUJIHPLOX-UHFFFAOYSA-N -1 1 343.354 4.416 20 0 EIADMM C[C@@]1([N-]S(=O)(=O)c2sc3ccccc3c2Cl)CC=CCC1 ZINC001191220330 1051398217 /nfs/dbraw/zinc/39/82/17/1051398217.db2.gz HZIBJMHZZDNREM-OAHLLOKOSA-N -1 1 341.885 4.332 20 0 EIADMM COc1ccc(CCCC(=O)Nc2ccc([O-])c(Cl)c2)c(OC)c1 ZINC000155539091 1051429154 /nfs/dbraw/zinc/42/91/54/1051429154.db2.gz YZIIRYYBHPTAQF-UHFFFAOYSA-N -1 1 349.814 4.024 20 0 EIADMM CCCCOc1ccc(Nc2cc(S(=O)(=O)CC)ccc2[O-])cc1 ZINC001175241400 1051468285 /nfs/dbraw/zinc/46/82/85/1051468285.db2.gz OFJHVAGQHZUYPM-UHFFFAOYSA-N -1 1 349.452 4.108 20 0 EIADMM Fc1c(F)c(F)c([N-]c2cc(-c3ccccn3)no2)c(F)c1F ZINC001175382687 1051563076 /nfs/dbraw/zinc/56/30/76/1051563076.db2.gz AAGLZZBUBHNMAU-UHFFFAOYSA-N -1 1 327.212 4.176 20 0 EIADMM Cc1c(Cl)cc(Nc2ccc([S@](C)=O)cc2)c([O-])c1Cl ZINC001175480256 1051607648 /nfs/dbraw/zinc/60/76/48/1051607648.db2.gz XDUVVXJXEAZVEG-FQEVSTJZSA-N -1 1 330.236 4.488 20 0 EIADMM COc1cc(C(=O)[N-]c2c(F)cccc2F)sc1Br ZINC000157357492 1051629391 /nfs/dbraw/zinc/62/93/91/1051629391.db2.gz LUGBERFUELGPPY-UHFFFAOYSA-N -1 1 348.168 4.050 20 0 EIADMM CC(C)c1ccccc1NC(=O)Nc1cc(=O)n(-c2ccccc2)[n-]1 ZINC001192227455 1051674015 /nfs/dbraw/zinc/67/40/15/1051674015.db2.gz SNVCLPUKKCHNMB-UHFFFAOYSA-N -1 1 336.395 4.345 20 0 EIADMM Cc1[nH]nc2cc(Nc3c(Cl)c(F)[n-]c(=O)c3Cl)ccc12 ZINC001175657441 1051713781 /nfs/dbraw/zinc/71/37/81/1051713781.db2.gz SRLWSSPGTOVDIB-UHFFFAOYSA-N -1 1 327.146 4.161 20 0 EIADMM CCCC[C@H](CC)COCCCNC(=O)c1cc([O-])cc(F)c1F ZINC001192678457 1051789681 /nfs/dbraw/zinc/78/96/81/1051789681.db2.gz BQINAGZHZVEYEI-ZDUSSCGKSA-N -1 1 343.414 4.023 20 0 EIADMM COc1cccc([C@H](C)NC(=O)Nc2cc([O-])c(Cl)cc2F)c1 ZINC001192883038 1051824736 /nfs/dbraw/zinc/82/47/36/1051824736.db2.gz UCUGLJQYQBHWME-VIFPVBQESA-N -1 1 338.766 4.076 20 0 EIADMM O=C(Nc1cc(C2CC2)ccn1)c1c([O-])cnc2ccc(Cl)cc21 ZINC001183637339 1051875128 /nfs/dbraw/zinc/87/51/28/1051875128.db2.gz YYSLNYNRQGYLSA-UHFFFAOYSA-N -1 1 339.782 4.119 20 0 EIADMM O=C([N-]CCCSCc1ccc(C(F)(F)F)cc1)C(F)(F)F ZINC000774679050 1051894666 /nfs/dbraw/zinc/89/46/66/1051894666.db2.gz DWYVSIWXXPWLGO-UHFFFAOYSA-N -1 1 345.308 4.007 20 0 EIADMM CC(=O)c1c(F)cccc1NC(=O)c1ccc([O-])cc1C(F)(F)F ZINC001193748113 1051991792 /nfs/dbraw/zinc/99/17/92/1051991792.db2.gz PTTDCUJRJAVEOO-UHFFFAOYSA-N -1 1 341.260 4.005 20 0 EIADMM COc1ccc([N-]S(=O)(=O)c2ccc(C)c3ccccc32)c(C)c1 ZINC001193825259 1052005570 /nfs/dbraw/zinc/00/55/70/1052005570.db2.gz UXWOMMFGWHWIHX-UHFFFAOYSA-N -1 1 341.432 4.266 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccnc(Cl)c2C)c2ccccc12 ZINC001193834399 1052009452 /nfs/dbraw/zinc/00/94/52/1052009452.db2.gz PROUBPMTYIILMN-UHFFFAOYSA-N -1 1 346.839 4.306 20 0 EIADMM O=C(NC[C@H]1CCC=CCCC1)c1ccc(Br)c([O-])c1 ZINC001184450511 1052015363 /nfs/dbraw/zinc/01/53/63/1052015363.db2.gz KICWQIOWNZDPJJ-LBPRGKRZSA-N -1 1 338.245 4.021 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc([C@@H](C)O)cc2)c2ccccc12 ZINC001193857019 1052015891 /nfs/dbraw/zinc/01/58/91/1052015891.db2.gz KLXIQIBCTDHXFU-CQSZACIVSA-N -1 1 341.432 4.002 20 0 EIADMM Cc1ccc(-c2ccccc2)c([N-]S(=O)(=O)c2ccccc2N)c1 ZINC001193935140 1052024586 /nfs/dbraw/zinc/02/45/86/1052024586.db2.gz UYWASRDRDNYOFR-UHFFFAOYSA-N -1 1 338.432 4.045 20 0 EIADMM C[C@@H](NC(=O)Nc1cccc([O-])c1Br)c1ccccc1 ZINC001185026767 1052155436 /nfs/dbraw/zinc/15/54/36/1052155436.db2.gz ICGZOHBWMWBLQI-SNVBAGLBSA-N -1 1 335.201 4.037 20 0 EIADMM CCOC(=O)c1c(C)csc1Nc1c(F)cc(F)c([O-])c1F ZINC001176663516 1052158051 /nfs/dbraw/zinc/15/80/51/1052158051.db2.gz HSLGFCMBEHEVHH-UHFFFAOYSA-N -1 1 331.315 4.100 20 0 EIADMM Cc1cn(-c2ccc(Nc3c(F)cc(F)c([O-])c3F)cc2F)cn1 ZINC001176670990 1052158161 /nfs/dbraw/zinc/15/81/61/1052158161.db2.gz PKNOERJRNCOFHX-UHFFFAOYSA-N -1 1 337.276 4.186 20 0 EIADMM [O-]c1c(F)cc(F)c(Nc2nc(Cl)c(Cl)nc2Cl)c1F ZINC001176670180 1052158259 /nfs/dbraw/zinc/15/82/59/1052158259.db2.gz UFCKCYNNXVMOHU-UHFFFAOYSA-N -1 1 344.507 4.303 20 0 EIADMM [O-]c1c(F)cc(F)c(Nc2c3nsnc3ccc2Cl)c1F ZINC001176672509 1052160189 /nfs/dbraw/zinc/16/01/89/1052160189.db2.gz YSBZIQWNFHAOON-UHFFFAOYSA-N -1 1 331.706 4.211 20 0 EIADMM Cc1cccc(C)c1S(=O)(=O)[N-]c1ccc(F)cc1C(F)(F)F ZINC001194602099 1052176867 /nfs/dbraw/zinc/17/68/67/1052176867.db2.gz FOYSGDAUHHRZQQ-UHFFFAOYSA-N -1 1 347.333 4.262 20 0 EIADMM Cc1cccc(C)c1S(=O)(=O)[N-]c1cccc2c(Cl)nccc12 ZINC001194639869 1052183785 /nfs/dbraw/zinc/18/37/85/1052183785.db2.gz VQXOVEXBXKPMHG-UHFFFAOYSA-N -1 1 346.839 4.306 20 0 EIADMM Cc1cccc(C)c1S(=O)(=O)[N-]c1ccccc1-c1ccncc1 ZINC001194642769 1052183837 /nfs/dbraw/zinc/18/38/37/1052183837.db2.gz OAZUSRUDKVCEPG-UHFFFAOYSA-N -1 1 338.432 4.166 20 0 EIADMM Cc1ccc(OC(C)C)cc1[N-]S(=O)(=O)c1c(C)cccc1C ZINC001194642452 1052183852 /nfs/dbraw/zinc/18/38/52/1052183852.db2.gz FNJHWAGVKXRCDR-UHFFFAOYSA-N -1 1 333.453 4.200 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2ccccc2C(F)F)ccc1Cl ZINC001185521337 1052256148 /nfs/dbraw/zinc/25/61/48/1052256148.db2.gz QQTGMRXJCPMUQO-UHFFFAOYSA-N -1 1 331.771 4.387 20 0 EIADMM CC(C)C[C@@H]1CCCCN1C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000622431847 1052267620 /nfs/dbraw/zinc/26/76/20/1052267620.db2.gz NCWQHDQFHKPWLK-ZDUSSCGKSA-N -1 1 329.362 4.452 20 0 EIADMM O=C(Nc1cccnc1)Nc1c([O-])cc(C(F)(F)F)cc1Cl ZINC001185695340 1052283052 /nfs/dbraw/zinc/28/30/52/1052283052.db2.gz JSKGCAMNGFRHPY-UHFFFAOYSA-N -1 1 331.681 4.103 20 0 EIADMM CN(C(=O)c1cncc([O-])c1)[C@H](c1ccc(Cl)cc1)C1CCCC1 ZINC000622579233 1052333352 /nfs/dbraw/zinc/33/33/52/1052333352.db2.gz YZEHRJGARHMQRB-SFHVURJKSA-N -1 1 344.842 4.444 20 0 EIADMM O=C(c1ccc([O-])cc1)C1CCN(Cc2ccc(Cl)s2)CC1 ZINC000623172459 1052600672 /nfs/dbraw/zinc/60/06/72/1052600672.db2.gz DVZOKDRTYVWZIL-UHFFFAOYSA-N -1 1 335.856 4.202 20 0 EIADMM O=C([N-]c1c(F)cc(Cl)cc1F)c1csc([C@@H]2CCCO2)n1 ZINC000180352885 1052795415 /nfs/dbraw/zinc/79/54/15/1052795415.db2.gz JWQWAXPFWVUUEA-NSHDSACASA-N -1 1 344.770 4.179 20 0 EIADMM CCOc1cc(C(=O)N2C[C@H](C)[C@H]3CCCC[C@@H]32)cc(Cl)c1[O-] ZINC000183551287 1052977297 /nfs/dbraw/zinc/97/72/97/1052977297.db2.gz CJHFJYMHGNULKA-LNSITVRQSA-N -1 1 337.847 4.095 20 0 EIADMM COC(=O)c1coc(C(=O)[N-]c2ccccc2SC2CCCC2)c1 ZINC000184002219 1052989087 /nfs/dbraw/zinc/98/90/87/1052989087.db2.gz GTYSUTVWYOZRCV-UHFFFAOYSA-N -1 1 345.420 4.353 20 0 EIADMM CC(C)c1ccc([C@@H](C)N(C)Cc2nc(=O)c3sccc3[n-]2)cc1 ZINC000194990343 1053049925 /nfs/dbraw/zinc/04/99/25/1053049925.db2.gz WNJYFTQYLZVXRI-CYBMUJFWSA-N -1 1 341.480 4.301 20 0 EIADMM C[C@@H](NCc1cc(=O)oc2cc([O-])c(Cl)cc12)c1ccsc1 ZINC000794582346 1053194721 /nfs/dbraw/zinc/19/47/21/1053194721.db2.gz MPIVSBUBLFZZBC-SECBINFHSA-N -1 1 335.812 4.064 20 0 EIADMM CCOC(=O)NC(=S)[N-]c1ccccc1Oc1ccc(F)cc1 ZINC001195449363 1053401261 /nfs/dbraw/zinc/40/12/61/1053401261.db2.gz SUFUAYIJDRIWQN-UHFFFAOYSA-N -1 1 334.372 4.061 20 0 EIADMM CCOc1ccc(NC(=O)c2cc3ccccc3cc2[O-])cc1OC ZINC000011870818 1053618844 /nfs/dbraw/zinc/61/88/44/1053618844.db2.gz PWVRRSMJYUPGTE-UHFFFAOYSA-N -1 1 337.375 4.205 20 0 EIADMM CC(C)C(=O)Nc1ccc(NC(=O)c2cc3ccccc3cc2[O-])cc1 ZINC000011715106 1053624524 /nfs/dbraw/zinc/62/45/24/1053624524.db2.gz VHIXALQZLPHRBJ-UHFFFAOYSA-N -1 1 348.402 4.392 20 0 EIADMM Cc1c(C)c(C)c(S(=O)(=O)[N-]c2ccc(Cl)nc2)c(C)c1C ZINC000111009286 1053628934 /nfs/dbraw/zinc/62/89/34/1053628934.db2.gz IRIGGGZIMILJAA-UHFFFAOYSA-N -1 1 338.860 4.078 20 0 EIADMM CN(Cc1ccccc1Cl)C(=O)c1ccc2ccccc2c1[O-] ZINC000017918196 1053699511 /nfs/dbraw/zinc/69/95/11/1053699511.db2.gz AVKMIMZQORBRNX-UHFFFAOYSA-N -1 1 325.795 4.471 20 0 EIADMM Cc1ccc(-n2ccc(NC(=O)Nc3ccc([O-])c(Cl)c3)n2)cc1 ZINC001626035548 1053713568 /nfs/dbraw/zinc/71/35/68/1053713568.db2.gz YRNGLFGOEGOWSJ-UHFFFAOYSA-N -1 1 342.786 4.184 20 0 EIADMM CSc1ccc([O-])c(-c2nc(C[C@]3(C)CC3(Cl)Cl)no2)c1 ZINC000854063019 1053749635 /nfs/dbraw/zinc/74/96/35/1053749635.db2.gz IVWNIGTUTCBDDN-CYBMUJFWSA-N -1 1 345.251 4.291 20 0 EIADMM C[C@@H]([N-]C(=O)C(F)(F)c1ccccc1F)c1c(F)cccc1F ZINC000765605016 1053795463 /nfs/dbraw/zinc/79/54/63/1053795463.db2.gz UDFJWAWZVZDYLR-SECBINFHSA-N -1 1 329.268 4.073 20 0 EIADMM O=C(Nc1cc(F)c([O-])cc1Cl)[C@@H]1CCCC[C@H]1C(F)(F)F ZINC000885680366 1053815739 /nfs/dbraw/zinc/81/57/39/1053815739.db2.gz PSJFQYUQEUIFGR-HTQZYQBOSA-N -1 1 339.716 4.492 20 0 EIADMM [O-]c1cc(F)c(NC(=S)Nc2ccccc2C(F)(F)F)c(F)c1 ZINC001197264208 1053865065 /nfs/dbraw/zinc/86/50/65/1053865065.db2.gz BDHAFIIJBPVYHO-UHFFFAOYSA-N -1 1 348.296 4.498 20 0 EIADMM Cc1cnc(C(=O)Nc2cccc(C(F)(F)F)c2[O-])cc1Cl ZINC001197289950 1053876709 /nfs/dbraw/zinc/87/67/09/1053876709.db2.gz YTSLETKMDYHLPF-UHFFFAOYSA-N -1 1 330.693 4.020 20 0 EIADMM Cc1noc(C(C)C)c1C(=O)Nc1cccc(C(F)(F)F)c1[O-] ZINC001197361040 1053882896 /nfs/dbraw/zinc/88/28/96/1053882896.db2.gz IBJQJBNBPOEYCY-UHFFFAOYSA-N -1 1 328.290 4.083 20 0 EIADMM CC(C)CCc1nnc([N-]C(=O)c2conc2C2CCCC2)s1 ZINC000869227164 1053977902 /nfs/dbraw/zinc/97/79/02/1053977902.db2.gz YRJIHHFURYALED-UHFFFAOYSA-N -1 1 334.445 4.025 20 0 EIADMM O=C(Nc1cc(Cl)c([O-])c2ccccc12)C1CC2(CSC2)C1 ZINC000869376171 1053994966 /nfs/dbraw/zinc/99/49/66/1053994966.db2.gz QMESBPREHWQKEK-UHFFFAOYSA-N -1 1 333.840 4.281 20 0 EIADMM Cc1ccc(Cl)cc1[N-]S(=O)(=O)c1cc(Cl)ccc1C ZINC000031666148 1054072961 /nfs/dbraw/zinc/07/29/61/1054072961.db2.gz JVUQDTQFCFWQRF-UHFFFAOYSA-N -1 1 330.236 4.411 20 0 EIADMM O=C([O-])CC[C@@H]1CCCN(Cc2cc(C(F)(F)F)ccc2Cl)C1 ZINC000871621299 1054232396 /nfs/dbraw/zinc/23/23/96/1054232396.db2.gz YBUMHDIVPLJTPB-NSHDSACASA-N -1 1 349.780 4.436 20 0 EIADMM O=C([N-]Cc1ccc(Cl)cc1)C(F)(F)c1c(F)cccc1F ZINC000857429325 1054234413 /nfs/dbraw/zinc/23/44/13/1054234413.db2.gz XJUIUOXGSXUQOI-UHFFFAOYSA-N -1 1 331.696 4.026 20 0 EIADMM Cc1c(=O)[n-]c(SC[C@@H]2C[C@@H]3CCC[C@@H]3O2)nc1-c1ccccc1 ZINC000871666988 1054243845 /nfs/dbraw/zinc/24/38/45/1054243845.db2.gz BCTIQCGGCCPBNI-JYJNAYRXSA-N -1 1 342.464 4.207 20 0 EIADMM Cc1ccc2cc([N-]S(=O)(=O)c3ccc4occc4c3)ccc2n1 ZINC001198861073 1054285904 /nfs/dbraw/zinc/28/59/04/1054285904.db2.gz GJWDZJFSOPMGRV-UHFFFAOYSA-N -1 1 338.388 4.090 20 0 EIADMM Cc1cc(Br)c([O-])c(NC(=O)[C@@H]2C[C@@H]3C[C@@H]3C[C@H]2C)c1 ZINC001152518668 1054315911 /nfs/dbraw/zinc/31/59/11/1054315911.db2.gz UEZCDDILLFOCLP-NOOOWODRSA-N -1 1 338.245 4.084 20 0 EIADMM Cn1ccc2cccc(C(=O)Nc3cccc(C(F)(F)F)c3[O-])c21 ZINC001199017988 1054320287 /nfs/dbraw/zinc/32/02/87/1054320287.db2.gz IMMGRMCUVVQOPH-UHFFFAOYSA-N -1 1 334.297 4.155 20 0 EIADMM O=c1nc(Cl)cc(Oc2ccc(OCC3CC3)c(Cl)c2)[n-]1 ZINC000858554199 1054515905 /nfs/dbraw/zinc/51/59/05/1054515905.db2.gz CUIYXISSSPDIJS-UHFFFAOYSA-N -1 1 327.167 4.070 20 0 EIADMM CSc1ccc(NC(=S)Nc2cc(F)c([O-])cc2F)cc1 ZINC001201185851 1054707360 /nfs/dbraw/zinc/70/73/60/1054707360.db2.gz DJWWDYSCAGOXSX-UHFFFAOYSA-N -1 1 326.393 4.201 20 0 EIADMM CSc1ccc(NC(=S)Nc2cc(F)cc(F)c2[O-])cc1 ZINC001201184250 1054707898 /nfs/dbraw/zinc/70/78/98/1054707898.db2.gz CGRJVQYTHZSBQI-UHFFFAOYSA-N -1 1 326.393 4.201 20 0 EIADMM O=C(Nc1ccc(C(F)(F)F)cc1)Nc1cc(F)c([O-])cc1F ZINC001202412018 1055161048 /nfs/dbraw/zinc/16/10/48/1055161048.db2.gz GEOSBPDHKQLRQX-UHFFFAOYSA-N -1 1 332.228 4.333 20 0 EIADMM CCOc1cc(-c2noc([C@@H](OCC)C(C)C)n2)cc(Cl)c1[O-] ZINC000624574571 1055371849 /nfs/dbraw/zinc/37/18/49/1055371849.db2.gz RNEZERZHTWKNCL-AWEZNQCLSA-N -1 1 340.807 4.228 20 0 EIADMM CN(C(=O)c1ccc(C(F)(F)F)c([O-])c1)C(C)(C)c1ccccc1 ZINC000671891452 1055608198 /nfs/dbraw/zinc/60/81/98/1055608198.db2.gz GRJIXTKFAASRBZ-UHFFFAOYSA-N -1 1 337.341 4.418 20 0 EIADMM Cc1ccc(F)c(CN2CCC(c3ccccc3C(=O)[O-])CC2)c1F ZINC000903405322 1055713818 /nfs/dbraw/zinc/71/38/18/1055713818.db2.gz QBGWHNDFIMCODX-UHFFFAOYSA-N -1 1 345.389 4.351 20 0 EIADMM CCCCCC(C)(C)CNC(=O)c1ccc(Br)cc1[O-] ZINC000094989698 1056730587 /nfs/dbraw/zinc/73/05/87/1056730587.db2.gz ZPPAFAQNBACBLD-UHFFFAOYSA-N -1 1 342.277 4.491 20 0 EIADMM Cc1ccnc(Br)c1Nc1cc(F)c([O-])c(Cl)c1 ZINC001214482854 1056771161 /nfs/dbraw/zinc/77/11/61/1056771161.db2.gz RMPMYKVZTIRTQD-UHFFFAOYSA-N -1 1 331.572 4.394 20 0 EIADMM Cc1nc2ccc([N-]S(=O)(=O)c3ccccc3C(C)(C)C)cc2o1 ZINC000742027659 1058507678 /nfs/dbraw/zinc/50/76/78/1058507678.db2.gz TVMHDWMDDZIAOL-UHFFFAOYSA-N -1 1 344.436 4.235 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1cccc(-c2cscn2)c1 ZINC000743822579 1059140635 /nfs/dbraw/zinc/14/06/35/1059140635.db2.gz HJXLLUIWUVNJTM-UHFFFAOYSA-N -1 1 330.796 4.421 20 0 EIADMM CCc1ccc([C@H](C)C(=O)OCCc2cc(C(C)=O)ccc2[O-])cc1 ZINC000744945596 1059674162 /nfs/dbraw/zinc/67/41/62/1059674162.db2.gz PFQUFVPTSCIZAX-AWEZNQCLSA-N -1 1 340.419 4.047 20 0 EIADMM CC[C@H](CC(=O)OCCc1cc(C(C)=O)ccc1[O-])c1ccccc1 ZINC000744957034 1059681213 /nfs/dbraw/zinc/68/12/13/1059681213.db2.gz LIBSAFQUECURIO-MRXNPFEDSA-N -1 1 340.419 4.264 20 0 EIADMM CC(=O)c1ccc([O-])c(CCOC(=O)C[C@@H](C)c2ccc(F)cc2)c1 ZINC000745022500 1059703832 /nfs/dbraw/zinc/70/38/32/1059703832.db2.gz MHBLVRPWHUJETO-CYBMUJFWSA-N -1 1 344.382 4.013 20 0 EIADMM O=C(NCCc1c[nH]c2cc(Cl)ccc12)c1c([O-])cccc1Cl ZINC000745189822 1059775498 /nfs/dbraw/zinc/77/54/98/1059775498.db2.gz QCEKLFVSMSDWKJ-UHFFFAOYSA-N -1 1 349.217 4.153 20 0 EIADMM CCOc1ccc(Cl)c(Nc2cc3ccc([O-])cc3oc2=O)c1 ZINC001212575406 1059869761 /nfs/dbraw/zinc/86/97/61/1059869761.db2.gz DAPCAIQEDNGYMP-UHFFFAOYSA-N -1 1 331.755 4.294 20 0 EIADMM O=C(NCc1ccc(Cl)c(C(F)(F)F)c1)c1ccc([O-])cc1F ZINC001169209839 1060691524 /nfs/dbraw/zinc/69/15/24/1060691524.db2.gz GSCZVBDDARSOKT-UHFFFAOYSA-N -1 1 347.695 4.134 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1CCC[C@H](c2nccs2)C1 ZINC000172092163 1032276768 /nfs/dbraw/zinc/27/67/68/1032276768.db2.gz NZNKBOFDYKRAJA-AWEZNQCLSA-N -1 1 338.432 4.022 20 0 EIADMM O=C(CCCOc1ccccc1Cl)Nc1ccc([O-])c(Cl)c1 ZINC000532749155 1032287354 /nfs/dbraw/zinc/28/73/54/1032287354.db2.gz ZURLOHUNXUONRW-UHFFFAOYSA-N -1 1 340.206 4.497 20 0 EIADMM CC(=C([O-])Nc1nc(-c2ccccc2)ns1)c1cccc(Cl)c1 ZINC000607797477 1019421210 /nfs/dbraw/zinc/42/12/10/1019421210.db2.gz FAXWVSNYFXXPQS-LLVKDONJSA-N -1 1 343.839 4.023 20 0 EIADMM O=C(Cc1ccc([O-])c(Cl)c1)N(C1CC1)[C@@H]1CCc2ccccc21 ZINC001625806893 1019655123 /nfs/dbraw/zinc/65/51/23/1019655123.db2.gz GYTKQIZNMXLAAU-GOSISDBHSA-N -1 1 341.838 4.267 20 0 EIADMM O=C(N[C@H](c1ccsc1)c1ccc(Cl)cc1)c1cncc([O-])c1 ZINC000339833409 1019899539 /nfs/dbraw/zinc/89/95/39/1019899539.db2.gz GFMDUWCNHZEUFB-INIZCTEOSA-N -1 1 344.823 4.022 20 0 EIADMM CCc1cc2c(CN(C)c3cccc(C)c3C)cc(=O)oc2cc1[O-] ZINC001167108825 1020187561 /nfs/dbraw/zinc/18/75/61/1020187561.db2.gz UVSDOEDTBXPOOW-UHFFFAOYSA-N -1 1 337.419 4.314 20 0 EIADMM Cc1nc(-c2cccc(C(=O)Nc3ccc(F)cc3[O-])c2)cs1 ZINC000340331722 1020767675 /nfs/dbraw/zinc/76/76/75/1020767675.db2.gz XULJJLYNOZIXOA-UHFFFAOYSA-N -1 1 328.368 4.216 20 0 EIADMM [O-]c1ccc(-c2noc(C3(c4ccc(F)cc4)CCC3)n2)cc1F ZINC000683593619 1020949138 /nfs/dbraw/zinc/94/91/38/1020949138.db2.gz OSQSOFZUPPKOAQ-UHFFFAOYSA-N -1 1 328.318 4.190 20 0 EIADMM [O-]c1ccc(-c2noc(-c3ccc([C@H]4CCCOC4)cc3)n2)cc1F ZINC000683593519 1020949319 /nfs/dbraw/zinc/94/93/19/1020949319.db2.gz MNRGNCRXJUWWGC-HNNXBMFYSA-N -1 1 340.354 4.142 20 0 EIADMM CC[C@H](C)n1ncc(NC(=O)c2cc(SC)ccc2[O-])c1C1CC1 ZINC000613121158 1021736805 /nfs/dbraw/zinc/73/68/05/1021736805.db2.gz FKGBZNXKTWAIPY-NSHDSACASA-N -1 1 345.468 4.411 20 0 EIADMM CC(=Nc1cc(I)ccc1[O-])c1ccccc1 ZINC001210990056 1021896625 /nfs/dbraw/zinc/89/66/25/1021896625.db2.gz AHBSBPUARYLVPE-UHFFFAOYSA-N -1 1 337.160 4.080 20 0 EIADMM CCOc1cc([N-]S(=O)(=O)c2cccc(C(F)F)c2)ccc1C ZINC000780386778 1022009906 /nfs/dbraw/zinc/00/99/06/1022009906.db2.gz DIJNNJXBTCTAEW-UHFFFAOYSA-N -1 1 341.379 4.132 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2cccc(OC(F)(F)F)c2)cc1C ZINC000024429666 1022303392 /nfs/dbraw/zinc/30/33/92/1022303392.db2.gz BSNMBAPSEUJOJS-UHFFFAOYSA-N -1 1 345.342 4.003 20 0 EIADMM CCS[C@H]1CC[C@@H](N(C)C(=O)c2ccc3ccccc3c2[O-])C1 ZINC000175391938 1022349031 /nfs/dbraw/zinc/34/90/31/1022349031.db2.gz LRLHXMRXPDLBFY-CABCVRRESA-N -1 1 329.465 4.292 20 0 EIADMM O=c1cc(C2CC2)nc(SCc2csc(-c3ccco3)n2)[n-]1 ZINC000188141387 1022460775 /nfs/dbraw/zinc/46/07/75/1022460775.db2.gz ADKSXLFKZNGJKC-UHFFFAOYSA-N -1 1 331.422 4.068 20 0 EIADMM CSc1ccc(Cl)cc1[N-]C(=O)c1scc2c1OCCO2 ZINC001125475095 1022524016 /nfs/dbraw/zinc/52/40/16/1022524016.db2.gz MYSTVJWTUJNNII-UHFFFAOYSA-N -1 1 341.841 4.147 20 0 EIADMM [O-]c1ccc(-c2noc(-c3scnc3C3CCCC3)n2)c(F)c1 ZINC000580813039 1022535568 /nfs/dbraw/zinc/53/55/68/1022535568.db2.gz HJVCWBSVKNJFCK-UHFFFAOYSA-N -1 1 331.372 4.362 20 0 EIADMM CCc1ccc(CSc2nc(-c3ccccc3)c(C)c(=O)[n-]2)nc1 ZINC000549062164 1022537111 /nfs/dbraw/zinc/53/71/11/1022537111.db2.gz IRAQJYGUEJZDTH-UHFFFAOYSA-N -1 1 337.448 4.407 20 0 EIADMM CCOc1cc(C(=O)N(C)[C@@H]2CCCC[C@H]2C)cc(Cl)c1[O-] ZINC000186565655 1022673661 /nfs/dbraw/zinc/67/36/61/1022673661.db2.gz QLZINBMQBQDFQU-BXUZGUMPSA-N -1 1 325.836 4.095 20 0 EIADMM O=C(COc1ccccc1)Nc1cc(Cl)c([O-])c2ccccc12 ZINC001167439589 1022722732 /nfs/dbraw/zinc/72/27/32/1022722732.db2.gz ADQLLNZBLGYGCW-UHFFFAOYSA-N -1 1 327.767 4.216 20 0 EIADMM O=C(Nc1cc(Cl)c([O-])c2ccccc12)c1ccc2c(c1)OCO2 ZINC001167439747 1022731352 /nfs/dbraw/zinc/73/13/52/1022731352.db2.gz GUCCEEMCOHJLEX-UHFFFAOYSA-N -1 1 341.750 4.180 20 0 EIADMM O=C(COC1CCCCC1)Nc1cc(Cl)c([O-])c2ccccc12 ZINC001167440135 1022745141 /nfs/dbraw/zinc/74/51/41/1022745141.db2.gz QEAFUEQPGLYEHJ-UHFFFAOYSA-N -1 1 333.815 4.487 20 0 EIADMM CCOc1cc(C(=O)Nc2cc(F)c(F)cc2F)cc(Cl)c1[O-] ZINC000186783600 1022751063 /nfs/dbraw/zinc/75/10/63/1022751063.db2.gz MEZSUUVUYDVAOV-UHFFFAOYSA-N -1 1 345.704 4.114 20 0 EIADMM Cc1c(=O)[n-]c(SCc2ccc(Cl)cn2)nc1-c1ccccc1 ZINC000163900227 1022877267 /nfs/dbraw/zinc/87/72/67/1022877267.db2.gz IZJSUZIBNDANIK-UHFFFAOYSA-N -1 1 343.839 4.086 20 0 EIADMM Cc1ccc(C2CCN(C(=O)c3cc4ccccc4cc3[O-])CC2)cn1 ZINC000378624241 1022896021 /nfs/dbraw/zinc/89/60/21/1022896021.db2.gz NBYHVIJQRJZLPN-UHFFFAOYSA-N -1 1 346.430 4.269 20 0 EIADMM Cc1c(=O)[n-]c(SCCOCC2CCC2)nc1-c1ccccc1 ZINC000416906225 1023067031 /nfs/dbraw/zinc/06/70/31/1023067031.db2.gz KJFAHRHMWRSEKX-UHFFFAOYSA-N -1 1 330.453 4.066 20 0 EIADMM CCc1cccc2cc(CN[C@@H](C(=O)[O-])[C@@H](C)c3ccccc3)oc21 ZINC000656570336 1023248239 /nfs/dbraw/zinc/24/82/39/1023248239.db2.gz XPXLWDAGBYEKES-IFXJQAMLSA-N -1 1 337.419 4.342 20 0 EIADMM C[C@@H]1CC[N@@H+](CCSc2cc(Cl)ccc2Cl)C[C@@H]1C(=O)[O-] ZINC000584779978 1023311965 /nfs/dbraw/zinc/31/19/65/1023311965.db2.gz ZISHGQYQBOTYBS-PWSUYJOCSA-N -1 1 348.295 4.128 20 0 EIADMM COc1cc(CN[C@H](CC(=O)[O-])c2ccc(C)o2)cc2ccccc21 ZINC000417567210 1023362248 /nfs/dbraw/zinc/36/22/48/1023362248.db2.gz JDSDWYFLPZEFII-QGZVFWFLSA-N -1 1 339.391 4.055 20 0 EIADMM CCOc1c(Cl)cccc1CN[C@H]1C[C@H](C(=O)[O-])c2ccccc21 ZINC000417624517 1023385623 /nfs/dbraw/zinc/38/56/23/1023385623.db2.gz KWVCHFGFNBQDHH-RDJZCZTQSA-N -1 1 345.826 4.142 20 0 EIADMM CC(C)=CCNC(=O)c1c[n-]c2ccc(Oc3ccccc3)cc2c1=O ZINC000430615181 1023410854 /nfs/dbraw/zinc/41/08/54/1023410854.db2.gz BFOMXLXRYGUHCR-UHFFFAOYSA-N -1 1 348.402 4.016 20 0 EIADMM [O-]c1cc(F)c(Cl)cc1-c1cc(F)ccc1OC[C@@H]1CCOC1 ZINC000623048638 1023586237 /nfs/dbraw/zinc/58/62/37/1023586237.db2.gz PWXSCPICYZAZFF-SNVBAGLBSA-N -1 1 340.753 4.406 20 0 EIADMM CC[C@@H](C)Oc1cccc([N-]S(=O)(=O)c2ccc(C)c(F)c2)c1 ZINC000511735042 1023843634 /nfs/dbraw/zinc/84/36/34/1023843634.db2.gz AXZHRTSLCHZVKO-CYBMUJFWSA-N -1 1 337.416 4.112 20 0 EIADMM CC(C)(C)c1ccc(S(=O)(=O)[N-]c2cccc3[nH]ccc32)cc1 ZINC000110139176 1033172220 /nfs/dbraw/zinc/17/22/20/1033172220.db2.gz LSKXAMXACGFFQM-UHFFFAOYSA-N -1 1 328.437 4.266 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1CC[C@@](F)(c2ccccc2)C1 ZINC000521072705 1023947286 /nfs/dbraw/zinc/94/72/86/1023947286.db2.gz QVKBOAJFEDXVJS-NRFANRHFSA-N -1 1 335.378 4.256 20 0 EIADMM Cc1cc(C)c(N)c(Nc2ccc(F)c(Br)c2[O-])c1 ZINC001216103008 1024039584 /nfs/dbraw/zinc/03/95/84/1024039584.db2.gz XEHZMZXQYFTQRK-UHFFFAOYSA-N -1 1 325.181 4.236 20 0 EIADMM Cc1ccc(C(F)(F)C(=O)[N-]C2(C(F)(F)F)CCCCC2)cc1 ZINC001126156845 1024651021 /nfs/dbraw/zinc/65/10/21/1024651021.db2.gz PQZRPOGSPMHRSM-UHFFFAOYSA-N -1 1 335.316 4.468 20 0 EIADMM C[C@@H]1CCC[C@H](C)N1Cc1csc(-c2cccc(C(=O)[O-])c2)n1 ZINC000652367147 1024734494 /nfs/dbraw/zinc/73/44/94/1024734494.db2.gz RYRDDPPJQXVWDI-BETUJISGSA-N -1 1 330.453 4.271 20 0 EIADMM CSc1ccc(Cl)cc1[N-]S(=O)(=O)c1ccc(C)cc1 ZINC000049124574 1024802758 /nfs/dbraw/zinc/80/27/58/1024802758.db2.gz ZYYUSXMUZFSQPL-UHFFFAOYSA-N -1 1 327.858 4.171 20 0 EIADMM CC(C)CCN(Cc1coc(-c2ccc(C(=O)[O-])cc2)n1)C1CC1 ZINC000652394227 1024805649 /nfs/dbraw/zinc/80/56/49/1024805649.db2.gz PJRFXLCPFQQZJK-UHFFFAOYSA-N -1 1 328.412 4.050 20 0 EIADMM O=C([O-])CC[C@@H](CNCc1c(Cl)cccc1Cl)C(F)(F)F ZINC000663262180 1024963728 /nfs/dbraw/zinc/96/37/28/1024963728.db2.gz QOIYQRYYXGZMME-QMMMGPOBSA-N -1 1 344.160 4.126 20 0 EIADMM COc1ccc(-c2nc(-c3c(Cl)cccc3Cl)no2)c([O-])c1 ZINC000184837144 1024981917 /nfs/dbraw/zinc/98/19/17/1024981917.db2.gz ZMNMVTVWMVHZIW-UHFFFAOYSA-N -1 1 337.162 4.425 20 0 EIADMM C[C@H](NC(=O)c1ccc(C(F)(F)F)c([O-])c1)[C@H]1CCC[C@@H](C)C1 ZINC001626589397 1025191367 /nfs/dbraw/zinc/19/13/67/1025191367.db2.gz PLGVNPPVUOXUAW-WOPDTQHZSA-N -1 1 329.362 4.356 20 0 EIADMM C[C@H]1CO[C@H](c2ccccc2)CN1C(=O)c1cc2ccccc2cc1[O-] ZINC000110315569 1033267227 /nfs/dbraw/zinc/26/72/27/1033267227.db2.gz QJJPDAQSPBNJRQ-BTYIYWSLSA-N -1 1 347.414 4.148 20 0 EIADMM Cc1onc(-c2cccc(Cl)c2Cl)c1C(=O)[N-]c1cnoc1 ZINC000684657879 1025399766 /nfs/dbraw/zinc/39/97/66/1025399766.db2.gz WYDFONAYJGLUJZ-UHFFFAOYSA-N -1 1 338.150 4.197 20 0 EIADMM O=C(Nc1ccc(OC(F)(F)F)cc1Cl)c1ccc([O-])cc1F ZINC001167508780 1025782265 /nfs/dbraw/zinc/78/22/65/1025782265.db2.gz NVPSAUUSCJKPCT-UHFFFAOYSA-N -1 1 349.667 4.336 20 0 EIADMM O=C([N-]Cc1cc(F)ccc1F)C(F)(F)c1cccc(Cl)c1 ZINC000729440825 1025871636 /nfs/dbraw/zinc/87/16/36/1025871636.db2.gz MMGBKGCXLIPJCI-UHFFFAOYSA-N -1 1 331.696 4.026 20 0 EIADMM C[C@H](Cc1ccccc1)N(Cc1ccccc1)C(=O)c1ncccc1[O-] ZINC001167518968 1025911351 /nfs/dbraw/zinc/91/13/51/1025911351.db2.gz YPVBVQBDXKLOGW-QGZVFWFLSA-N -1 1 346.430 4.061 20 0 EIADMM Cc1cccc(NC2CCN(C(=O)c3ccc(Cl)cc3[O-])CC2)c1 ZINC000157767798 1026036317 /nfs/dbraw/zinc/03/63/17/1026036317.db2.gz NCQAXDWXPHSIQT-UHFFFAOYSA-N -1 1 344.842 4.071 20 0 EIADMM CC[C@@H](C)c1ccc(S(=O)(=O)[N-]c2ccc(Cl)nc2C)cc1 ZINC000318359796 1026066854 /nfs/dbraw/zinc/06/68/54/1026066854.db2.gz GGOXHDNWMIYZPL-LLVKDONJSA-N -1 1 338.860 4.358 20 0 EIADMM O=C(N[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl)c1ccc([O-])c(F)c1 ZINC000684776595 1026262169 /nfs/dbraw/zinc/26/21/69/1026262169.db2.gz GILRDVXCZPJFBJ-SMDDNHRTSA-N -1 1 340.181 4.124 20 0 EIADMM Cc1nc2cc(F)ccc2cc1C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000111666732 1026315130 /nfs/dbraw/zinc/31/51/30/1026315130.db2.gz QWPVXTPUBOHYPD-UHFFFAOYSA-N -1 1 330.746 4.294 20 0 EIADMM CC[C@H]([N-]C(=O)C(F)(F)c1ccccc1F)c1ccc(F)cc1F ZINC001126331106 1026382776 /nfs/dbraw/zinc/38/27/76/1026382776.db2.gz WQHDHSBGSQOQPK-HNNXBMFYSA-N -1 1 343.295 4.463 20 0 EIADMM CC[C@@H]([N-]C(=O)C(F)(F)c1ccccc1F)c1ccc(F)cc1F ZINC001126331107 1026384255 /nfs/dbraw/zinc/38/42/55/1026384255.db2.gz WQHDHSBGSQOQPK-OAHLLOKOSA-N -1 1 343.295 4.463 20 0 EIADMM CCOc1cc(-c2noc([C@H](C)Cc3ccco3)n2)cc(Cl)c1[O-] ZINC000664847634 1026471579 /nfs/dbraw/zinc/47/15/79/1026471579.db2.gz YZRGNOAJKLDKRT-SNVBAGLBSA-N -1 1 348.786 4.434 20 0 EIADMM Cc1ccc(-c2ccc(CN[C@H](Cc3ccccc3)C(=O)[O-])o2)cc1 ZINC000426685076 1026474330 /nfs/dbraw/zinc/47/43/30/1026474330.db2.gz FVQOSWVRSGUPKJ-LJQANCHMSA-N -1 1 335.403 4.041 20 0 EIADMM COc1cc(-c2ccccc2)ccc1CNCc1ccc(C(=O)[O-])cc1 ZINC000426696636 1026481135 /nfs/dbraw/zinc/48/11/35/1026481135.db2.gz PWMUNODLYWMKNJ-UHFFFAOYSA-N -1 1 347.414 4.350 20 0 EIADMM Cc1c(=O)[n-]c(S[C@@H]2CCOC(C)(C)C2)nc1-c1ccccc1 ZINC000582347205 1026482263 /nfs/dbraw/zinc/48/22/63/1026482263.db2.gz NYKVLUIOSOIBBS-CQSZACIVSA-N -1 1 330.453 4.207 20 0 EIADMM Cc1cc2cc(CN[C@H](CC(=O)[O-])c3ccsc3)oc2cc1C ZINC000426697777 1026484807 /nfs/dbraw/zinc/48/48/07/1026484807.db2.gz XOUAFDSKEWRJHL-MRXNPFEDSA-N -1 1 329.421 4.417 20 0 EIADMM O=C([O-])[C@H](NCc1ccc(F)c(Cl)c1)c1ccc(Cl)c(F)c1 ZINC000426727123 1026500784 /nfs/dbraw/zinc/50/07/84/1026500784.db2.gz MUVCGMKRTAUMOZ-CQSZACIVSA-N -1 1 346.160 4.187 20 0 EIADMM CCC/C=C/c1nc(-c2cc(Br)c([O-])c(OC)c2)no1 ZINC000664849210 1026519605 /nfs/dbraw/zinc/51/96/05/1026519605.db2.gz AZGMPNRQJOCRMT-AATRIKPKSA-N -1 1 339.189 4.027 20 0 EIADMM Cc1ccc([C@H](CC(=O)[O-])NCc2cnc(-c3cccs3)s2)o1 ZINC000426790187 1026563165 /nfs/dbraw/zinc/56/31/65/1026563165.db2.gz BJBUDYGSPCZESE-LBPRGKRZSA-N -1 1 348.449 4.079 20 0 EIADMM CC(C)(C)c1ncc(CN[C@@H](CCCc2ccccc2)C(=O)[O-])s1 ZINC000426795887 1026566552 /nfs/dbraw/zinc/56/65/52/1026566552.db2.gz ZDQPDVHDCLLRKD-INIZCTEOSA-N -1 1 346.496 4.006 20 0 EIADMM O=C([O-])C[C@H](NCc1ccsc1Cl)c1cccc(Cl)c1 ZINC000426815434 1026577465 /nfs/dbraw/zinc/57/74/65/1026577465.db2.gz FPFFWEBJEQPSCG-LBPRGKRZSA-N -1 1 330.236 4.361 20 0 EIADMM C[C@@H](c1cccs1)N(C)C(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684872928 1026640923 /nfs/dbraw/zinc/64/09/23/1026640923.db2.gz LJQHWCMSDLTIPG-VIFPVBQESA-N -1 1 329.343 4.306 20 0 EIADMM CC(C)Oc1ccc(NC(=O)c2ccc(C(F)(F)F)c([O-])c2)cc1 ZINC000684873195 1026641436 /nfs/dbraw/zinc/64/14/36/1026641436.db2.gz QPSVQDPZUXLCJR-UHFFFAOYSA-N -1 1 339.313 4.451 20 0 EIADMM Cc1ccc2c(c1)N(C(=O)c1ccc(C(F)(F)F)c([O-])c1)CCC2 ZINC000684874004 1026647324 /nfs/dbraw/zinc/64/73/24/1026647324.db2.gz IFEOLEGGSXWADU-UHFFFAOYSA-N -1 1 335.325 4.312 20 0 EIADMM CC(C)(C)c1ccc(S(=O)(=O)[N-]c2ccc3cc[nH]c3c2)cc1 ZINC000432645226 1026663709 /nfs/dbraw/zinc/66/37/09/1026663709.db2.gz UWXKGKYOUMLGHN-UHFFFAOYSA-N -1 1 328.437 4.266 20 0 EIADMM CCCc1ccc(S(=O)(=O)[N-]c2cccc(OC(F)F)c2)cc1 ZINC000511136992 1026710178 /nfs/dbraw/zinc/71/01/78/1026710178.db2.gz URFIFXFEXHZQOA-UHFFFAOYSA-N -1 1 341.379 4.041 20 0 EIADMM [O-]c1cccc(CN2CCO[C@@H](c3ccc(Cl)cc3)C2)c1Cl ZINC000507267819 1026725931 /nfs/dbraw/zinc/72/59/31/1026725931.db2.gz NIRSCZIWMOQVTN-MRXNPFEDSA-N -1 1 338.234 4.273 20 0 EIADMM O=C(Nc1ccc(F)cc1[O-])c1cccc(Br)c1Cl ZINC000507325002 1026745045 /nfs/dbraw/zinc/74/50/45/1026745045.db2.gz KMSZOUMLGBEOIO-UHFFFAOYSA-N -1 1 344.567 4.200 20 0 EIADMM Cc1ccccc1NC(=O)[C@@H](C)n1c(-c2cccs2)n[n-]c1=S ZINC000065575466 1026867530 /nfs/dbraw/zinc/86/75/30/1026867530.db2.gz PVKGGSJYVCVQHA-LLVKDONJSA-N -1 1 344.465 4.177 20 0 EIADMM O=C(NCc1ccc(-c2cccnc2)cc1)c1ccc(Cl)cc1[O-] ZINC000440656339 1026993038 /nfs/dbraw/zinc/99/30/38/1026993038.db2.gz CDJUJTPUTYANLC-UHFFFAOYSA-N -1 1 338.794 4.038 20 0 EIADMM CC(C)(C)c1ccc(C(F)(F)C(=O)[N-]CC(F)(F)C(F)F)cc1 ZINC001271612753 1027135734 /nfs/dbraw/zinc/13/57/34/1027135734.db2.gz WMIBUFPHWNOCNM-UHFFFAOYSA-N -1 1 341.295 4.093 20 0 EIADMM CCn1cc([N-]c2nn3cc(-c4ccc(Cl)cc4)nc3s2)cn1 ZINC000302378030 1027301074 /nfs/dbraw/zinc/30/10/74/1027301074.db2.gz BDAZRXDBJNIPQL-UHFFFAOYSA-N -1 1 344.831 4.071 20 0 EIADMM Cc1nc(-c2ccc(N[C@H]3CCC[C@@H](C)CC3)nc2)[n-]c(=O)c1C ZINC000302662124 1027355521 /nfs/dbraw/zinc/35/55/21/1027355521.db2.gz LWWLHYQZHHSLBX-WBMJQRKESA-N -1 1 326.444 4.242 20 0 EIADMM COc1c(F)c(F)ccc1Nc1ccc(F)c(Br)c1[O-] ZINC001211898522 1027420267 /nfs/dbraw/zinc/42/02/67/1027420267.db2.gz ILGNKKOHJFHZGD-UHFFFAOYSA-N -1 1 348.118 4.324 20 0 EIADMM O=C(c1ncccc1[O-])N1CCC[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000188443838 1027646328 /nfs/dbraw/zinc/64/63/28/1027646328.db2.gz SYWLJXYCDBMFNZ-ZDUSSCGKSA-N -1 1 337.206 4.071 20 0 EIADMM C[C@H](OCC(F)(F)F)c1noc(-c2ccc3ccccc3c2[O-])n1 ZINC000896606305 1027701273 /nfs/dbraw/zinc/70/12/73/1027701273.db2.gz IZWZLRIYWSLLMW-VIFPVBQESA-N -1 1 338.285 4.235 20 0 EIADMM Cc1nc(-c2ccc(NCC(C)(C)C(C)(C)C)nc2)[n-]c(=O)c1C ZINC000431509203 1027770085 /nfs/dbraw/zinc/77/00/85/1027770085.db2.gz NGYDVJOWZGDMMG-UHFFFAOYSA-N -1 1 328.460 4.345 20 0 EIADMM Cc1cc2cc[nH]c2cc1NC(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000444448728 1027796854 /nfs/dbraw/zinc/79/68/54/1027796854.db2.gz OJHVLHWLXHVQHJ-UHFFFAOYSA-N -1 1 334.297 4.453 20 0 EIADMM CCOc1cc(-c2nc([C@H]3CCC(F)(F)C3)no2)cc(Cl)c1[O-] ZINC000281253868 1028462394 /nfs/dbraw/zinc/46/23/94/1028462394.db2.gz DWYCKGQOQZRXNZ-QMMMGPOBSA-N -1 1 344.745 4.397 20 0 EIADMM CCOc1cc(-c2noc(-c3cc(C(C)C)no3)n2)cc(Cl)c1[O-] ZINC000445405448 1028518484 /nfs/dbraw/zinc/51/84/84/1028518484.db2.gz GDHWCTSAWPJBGN-UHFFFAOYSA-N -1 1 349.774 4.273 20 0 EIADMM CCOc1cc(-c2noc(/C=C\c3ccco3)n2)cc(Cl)c1[O-] ZINC000445429668 1028528220 /nfs/dbraw/zinc/52/82/20/1028528220.db2.gz BFKLHJMHVFRVQM-WAYWQWQTSA-N -1 1 332.743 4.258 20 0 EIADMM COc1ccc(/C=C\c2nc(-c3ccc([O-])cc3Cl)no2)cc1 ZINC000445450794 1028541989 /nfs/dbraw/zinc/54/19/89/1028541989.db2.gz WRPCUTZQMSKADO-WTKPLQERSA-N -1 1 328.755 4.275 20 0 EIADMM COc1ccc(O[C@@H](C)c2nc(-c3ccc([O-])cc3Cl)no2)cc1 ZINC000445449989 1028542221 /nfs/dbraw/zinc/54/22/21/1028542221.db2.gz XBTDHRJQXWJMJY-JTQLQIEISA-N -1 1 346.770 4.244 20 0 EIADMM [O-]c1ccc(-c2noc(CCCOCc3ccccc3)n2)c(Cl)c1 ZINC000445446189 1028578059 /nfs/dbraw/zinc/57/80/59/1028578059.db2.gz CWPHFRQERSCBDJ-UHFFFAOYSA-N -1 1 344.798 4.245 20 0 EIADMM [O-]c1ccc(-c2noc(/C=C/c3nc4ccccc4o3)n2)c(Cl)c1 ZINC000445447403 1028582892 /nfs/dbraw/zinc/58/28/92/1028582892.db2.gz OVDLMOSPYPZTBT-BQYQJAHWSA-N -1 1 339.738 4.407 20 0 EIADMM [O-]c1ccc(-c2noc([C@@H]3CCSc4ccccc43)n2)c(F)c1 ZINC000445454694 1028607529 /nfs/dbraw/zinc/60/75/29/1028607529.db2.gz ABMTVCDLVYTWAS-GFCCVEGCSA-N -1 1 328.368 4.209 20 0 EIADMM CCC(CC)n1nc(C)cc1-c1nc(-c2ccc([O-])cc2F)no1 ZINC000445459143 1028615914 /nfs/dbraw/zinc/61/59/14/1028615914.db2.gz XXQKPWNEYCDLIS-UHFFFAOYSA-N -1 1 330.363 4.114 20 0 EIADMM Cc1ccc(Br)cc1-c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445482433 1028629661 /nfs/dbraw/zinc/62/96/61/1028629661.db2.gz PREDKMQRSARTOV-UHFFFAOYSA-N -1 1 349.159 4.319 20 0 EIADMM Cc1ccc(C(=O)CCc2nc(-c3ccc([O-])c(F)c3)no2)cc1C ZINC000445483067 1028633567 /nfs/dbraw/zinc/63/35/67/1028633567.db2.gz UYSPJVOKFFAGCG-UHFFFAOYSA-N -1 1 340.354 4.014 20 0 EIADMM [O-]c1ccc(-c2noc(-c3ccc(Br)s3)n2)cc1F ZINC000445482190 1028633903 /nfs/dbraw/zinc/63/39/03/1028633903.db2.gz ROMDHMLXQRENMH-UHFFFAOYSA-N -1 1 341.161 4.072 20 0 EIADMM [O-]c1ccc(-c2noc(Cn3ccc4ccc(Cl)cc43)n2)cc1F ZINC000445473924 1028642663 /nfs/dbraw/zinc/64/26/63/1028642663.db2.gz PATXTWMPRWBBLR-UHFFFAOYSA-N -1 1 343.745 4.238 20 0 EIADMM CCSc1cccc(C(=O)Nc2ccc(-c3cc(=O)[nH][n-]3)cc2)c1 ZINC000343232857 1028742377 /nfs/dbraw/zinc/74/23/77/1028742377.db2.gz OQMFJVSPRIQNHS-UHFFFAOYSA-N -1 1 339.420 4.147 20 0 EIADMM CCOc1cc(-c2nc(-c3ccc(Cl)o3)no2)cc(Cl)c1[O-] ZINC000445593116 1028777501 /nfs/dbraw/zinc/77/75/01/1028777501.db2.gz OYSAKMBECVZJSL-UHFFFAOYSA-N -1 1 341.150 4.408 20 0 EIADMM O=S(=O)([N-]c1ccc(F)cc1F)c1c(Cl)cccc1Cl ZINC000016129362 1028785705 /nfs/dbraw/zinc/78/57/05/1028785705.db2.gz TWLDDZWCEYRNJM-UHFFFAOYSA-N -1 1 338.162 4.072 20 0 EIADMM CC[C@H](Oc1[n-]c(=S)ncc1F)c1ccc(Br)cc1 ZINC001227382155 1028971879 /nfs/dbraw/zinc/97/18/79/1028971879.db2.gz AZFZNSFQGADZHR-NSHDSACASA-N -1 1 343.221 4.197 20 0 EIADMM Cc1nnc(SCC(=O)c2ccc([O-])cc2)n1[C@@H]1CCC[C@H](C)C1 ZINC000536090899 1028973744 /nfs/dbraw/zinc/97/37/44/1028973744.db2.gz RDDDOGPSJSEWEO-SWLSCSKDSA-N -1 1 345.468 4.018 20 0 EIADMM COc1cc(SC)ccc1NC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000192649149 1029320848 /nfs/dbraw/zinc/32/08/48/1029320848.db2.gz HNAFBVWIOJHECI-UHFFFAOYSA-N -1 1 338.816 4.420 20 0 EIADMM COCc1ccc([C@@H]2CCCN2Cc2c(Cl)cccc2C(=O)[O-])o1 ZINC000565105667 1029633559 /nfs/dbraw/zinc/63/35/59/1029633559.db2.gz IEWWXNKIESPUGH-INIZCTEOSA-N -1 1 349.814 4.115 20 0 EIADMM Cc1nc(-c2ccc(N[C@@H](C)CCc3ccccc3)nc2)[n-]c(=O)c1C ZINC000301162502 1029678431 /nfs/dbraw/zinc/67/84/31/1029678431.db2.gz GPQPSIZGERZDQA-AWEZNQCLSA-N -1 1 348.450 4.294 20 0 EIADMM Cc1nc(-c2ccc(NC[C@H]3CCCC[C@@H]3C)nc2)[n-]c(=O)c1C ZINC000301349193 1029714347 /nfs/dbraw/zinc/71/43/47/1029714347.db2.gz IFNAZKZENICOCK-SWLSCSKDSA-N -1 1 326.444 4.099 20 0 EIADMM CCCC1(CNc2ccc(-c3nc(C)c(C)c(=O)[n-]3)cn2)CCC1 ZINC000301616310 1029774383 /nfs/dbraw/zinc/77/43/83/1029774383.db2.gz ABQZAEYMFWFOSC-UHFFFAOYSA-N -1 1 326.444 4.243 20 0 EIADMM Cc1c(=O)[n-]c(SC[C@H]2CCO[C@H](C)C2)nc1-c1ccccc1 ZINC000447284280 1029963957 /nfs/dbraw/zinc/96/39/57/1029963957.db2.gz FCYOOEIKUAGYJY-OCCSQVGLSA-N -1 1 330.453 4.065 20 0 EIADMM C[C@H]1C[C@H](c2cccnc2)N(C(=O)c2cc3ccccc3cc2[O-])C1 ZINC000182851496 1029994766 /nfs/dbraw/zinc/99/47/66/1029994766.db2.gz MQBJJVGBRCJJAH-IFXJQAMLSA-N -1 1 332.403 4.164 20 0 EIADMM CC1(C)[C@@H](c2ccc(F)cc2)CCN1C(=O)c1ccc([O-])c(F)c1 ZINC000529943447 1030002041 /nfs/dbraw/zinc/00/20/41/1030002041.db2.gz FLSAGLXXOHWQIZ-OAHLLOKOSA-N -1 1 331.362 4.079 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2ccc(-c3nccs3)cc2)ccc1F ZINC000096695250 1030018660 /nfs/dbraw/zinc/01/86/60/1030018660.db2.gz DBLBONXGRSISJK-UHFFFAOYSA-N -1 1 348.424 4.058 20 0 EIADMM CC(C)C[C@@]1(C)CCCN1C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000622637779 1030058007 /nfs/dbraw/zinc/05/80/07/1030058007.db2.gz GFGMIWASWRRJOR-MRXNPFEDSA-N -1 1 329.362 4.452 20 0 EIADMM Cc1nc(-c2ccc(N3CC[C@H](CC(C)(C)C)C3)nc2)[n-]c(=O)c1C ZINC000450943668 1030123756 /nfs/dbraw/zinc/12/37/56/1030123756.db2.gz IFWAWZBLAUMJQO-OAHLLOKOSA-N -1 1 340.471 4.124 20 0 EIADMM CC(C)c1ccc(S(=O)(=O)[N-]c2cccc3ncccc23)cc1 ZINC000008696923 1030189746 /nfs/dbraw/zinc/18/97/46/1030189746.db2.gz LPJXZUDNCBQLGG-UHFFFAOYSA-N -1 1 326.421 4.159 20 0 EIADMM [O-]c1ccc(-c2noc(-c3ccc(C(F)(F)F)s3)n2)cc1F ZINC000685366105 1030238735 /nfs/dbraw/zinc/23/87/35/1030238735.db2.gz XAVFTFUBTGNCLX-UHFFFAOYSA-N -1 1 330.262 4.329 20 0 EIADMM CCOc1cc(C(=O)N2CCC[C@]3(CC=CCC3)C2)cc(Cl)c1[O-] ZINC000186813043 1030309012 /nfs/dbraw/zinc/30/90/12/1030309012.db2.gz IHXMGWCVWVBMCD-LJQANCHMSA-N -1 1 349.858 4.407 20 0 EIADMM C[C@@H]1CC[C@@H](C(=O)[O-])CN1Cc1ccc(Cl)c(C(F)(F)F)c1 ZINC000263311179 1030338923 /nfs/dbraw/zinc/33/89/23/1030338923.db2.gz HZMWCCTYOGJBKV-MWLCHTKSSA-N -1 1 335.753 4.044 20 0 EIADMM Cc1ncccc1CN[C@H](CC(=O)[O-])c1cc(Cl)cc(Cl)c1 ZINC000426749777 1030813802 /nfs/dbraw/zinc/81/38/02/1030813802.db2.gz INKLOGORZJNJKP-OAHLLOKOSA-N -1 1 339.222 4.002 20 0 EIADMM CC(C)(C)CC(C)(C)NC(=O)c1ccc(Br)c([O-])c1 ZINC000226953688 1031106672 /nfs/dbraw/zinc/10/66/72/1031106672.db2.gz QSYPRDURFHELCR-UHFFFAOYSA-N -1 1 328.250 4.099 20 0 EIADMM CCOc1cc(-c2noc(-c3conc3C(C)C)n2)cc(Cl)c1[O-] ZINC000528169877 1031231491 /nfs/dbraw/zinc/23/14/91/1031231491.db2.gz VRJCGDKACWWIFD-UHFFFAOYSA-N -1 1 349.774 4.273 20 0 EIADMM O=C(Nc1ccc(F)cc1[O-])[C@@H]1C[C@H]1c1cccc(C(F)(F)F)c1 ZINC000532622137 1031432074 /nfs/dbraw/zinc/43/20/74/1031432074.db2.gz DUQMRRARMBEPMG-QWHCGFSZSA-N -1 1 339.288 4.292 20 0 EIADMM O=C(Nc1ccc(F)cc1[O-])c1cc(-c2ccc(Cl)s2)on1 ZINC000532620868 1031432421 /nfs/dbraw/zinc/43/24/21/1031432421.db2.gz WZFLGHCZOHJBGA-UHFFFAOYSA-N -1 1 338.747 4.154 20 0 EIADMM O=C(CCC(=O)c1ccc2c(c1)CCCC2)Nc1ccc(F)cc1[O-] ZINC000532012894 1031976524 /nfs/dbraw/zinc/97/65/24/1031976524.db2.gz NSCGSUPJORVCGM-UHFFFAOYSA-N -1 1 341.382 4.012 20 0 EIADMM CCc1cccc(S(=O)(=O)[N-]c2ccc(-c3nccs3)cc2)c1 ZINC000433493656 1034581093 /nfs/dbraw/zinc/58/10/93/1034581093.db2.gz LIWOAJCBBDXIFR-UHFFFAOYSA-N -1 1 344.461 4.173 20 0 EIADMM CCc1ccc([C@H]2CN(Cc3cccc([O-])c3Cl)CCO2)cc1 ZINC000513185387 1034831911 /nfs/dbraw/zinc/83/19/11/1034831911.db2.gz ZGUMCRYUPOVJLN-GOSISDBHSA-N -1 1 331.843 4.182 20 0 EIADMM CC(C)[C@H](NC(=O)c1ccc(Br)c([O-])c1)c1ccccc1 ZINC000485221863 1035785894 /nfs/dbraw/zinc/78/58/94/1035785894.db2.gz HHXGRKPFMKTDCV-INIZCTEOSA-N -1 1 348.240 4.282 20 0 EIADMM O=C(Nc1cccc2ccsc21)c1nc[n-]c1C(=O)c1ccccc1 ZINC000502142848 1035865495 /nfs/dbraw/zinc/86/54/95/1035865495.db2.gz NMZRFUUAQIWPFP-UHFFFAOYSA-N -1 1 347.399 4.108 20 0 EIADMM CCOc1cccc(C(=O)/C=C/c2ccc([O-])c(Br)c2)c1 ZINC000060162653 1035890512 /nfs/dbraw/zinc/89/05/12/1035890512.db2.gz CLIJOTQQBFXEAT-SOFGYWHQSA-N -1 1 347.208 4.450 20 0 EIADMM Cc1ncc([N-]c2cc(-c3cccc(Br)n3)no2)s1 ZINC001212130348 1036038121 /nfs/dbraw/zinc/03/81/21/1036038121.db2.gz LOKNEDJAOSJNCN-UHFFFAOYSA-N -1 1 337.202 4.008 20 0 EIADMM Cc1cnc(C(=O)N2CCCCC[C@@H]2/C=C/c2ccccc2)c([O-])c1 ZINC000460127397 1036094025 /nfs/dbraw/zinc/09/40/25/1036094025.db2.gz MCQQORBQOAHKGY-IENJSVCTSA-N -1 1 336.435 4.194 20 0 EIADMM O=C([N-]c1nnc(C2CCCCC2)s1)c1ccc(Cl)nc1F ZINC000906370840 1036248895 /nfs/dbraw/zinc/24/88/95/1036248895.db2.gz XEKDKOTXYHAIRH-UHFFFAOYSA-N -1 1 340.811 4.026 20 0 EIADMM O=C(Nc1c([O-])cc(Br)cc1Cl)[C@@H]1CC[C@H]2C[C@H]2C1 ZINC000572246278 1036472805 /nfs/dbraw/zinc/47/28/05/1036472805.db2.gz WJPVLSLTRLLTPB-YIZRAAEISA-N -1 1 344.636 4.183 20 0 EIADMM CO[C@H](C)c1cccc([N-]S(=O)(=O)c2cccc(Cl)c2C)c1 ZINC000588833549 1036545504 /nfs/dbraw/zinc/54/55/04/1036545504.db2.gz PNOAHOBZVDFRHC-GFCCVEGCSA-N -1 1 339.844 4.157 20 0 EIADMM O=C(Nc1nc2c(s1)CCCCC2)Nc1ccc([O-])c(Cl)c1 ZINC000486179701 1036549014 /nfs/dbraw/zinc/54/90/14/1036549014.db2.gz UKKOKIMNSFCPLC-UHFFFAOYSA-N -1 1 337.832 4.415 20 0 EIADMM COc1cccc(S(=O)(=O)[N-]c2ccccc2-c2ccccc2)c1 ZINC000589428734 1036798337 /nfs/dbraw/zinc/79/83/37/1036798337.db2.gz GYGPUHFSQDMSNR-UHFFFAOYSA-N -1 1 339.416 4.163 20 0 EIADMM CC(C)Oc1ccccc1CSc1nc(C(F)(F)F)cc(=O)[n-]1 ZINC000599124425 1036882116 /nfs/dbraw/zinc/88/21/16/1036882116.db2.gz ROYIILPKIMBKLH-UHFFFAOYSA-N -1 1 344.358 4.281 20 0 EIADMM CSc1ccc(C)c(NC(=O)c2c(C)nc(C(C)(C)C)[n-]c2=O)c1 ZINC000271923988 1037056733 /nfs/dbraw/zinc/05/67/33/1037056733.db2.gz KULWMKIXKCCPBJ-UHFFFAOYSA-N -1 1 345.468 4.071 20 0 EIADMM CC(C)C(=O)c1ccc([C@@H](C)C(=O)Nc2cc([O-])c(F)cc2F)cc1 ZINC000909986569 1037224496 /nfs/dbraw/zinc/22/44/96/1037224496.db2.gz OYJLBSMSLCREHT-LLVKDONJSA-N -1 1 347.361 4.251 20 0 EIADMM CC(C)(CC(=O)Nc1cc([O-])c(F)cc1F)CC(=O)c1ccccc1 ZINC000909986869 1037226822 /nfs/dbraw/zinc/22/68/22/1037226822.db2.gz VSZXKADZPKVNQT-UHFFFAOYSA-N -1 1 347.361 4.298 20 0 EIADMM CC(C)(C)OCc1ccccc1C(=O)Nc1cc(F)cc(F)c1[O-] ZINC000910981961 1037591507 /nfs/dbraw/zinc/59/15/07/1037591507.db2.gz GWFLGQUMNPZTDM-UHFFFAOYSA-N -1 1 335.350 4.238 20 0 EIADMM Cc1ccc(-c2cnc(CCC(=O)Nc3c([O-])cccc3F)o2)cc1 ZINC000605439638 1037787388 /nfs/dbraw/zinc/78/73/88/1037787388.db2.gz JGONMFFJBFSHTE-UHFFFAOYSA-N -1 1 340.354 4.066 20 0 EIADMM CCCCc1nc(CSc2nc(C(F)(F)F)cc(=O)[n-]2)cs1 ZINC000605446947 1037790929 /nfs/dbraw/zinc/79/09/29/1037790929.db2.gz WZTBAUFTEIPEBZ-UHFFFAOYSA-N -1 1 349.403 4.292 20 0 EIADMM C[C@@H](Sc1ccccc1Cl)C(=O)Nc1c([O-])cccc1F ZINC000605440555 1037791117 /nfs/dbraw/zinc/79/11/17/1037791117.db2.gz VGIGUFGDJBWUSS-SECBINFHSA-N -1 1 325.792 4.304 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc(Cl)c(OC(F)F)c2)cc1 ZINC000504043492 1038116288 /nfs/dbraw/zinc/11/62/88/1038116288.db2.gz QZYRYFCNPJDAHM-UHFFFAOYSA-N -1 1 347.770 4.051 20 0 EIADMM Cc1ccc(NC(=O)OC(C)(C)C)cc1NC(=O)c1ccccc1[O-] ZINC000150925116 1038236874 /nfs/dbraw/zinc/23/68/74/1038236874.db2.gz OLEGGDFXTJPYPJ-UHFFFAOYSA-N -1 1 342.395 4.300 20 0 EIADMM CC(C)(C)Oc1ccc([N-]S(=O)(=O)c2cccc(Cl)c2)cc1 ZINC000607616109 1038239796 /nfs/dbraw/zinc/23/97/96/1038239796.db2.gz YNSPMTFNJCTAGL-UHFFFAOYSA-N -1 1 339.844 4.318 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2cccc(Cl)c2Cl)sc1C ZINC000539111294 1038844298 /nfs/dbraw/zinc/84/42/98/1038844298.db2.gz ZKWHZDWFNQFJQQ-UHFFFAOYSA-N -1 1 336.265 4.473 20 0 EIADMM CCc1ccc(-c2ccc(CN3CCC[C@@H](C)[C@@H]3C(=O)[O-])o2)cc1 ZINC000424424455 1038845265 /nfs/dbraw/zinc/84/52/65/1038845265.db2.gz WSLQPEGQGYYONA-AUUYWEPGSA-N -1 1 327.424 4.194 20 0 EIADMM COCc1ccc(S(=O)(=O)[N-]c2c(C)cccc2C(C)C)cc1 ZINC000539231353 1038882929 /nfs/dbraw/zinc/88/29/29/1038882929.db2.gz NWFDUYZZSAGXMM-UHFFFAOYSA-N -1 1 333.453 4.066 20 0 EIADMM Cc1ccc(C)c(S(=O)(=O)[N-]c2ccc(-c3ccc[nH]3)cc2)c1 ZINC000539358322 1038994365 /nfs/dbraw/zinc/99/43/65/1038994365.db2.gz RWCKHHNKMTYRMU-UHFFFAOYSA-N -1 1 326.421 4.099 20 0 EIADMM Cc1nc(C(C)(C)C)[n-]c(=O)c1C(=O)N[C@H](C)[C@@H](C)C1CCCCC1 ZINC000481208308 1039123992 /nfs/dbraw/zinc/12/39/92/1039123992.db2.gz YCRMRYKYXUNDQL-CHWSQXEVSA-N -1 1 347.503 4.123 20 0 EIADMM Cc1csc(-c2cccc(NC(=O)c3c(F)ccc([O-])c3F)c2)n1 ZINC000552545890 1039644427 /nfs/dbraw/zinc/64/44/27/1039644427.db2.gz DWFNECXEEUBTMS-UHFFFAOYSA-N -1 1 346.358 4.355 20 0 EIADMM O=C(N[C@@H](c1ccccc1)C1CC1)c1ccc(Br)c([O-])c1 ZINC000481832274 1039852344 /nfs/dbraw/zinc/85/23/44/1039852344.db2.gz STUPLZABFVKIHX-INIZCTEOSA-N -1 1 346.224 4.036 20 0 EIADMM COc1cc(C(=O)N2CC3(CCCC3)[C@H]2C(C)C)cc(Cl)c1[O-] ZINC000457157929 1039857748 /nfs/dbraw/zinc/85/77/48/1039857748.db2.gz FBZDRKMQBJIFEA-MRXNPFEDSA-N -1 1 337.847 4.095 20 0 EIADMM CCOc1cc(C(=O)NC(C2CCC2)C2CCC2)cc(Cl)c1[O-] ZINC000553284702 1040115069 /nfs/dbraw/zinc/11/50/69/1040115069.db2.gz BMJGGODMQDWGGO-UHFFFAOYSA-N -1 1 337.847 4.143 20 0 EIADMM [O-]c1ccc(-c2noc(CCc3cccc(F)c3F)n2)c(Cl)c1 ZINC000445450300 1040179997 /nfs/dbraw/zinc/17/99/97/1040179997.db2.gz XRZXTLOUEDCFGJ-UHFFFAOYSA-N -1 1 336.725 4.159 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccnc(-c3ccccc3)c2)cc1C ZINC000479250933 1040224641 /nfs/dbraw/zinc/22/46/41/1040224641.db2.gz UTNJMCQBIVFJBY-UHFFFAOYSA-N -1 1 338.432 4.166 20 0 EIADMM CC[C@@H](CNC(=O)c1ccc(Br)c([O-])c1)c1ccccc1 ZINC000479532621 1040457773 /nfs/dbraw/zinc/45/77/73/1040457773.db2.gz XPBFODPOPSUEHG-LBPRGKRZSA-N -1 1 348.240 4.078 20 0 EIADMM Nc1ccc(F)c(Nc2cc(Br)cc(Cl)c2[O-])c1 ZINC001211841487 1040465389 /nfs/dbraw/zinc/46/53/89/1040465389.db2.gz FHKLQBAZVDVDSO-UHFFFAOYSA-N -1 1 331.572 4.273 20 0 EIADMM CC[C@H](C)c1ccc(S(=O)(=O)[N-]c2c(F)cccc2OC)cc1 ZINC000479558889 1040468682 /nfs/dbraw/zinc/46/86/82/1040468682.db2.gz XXJHENQEFUVKFT-LBPRGKRZSA-N -1 1 337.416 4.149 20 0 EIADMM CSc1ccc(S(=O)(=O)[N-]c2cc(F)cc(Cl)c2)cc1 ZINC000477408523 1040475342 /nfs/dbraw/zinc/47/53/42/1040475342.db2.gz YBKUWPNVDMBCNE-UHFFFAOYSA-N -1 1 331.821 4.002 20 0 EIADMM Cc1coc(-c2cc(NC(=O)c3cc(F)ccc3[O-])ccc2C)n1 ZINC000160505520 1040569367 /nfs/dbraw/zinc/56/93/67/1040569367.db2.gz XNVONIGGQXLEEB-UHFFFAOYSA-N -1 1 326.327 4.055 20 0 EIADMM CC(F)(F)c1cccc([N-]S(=O)(=O)c2cccc(Cl)c2)c1 ZINC000436182864 1040950054 /nfs/dbraw/zinc/95/00/54/1040950054.db2.gz QUYMEXXMVOBPLX-UHFFFAOYSA-N -1 1 331.771 4.253 20 0 EIADMM CCc1cc(=O)[n-]c(SCCOc2c(Cl)cccc2Cl)n1 ZINC000436192472 1040962389 /nfs/dbraw/zinc/96/23/89/1040962389.db2.gz CRWNFDAQWYCUFR-UHFFFAOYSA-N -1 1 345.251 4.223 20 0 EIADMM Cc1nc(-c2ccc(N[C@H]3CCC[C@@H](C(C)C)C3)nc2)[n-]c(=O)c1C ZINC000462828813 1040983885 /nfs/dbraw/zinc/98/38/85/1040983885.db2.gz QPQLWQDCHBYXFF-WBVHZDCISA-N -1 1 340.471 4.488 20 0 EIADMM CCC[C@@H](C)C[C@H](NCc1ccc(-c2ccc(F)cc2)o1)C(=O)[O-] ZINC000904002849 1041249360 /nfs/dbraw/zinc/24/93/60/1041249360.db2.gz FTHLBEWLNBALKR-DYVFJYSZSA-N -1 1 333.403 4.455 20 0 EIADMM Cc1cc(C)c(/C=C\CN[C@@H](C)c2nc(C(=O)[O-])cs2)cc1C ZINC000904024382 1041271227 /nfs/dbraw/zinc/27/12/27/1041271227.db2.gz RKAIQOFSSXIRCJ-GXMNPTEKSA-N -1 1 330.453 4.131 20 0 EIADMM CC(C)(C)Oc1ccc(-c2nc(-c3ccc([O-])cc3Cl)no2)nc1 ZINC000436521838 1041302398 /nfs/dbraw/zinc/30/23/98/1041302398.db2.gz PAGXYPONYURMII-UHFFFAOYSA-N -1 1 345.786 4.335 20 0 EIADMM COc1cccc2c1[C@H](c1nc(-c3ccc([O-])cc3Cl)no1)CC2 ZINC000436522897 1041304392 /nfs/dbraw/zinc/30/43/92/1041304392.db2.gz YCQXNDYDGHPFRP-CYBMUJFWSA-N -1 1 342.782 4.182 20 0 EIADMM CCOc1cc(NC(=O)c2cc3ccccc3cc2[O-])ccc1OC ZINC000436522465 1041305010 /nfs/dbraw/zinc/30/50/10/1041305010.db2.gz UYMATBQCRJRAMV-UHFFFAOYSA-N -1 1 337.375 4.205 20 0 EIADMM CCOc1cc(-c2nc(Cc3ccccc3C)no2)cc(Cl)c1[O-] ZINC000436516085 1041319574 /nfs/dbraw/zinc/31/95/74/1041319574.db2.gz UPMRAEUTBYFIFG-UHFFFAOYSA-N -1 1 344.798 4.394 20 0 EIADMM O=C(Nc1ccc(-c2cncnc2)cc1)c1ccc2ccccc2c1[O-] ZINC000436538611 1041330036 /nfs/dbraw/zinc/33/00/36/1041330036.db2.gz RFGONSPUSWQVMF-UHFFFAOYSA-N -1 1 341.370 4.255 20 0 EIADMM CCC(CC)c1cc(CNC(=O)c2ccc3ccccc3c2[O-])on1 ZINC000436557917 1041331078 /nfs/dbraw/zinc/33/10/78/1041331078.db2.gz YNPGYYIMCRCYJV-UHFFFAOYSA-N -1 1 338.407 4.367 20 0 EIADMM CC(C)(C)C[C@@H]1CCCN1C(=O)c1ccc(Br)cc1[O-] ZINC000436539896 1041333495 /nfs/dbraw/zinc/33/34/95/1041333495.db2.gz QBUIHDKVDOPXEA-LBPRGKRZSA-N -1 1 340.261 4.196 20 0 EIADMM C[C@@H](c1ccc(Cl)cc1)[C@H](C)N(C)C(=O)c1cc(F)ccc1[O-] ZINC000436573106 1041351276 /nfs/dbraw/zinc/35/12/76/1041351276.db2.gz GZWBCOSXEQWLAE-NEPJUHHUSA-N -1 1 335.806 4.449 20 0 EIADMM C[C@H]1[C@H](Cc2ccccc2)CCN1C(=O)c1cc(Cl)ccc1[O-] ZINC000436574226 1041351840 /nfs/dbraw/zinc/35/18/40/1041351840.db2.gz JOBRQRJSQNRCPG-ZFWWWQNUSA-N -1 1 329.827 4.139 20 0 EIADMM CN(C(=O)c1cc(F)ccc1[O-])C1c2ccccc2-c2ccccc21 ZINC000436574831 1041352885 /nfs/dbraw/zinc/35/28/85/1041352885.db2.gz MQOYNLTYWXAOHN-UHFFFAOYSA-N -1 1 333.362 4.373 20 0 EIADMM O=C(Nc1c[nH]nc1-c1ccccc1)c1ccc2ccccc2c1[O-] ZINC000436609343 1041370558 /nfs/dbraw/zinc/37/05/58/1041370558.db2.gz WFSYDFDMWNGSDF-UHFFFAOYSA-N -1 1 329.359 4.188 20 0 EIADMM O=C(c1cc(F)ccc1[O-])N1CCCC[C@@H]1CCc1ccccc1 ZINC000436609817 1041370895 /nfs/dbraw/zinc/37/08/95/1041370895.db2.gz WMHVGDCQZKNBMX-QGZVFWFLSA-N -1 1 327.399 4.159 20 0 EIADMM C[C@H]([C@@H]1Cc2ccccc2O1)N(C)C(=O)c1cc2ccccc2cc1[O-] ZINC000436609217 1041371062 /nfs/dbraw/zinc/37/10/62/1041371062.db2.gz VRHAVKUAADJBFI-SZNDQCEHSA-N -1 1 347.414 4.010 20 0 EIADMM CCOc1ccc(NC(=O)c2ccc(C(C)C)cc2[O-])cc1OC ZINC000436655385 1041397262 /nfs/dbraw/zinc/39/72/62/1041397262.db2.gz LRJYUCCRMZAGQA-UHFFFAOYSA-N -1 1 329.396 4.175 20 0 EIADMM C[C@@H](C1CCCCC1)N(C)C(=O)c1ccc(Br)cc1[O-] ZINC000436679677 1041419462 /nfs/dbraw/zinc/41/94/62/1041419462.db2.gz HHTUVRKXBYAAEM-NSHDSACASA-N -1 1 340.261 4.196 20 0 EIADMM Cc1c(Br)cccc1-c1noc(-c2cc(F)ccc2[O-])n1 ZINC000436689362 1041423254 /nfs/dbraw/zinc/42/32/54/1041423254.db2.gz QUGJYJVGOLQWRF-UHFFFAOYSA-N -1 1 349.159 4.319 20 0 EIADMM [O-]c1ccc(-c2nc(-c3ccccc3OC(F)(F)F)no2)c(F)c1 ZINC000436691101 1041425759 /nfs/dbraw/zinc/42/57/59/1041425759.db2.gz RWAUSFLBBPOSRD-UHFFFAOYSA-N -1 1 340.232 4.147 20 0 EIADMM COc1cc(F)c(F)cc1NC(=O)c1cc2ccccc2cc1[O-] ZINC000436695034 1041428133 /nfs/dbraw/zinc/42/81/33/1041428133.db2.gz CXLUNGQTACDAEX-UHFFFAOYSA-N -1 1 329.302 4.085 20 0 EIADMM CN(Cc1ccccc1C(F)(F)F)C(=O)c1ccc(Cl)cc1[O-] ZINC000436724002 1041444243 /nfs/dbraw/zinc/44/42/43/1041444243.db2.gz QDOGPODLHNIKFZ-UHFFFAOYSA-N -1 1 343.732 4.337 20 0 EIADMM C[C@@H](c1ccc(F)c(F)c1)N(C)C(=O)c1ccc(Cl)cc1[O-] ZINC000436724706 1041444944 /nfs/dbraw/zinc/44/49/44/1041444944.db2.gz TYSGAXYMQMWTRJ-VIFPVBQESA-N -1 1 325.742 4.157 20 0 EIADMM CCN(CCc1cccs1)C(=O)c1ccc2ccccc2c1[O-] ZINC000436735587 1041446142 /nfs/dbraw/zinc/44/61/42/1041446142.db2.gz DLDASJSBDXYLMH-UHFFFAOYSA-N -1 1 325.433 4.312 20 0 EIADMM CC1(C)CN(C(=O)c2ccc(C(F)(F)F)cc2[O-])[C@H]2CCC[C@@H]21 ZINC000436738642 1041448899 /nfs/dbraw/zinc/44/88/99/1041448899.db2.gz UAWPPYFYTKOQRE-STQMWFEESA-N -1 1 327.346 4.062 20 0 EIADMM CCc1cc(=O)[n-]c(S[C@H](c2ccccc2)c2ccc(F)cc2)n1 ZINC000195058155 1041453702 /nfs/dbraw/zinc/45/37/02/1041453702.db2.gz IVLICIHWWHHKHZ-GOSISDBHSA-N -1 1 340.423 4.353 20 0 EIADMM C[C@H](Oc1ccccc1NC(=O)c1cc(F)ccc1[O-])C(F)(F)F ZINC000436746987 1041459925 /nfs/dbraw/zinc/45/99/25/1041459925.db2.gz JFSIYIATAOMEDQ-VIFPVBQESA-N -1 1 343.276 4.113 20 0 EIADMM O=C(c1ccc(C(F)(F)F)cc1[O-])N1CCC[C@H]2CCCC[C@H]21 ZINC000436763088 1041460134 /nfs/dbraw/zinc/46/01/34/1041460134.db2.gz ISNKVFXMIMRWEL-BXUZGUMPSA-N -1 1 327.346 4.206 20 0 EIADMM Cc1ccccc1[C@H]1CCN(C(=O)c2ccc(C(F)(F)F)cc2[O-])C1 ZINC000436763061 1041460429 /nfs/dbraw/zinc/46/04/29/1041460429.db2.gz IHHZZPCHPWLZJQ-ZDUSSCGKSA-N -1 1 349.352 4.349 20 0 EIADMM C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)c1cc(Cl)ccc1[O-] ZINC000436749602 1041461788 /nfs/dbraw/zinc/46/17/88/1041461788.db2.gz KLRIWJIGPPNREE-UKRRQHHQSA-N -1 1 329.827 4.454 20 0 EIADMM C[C@@]1(c2ccccc2)CCN(C(=O)c2ccc(C(F)(F)F)cc2[O-])C1 ZINC000436749442 1041463889 /nfs/dbraw/zinc/46/38/89/1041463889.db2.gz AXRQKLTVNCDCCF-GOSISDBHSA-N -1 1 349.352 4.215 20 0 EIADMM O=C([O-])c1cc(/C=C/c2cc(F)c(O)c(F)c2)nc2ccccc21 ZINC000436778575 1041472674 /nfs/dbraw/zinc/47/26/74/1041472674.db2.gz RJJIAKBHXZLVNH-AATRIKPKSA-N -1 1 327.286 4.087 20 0 EIADMM CN(C(=O)c1ccc(C(F)(F)F)cc1[O-])[C@@H]1CCc2ccccc21 ZINC000436765793 1041474078 /nfs/dbraw/zinc/47/40/78/1041474078.db2.gz YVFBZVMUXUYSCS-OAHLLOKOSA-N -1 1 335.325 4.171 20 0 EIADMM O=C(Nc1c[nH]nc1-c1ccccc1)c1ccc(C(F)(F)F)cc1[O-] ZINC000436768357 1041477043 /nfs/dbraw/zinc/47/70/43/1041477043.db2.gz IYVOULRKZOFXFI-UHFFFAOYSA-N -1 1 347.296 4.053 20 0 EIADMM COCc1ccccc1S(=O)(=O)[N-]c1ccccc1CCC(C)C ZINC000538705892 1041482808 /nfs/dbraw/zinc/48/28/08/1041482808.db2.gz CQLBJZBQAOHNRJ-UHFFFAOYSA-N -1 1 347.480 4.222 20 0 EIADMM CC[C@H](C)[C@@H](C)N(C(=O)c1ccc(C(F)(F)F)cc1[O-])C1CC1 ZINC000436819076 1041487149 /nfs/dbraw/zinc/48/71/49/1041487149.db2.gz MOSVTGWQDDEACC-WDEREUQCSA-N -1 1 329.362 4.450 20 0 EIADMM O=C(Nc1nc(-c2ccc[nH]2)cs1)c1ccc2ccccc2c1[O-] ZINC000436830458 1041496661 /nfs/dbraw/zinc/49/66/61/1041496661.db2.gz DHAMIMRCYHGPCS-UHFFFAOYSA-N -1 1 335.388 4.249 20 0 EIADMM O=C(c1cc(F)ccc1[O-])N1CCC([C@@H](F)c2ccccc2F)CC1 ZINC000436836316 1041498031 /nfs/dbraw/zinc/49/80/31/1041498031.db2.gz CSEMOHJUHFAVKB-GOSISDBHSA-N -1 1 349.352 4.233 20 0 EIADMM COc1ccc(CCCN(C)C(=O)c2cc3ccccc3cc2[O-])cc1 ZINC000436820799 1041501888 /nfs/dbraw/zinc/50/18/88/1041501888.db2.gz SGHWQYUBNWMWTJ-UHFFFAOYSA-N -1 1 349.430 4.259 20 0 EIADMM COc1c(F)cc(NC(=O)c2ccc3ccccc3c2[O-])cc1F ZINC000436823987 1041503818 /nfs/dbraw/zinc/50/38/18/1041503818.db2.gz DZPAVVCOUSAHJP-UHFFFAOYSA-N -1 1 329.302 4.085 20 0 EIADMM O=C(NCC1(c2ccc(F)cc2)CCCC1)c1c(F)ccc([O-])c1F ZINC000540514099 1041509025 /nfs/dbraw/zinc/50/90/25/1041509025.db2.gz UYGABZDTWBKHJS-UHFFFAOYSA-N -1 1 349.352 4.051 20 0 EIADMM CC1(C)CN(C(=O)c2cc3ccccc3cc2[O-])[C@@H]1c1cccnc1 ZINC000436840148 1041510341 /nfs/dbraw/zinc/51/03/41/1041510341.db2.gz WFMYPFBQZNSZBQ-LJQANCHMSA-N -1 1 332.403 4.164 20 0 EIADMM CC[C@@H](c1ccccc1OC)N(C)C(=O)c1ccc(Cl)cc1[O-] ZINC000436847331 1041514949 /nfs/dbraw/zinc/51/49/49/1041514949.db2.gz JQKDWVSGNXGPSR-HNNXBMFYSA-N -1 1 333.815 4.278 20 0 EIADMM CN(C(=O)c1ccc([O-])cc1F)C1c2ccccc2-c2ccccc21 ZINC000436868133 1041526410 /nfs/dbraw/zinc/52/64/10/1041526410.db2.gz GMMNPLPWFGCKLP-UHFFFAOYSA-N -1 1 333.362 4.373 20 0 EIADMM C[C@@H](Cn1ccc2ccccc21)c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000436870817 1041529485 /nfs/dbraw/zinc/52/94/85/1041529485.db2.gz GCCOTOUYPYMKSB-LBPRGKRZSA-N -1 1 337.354 4.340 20 0 EIADMM C[C@@H](NC(=O)c1cc(F)ccc1[O-])c1ccc(-c2cccnc2)cc1 ZINC000436870899 1041529926 /nfs/dbraw/zinc/52/99/26/1041529926.db2.gz RDCGIEGDBOKVSS-CYBMUJFWSA-N -1 1 336.366 4.084 20 0 EIADMM [O-]c1ccc(-c2noc(Cc3cnc4ccccc4c3)n2)c(Cl)c1 ZINC000436875941 1041533121 /nfs/dbraw/zinc/53/31/21/1041533121.db2.gz ZIIHBTJFJJSUFK-UHFFFAOYSA-N -1 1 337.766 4.235 20 0 EIADMM C[C@]1(c2ccccc2)CCCN(C(=O)c2cc(F)ccc2[O-])CC1 ZINC000436858574 1041534438 /nfs/dbraw/zinc/53/44/38/1041534438.db2.gz OUDJLINEDWNLSA-FQEVSTJZSA-N -1 1 327.399 4.115 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cnccc3Oc3ccccc3)n2)c(F)c1 ZINC000436876552 1041535604 /nfs/dbraw/zinc/53/56/04/1041535604.db2.gz ZZMBMCSSEYTPMX-UHFFFAOYSA-N -1 1 349.321 4.436 20 0 EIADMM CCOc1cc(-c2noc([C@H](OC)[C@@H](C)CC)n2)cc(Cl)c1[O-] ZINC000436876378 1041535666 /nfs/dbraw/zinc/53/56/66/1041535666.db2.gz IDMOKTMYNOVNBZ-LKFCYVNXSA-N -1 1 340.807 4.228 20 0 EIADMM Cc1ccc(-c2ocnc2-c2nc(-c3ccc([O-])c(F)c3)no2)cc1 ZINC000436877904 1041536153 /nfs/dbraw/zinc/53/61/53/1041536153.db2.gz IJIRPXOAFRCNLG-UHFFFAOYSA-N -1 1 337.310 4.212 20 0 EIADMM [O-]c1ccc(-c2noc([C@@H]3C[C@@H]3c3ccc(F)cc3F)n2)cc1F ZINC000436877484 1041537843 /nfs/dbraw/zinc/53/78/43/1041537843.db2.gz GOYHEGCDKAHCMC-VXGBXAGGSA-N -1 1 332.281 4.131 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cscc3Br)n2)cc1F ZINC000436881185 1041538015 /nfs/dbraw/zinc/53/80/15/1041538015.db2.gz WDFUPZYWEUAXGS-UHFFFAOYSA-N -1 1 341.161 4.072 20 0 EIADMM COCc1cccc(-c2noc(-c3ccc4ccccc4c3[O-])n2)c1 ZINC000436908186 1041549073 /nfs/dbraw/zinc/54/90/73/1041549073.db2.gz IEBXOKQEXJDHNB-UHFFFAOYSA-N -1 1 332.359 4.409 20 0 EIADMM Cc1nc(-c2ccccc2NC(=O)c2cc(F)ccc2[O-])cs1 ZINC000436899856 1041552871 /nfs/dbraw/zinc/55/28/71/1041552871.db2.gz GCWKZAXUOKWWGF-UHFFFAOYSA-N -1 1 328.368 4.216 20 0 EIADMM CC(=O)Nc1ccc([O-])c(-c2nc(-c3cc(Cl)ccc3C)no2)c1 ZINC000436939693 1041567173 /nfs/dbraw/zinc/56/71/73/1041567173.db2.gz PVUSFVBGHPAFGR-UHFFFAOYSA-N -1 1 343.770 4.029 20 0 EIADMM CCCc1ccccc1[N-]S(=O)(=O)c1ccc(F)c2ncccc12 ZINC000032595507 1041574635 /nfs/dbraw/zinc/57/46/35/1041574635.db2.gz ZYQLLPIGGJSSRS-UHFFFAOYSA-N -1 1 344.411 4.127 20 0 EIADMM O=C(NCc1cccc(OC(F)F)c1)c1ccc2ccccc2c1[O-] ZINC000436984155 1041579482 /nfs/dbraw/zinc/57/94/82/1041579482.db2.gz LVIOPAWNDSZVTJ-UHFFFAOYSA-N -1 1 343.329 4.077 20 0 EIADMM COc1ccc(-c2nc(-c3ccccc3C(F)(F)F)no2)c([O-])c1 ZINC000437003392 1041587999 /nfs/dbraw/zinc/58/79/99/1041587999.db2.gz SZHWIAWHYDNRIR-UHFFFAOYSA-N -1 1 336.269 4.137 20 0 EIADMM COc1ccc(OC)c(-c2noc(-c3ccc4ccccc4c3[O-])n2)c1 ZINC000437001974 1041595702 /nfs/dbraw/zinc/59/57/02/1041595702.db2.gz RSWVKNMFIZTURH-UHFFFAOYSA-N -1 1 348.358 4.280 20 0 EIADMM CCCCN(C(=O)C(=O)c1ccc([O-])cc1)[C@@H](CC)c1ccccc1 ZINC000437002169 1041595774 /nfs/dbraw/zinc/59/57/74/1041595774.db2.gz PNKWVIQDVJNGBZ-IBGZPJMESA-N -1 1 339.435 4.355 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1ncsc1-c1ccccc1 ZINC000438139016 1042061068 /nfs/dbraw/zinc/06/10/68/1042061068.db2.gz CAEPZOCFKSLNSN-UHFFFAOYSA-N -1 1 330.796 4.421 20 0 EIADMM CSc1ccc([N-]S(=O)(=O)c2ccc(C(=O)C(C)C)cc2)cc1 ZINC000438797949 1042349098 /nfs/dbraw/zinc/34/90/98/1042349098.db2.gz VXHMVSZLHZPKQR-UHFFFAOYSA-N -1 1 349.477 4.048 20 0 EIADMM Cc1c(F)cccc1S(=O)(=O)[N-]c1cccc(OC2CCCC2)c1 ZINC000438809722 1042358588 /nfs/dbraw/zinc/35/85/88/1042358588.db2.gz MFVDUWNSLQUCKG-UHFFFAOYSA-N -1 1 349.427 4.256 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccccc2CC(F)(F)F)cc1F ZINC000172901195 1042511386 /nfs/dbraw/zinc/51/13/86/1042511386.db2.gz CUXGFPUVWQUSBZ-UHFFFAOYSA-N -1 1 347.333 4.040 20 0 EIADMM CC(C)CC[C@H]1CCCN1C(=O)c1ccc(Br)c([O-])c1 ZINC000491992882 1042528695 /nfs/dbraw/zinc/52/86/95/1042528695.db2.gz AZOCBHMBVDLBEO-CYBMUJFWSA-N -1 1 340.261 4.196 20 0 EIADMM O=S(=O)([N-]c1ccc(OCc2ccccc2)cc1)c1ccsc1 ZINC000506580762 1042632488 /nfs/dbraw/zinc/63/24/88/1042632488.db2.gz URTCXWQZVASOGU-UHFFFAOYSA-N -1 1 345.445 4.128 20 0 EIADMM CC1(C)CC(C(=O)Nc2c([O-])cc(Br)cc2Cl)C1 ZINC000518774695 1042680006 /nfs/dbraw/zinc/68/00/06/1042680006.db2.gz BSGUALUCOYVQBY-UHFFFAOYSA-N -1 1 332.625 4.183 20 0 EIADMM COc1ccc(S(=O)(=O)[N-]c2cccc(C(F)F)c2)cc1Cl ZINC000509610625 1042689785 /nfs/dbraw/zinc/68/97/85/1042689785.db2.gz LFOPXUKHNXBORR-UHFFFAOYSA-N -1 1 347.770 4.087 20 0 EIADMM COc1csc(C(=O)[N-]c2nc(Sc3ccccc3)ns2)c1 ZINC000176788979 1042819068 /nfs/dbraw/zinc/81/90/68/1042819068.db2.gz XIJITVUUZCKMDN-UHFFFAOYSA-N -1 1 349.462 4.012 20 0 EIADMM COc1cc(C(=O)N2CC[C@H](C(C)(C)C)C[C@H]2C)cc(Cl)c1[O-] ZINC000493179469 1042837107 /nfs/dbraw/zinc/83/71/07/1042837107.db2.gz HQFKTWKADIEOHH-YPMHNXCESA-N -1 1 339.863 4.341 20 0 EIADMM CC1(C)CN(C(=O)c2ccc(Cl)cc2[O-])CC[C@H]1C(F)(F)F ZINC000190645086 1042873879 /nfs/dbraw/zinc/87/38/79/1042873879.db2.gz SGQCCAUAIHBPSU-GFCCVEGCSA-N -1 1 335.753 4.096 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccccc2N2CCCCC2)c(C)c1 ZINC000007056732 1042918423 /nfs/dbraw/zinc/91/84/23/1042918423.db2.gz GCZBVMMRCYNLOB-UHFFFAOYSA-N -1 1 344.480 4.095 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2cccc(OC3CCCC3)c2)ccc1F ZINC000520638704 1042962116 /nfs/dbraw/zinc/96/21/16/1042962116.db2.gz UVQSYNPWZIVWMJ-UHFFFAOYSA-N -1 1 349.427 4.256 20 0 EIADMM CCCc1ccc(S(=O)(=O)[N-]c2cccc(COC(C)C)c2)cc1 ZINC000063849430 1043056449 /nfs/dbraw/zinc/05/64/49/1043056449.db2.gz OEEXGIFEGYQAEX-UHFFFAOYSA-N -1 1 347.480 4.365 20 0 EIADMM Cc1ccc(C)c(S(=O)(=O)[N-]c2cccc(COC(C)C)c2)c1 ZINC000063849382 1043057603 /nfs/dbraw/zinc/05/76/03/1043057603.db2.gz FXVMDIGAQNMFNM-UHFFFAOYSA-N -1 1 333.453 4.029 20 0 EIADMM Cc1ccc2ncccc2c1S(=O)(=O)[N-]c1ccc(Cl)cc1C ZINC000673983415 1043234285 /nfs/dbraw/zinc/23/42/85/1043234285.db2.gz VBRVFGFRYLAMAP-UHFFFAOYSA-N -1 1 346.839 4.306 20 0 EIADMM [O-]c1cccnc1-c1nc(-c2ccc(Cl)c(C(F)(F)F)c2)no1 ZINC001212481044 1043436318 /nfs/dbraw/zinc/43/63/18/1043436318.db2.gz XKWDXZOGOAJQPQ-UHFFFAOYSA-N -1 1 341.676 4.176 20 0 EIADMM Cc1ccccc1C1CCN(C(=O)c2c([O-])cccc2Cl)CC1 ZINC000730285811 1043488968 /nfs/dbraw/zinc/48/89/68/1043488968.db2.gz JXMWJTAKWLCKID-UHFFFAOYSA-N -1 1 329.827 4.374 20 0 EIADMM Cc1cccc([N-]S(=O)(=O)c2ccc(CC(F)(F)F)cc2)c1C ZINC000189224011 1043489189 /nfs/dbraw/zinc/48/91/89/1043489189.db2.gz ZBQANHZHGGFZKP-UHFFFAOYSA-N -1 1 343.370 4.209 20 0 EIADMM Cc1cc(Cl)ccc1C1=CCN(Cc2ccc(C(=O)[O-])o2)CC1 ZINC000530172735 1043631102 /nfs/dbraw/zinc/63/11/02/1043631102.db2.gz OWGAHGJRAQXZHA-UHFFFAOYSA-N -1 1 331.799 4.229 20 0 EIADMM COc1cc(C(=O)N2CCC[C@@H]2c2ccc(C)cc2)cc(Cl)c1[O-] ZINC000442859445 1043864209 /nfs/dbraw/zinc/86/42/09/1043864209.db2.gz ADCFQZRLJXASOK-MRXNPFEDSA-N -1 1 345.826 4.340 20 0 EIADMM CCN(C(=O)c1cc(Cl)c([O-])c(OC)c1)c1cccc(Cl)c1 ZINC000442858145 1043875686 /nfs/dbraw/zinc/87/56/86/1043875686.db2.gz OJTMUDJHYBFLRA-UHFFFAOYSA-N -1 1 340.206 4.374 20 0 EIADMM CCOc1cc(C(=O)N[C@@H]2CCCC(C)(C)C2)cc(Cl)c1[O-] ZINC000442927185 1043893463 /nfs/dbraw/zinc/89/34/63/1043893463.db2.gz ZBMBHICAAJHYMZ-GFCCVEGCSA-N -1 1 325.836 4.143 20 0 EIADMM O=C(c1c([O-])cccc1Cl)N1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000732301579 1043895138 /nfs/dbraw/zinc/89/51/38/1043895138.db2.gz XQPNKJBDLBSCPT-LBPRGKRZSA-N -1 1 336.218 4.329 20 0 EIADMM COc1cc(C(=O)N[C@@H](c2ccccc2C)C2CC2)cc(Cl)c1[O-] ZINC000442982557 1043949284 /nfs/dbraw/zinc/94/92/84/1043949284.db2.gz YAZMSCOPNRBABM-QGZVFWFLSA-N -1 1 345.826 4.244 20 0 EIADMM COc1cc(C(=O)N2CC[C@@H](c3ccccc3)[C@H]2C)cc(Cl)c1[O-] ZINC000443302009 1044164171 /nfs/dbraw/zinc/16/41/71/1044164171.db2.gz OCZSDARFNGTFBH-IUODEOHRSA-N -1 1 345.826 4.072 20 0 EIADMM Cc1csc(-c2cccc(S(=O)(=O)[N-]c3ccccc3C)c2)n1 ZINC000443399972 1044256719 /nfs/dbraw/zinc/25/67/19/1044256719.db2.gz OVDBVVKQSMRTIY-UHFFFAOYSA-N -1 1 344.461 4.228 20 0 EIADMM CCOc1cc(C(=O)N2c3ccccc3CC[C@@H]2C)cc(Cl)c1[O-] ZINC000675536070 1044372876 /nfs/dbraw/zinc/37/28/76/1044372876.db2.gz XFVYPPVLKBJFKQ-LBPRGKRZSA-N -1 1 345.826 4.426 20 0 EIADMM O=C(c1ncccc1[O-])N1CCCCC[C@@H]1Cc1ccccc1Cl ZINC000508426150 1044435973 /nfs/dbraw/zinc/43/59/73/1044435973.db2.gz FUYWZLNDTKLGCK-OAHLLOKOSA-N -1 1 344.842 4.068 20 0 EIADMM C[C@H](NC(=O)c1c([O-])cccc1Cl)c1nc2ccccc2s1 ZINC000734177377 1044510988 /nfs/dbraw/zinc/51/09/88/1044510988.db2.gz IBLRHFNXOMLYHJ-VIFPVBQESA-N -1 1 332.812 4.146 20 0 EIADMM COC[C@@H]([N-]c1nc(-c2ccccc2)no1)c1cccc(Cl)c1 ZINC000673521811 1044575204 /nfs/dbraw/zinc/57/52/04/1044575204.db2.gz SBSZFZNNEDGORC-OAHLLOKOSA-N -1 1 329.787 4.190 20 0 EIADMM C[C@@H](C(=O)Nc1ccc(F)cc1[O-])c1ccccc1C(F)(F)F ZINC000676056271 1044621099 /nfs/dbraw/zinc/62/10/99/1044621099.db2.gz XBYYLRZBLJXACQ-SECBINFHSA-N -1 1 327.277 4.292 20 0 EIADMM C[N@H+](Cc1nc(=O)c2sc(-c3ccc(F)cc3)cc2[n-]1)CC1CC1 ZINC000053184032 1044948921 /nfs/dbraw/zinc/94/89/21/1044948921.db2.gz BJXYWCQEWNRDAF-UHFFFAOYSA-N -1 1 343.427 4.045 20 0 EIADMM CSc1cccc(S(=O)(=O)[N-]c2ccc(F)c(C3CC3)c2)c1 ZINC000509391569 1045089832 /nfs/dbraw/zinc/08/98/32/1045089832.db2.gz ZMXMNLXIBBBSEW-UHFFFAOYSA-N -1 1 337.441 4.226 20 0 EIADMM Cc1oc(-c2cccs2)nc1CSc1nc(C2CC2)cc(=O)[n-]1 ZINC000470453961 1045428150 /nfs/dbraw/zinc/42/81/50/1045428150.db2.gz QUIZKBZSSZUSRL-UHFFFAOYSA-N -1 1 345.449 4.377 20 0 EIADMM COc1cc(C(=O)N(C)C2CCCCCCC2)cc(Cl)c1[O-] ZINC000153705629 1045454944 /nfs/dbraw/zinc/45/49/44/1045454944.db2.gz WNPPPJAROHHOFD-UHFFFAOYSA-N -1 1 325.836 4.239 20 0 EIADMM O=S(=O)([N-]c1ccc2c[nH]nc2c1)c1ccc(-c2ccccc2)cc1 ZINC000074934786 1045520273 /nfs/dbraw/zinc/52/02/73/1045520273.db2.gz RVLOJCXKLXYMDJ-UHFFFAOYSA-N -1 1 349.415 4.031 20 0 EIADMM O=C(Nc1ccccc1SC(F)(F)F)c1ccc([O-])c(F)c1 ZINC000767936538 1045684603 /nfs/dbraw/zinc/68/46/03/1045684603.db2.gz VHTSZCBPSJNMRA-UHFFFAOYSA-N -1 1 331.290 4.396 20 0 EIADMM O=c1nc(CN2CCCCC[C@@H]2c2ccccc2)[n-]c2ccsc21 ZINC000077195052 1045936641 /nfs/dbraw/zinc/93/66/41/1045936641.db2.gz BTEUIGLVGNTPSJ-MRXNPFEDSA-N -1 1 339.464 4.102 20 0 EIADMM CC(C)[C@H](NC(=O)c1c([O-])cccc1Cl)c1nc2ccccc2[nH]1 ZINC000769664331 1046040905 /nfs/dbraw/zinc/04/09/05/1046040905.db2.gz OFAJXTWOEDCMRR-INIZCTEOSA-N -1 1 343.814 4.049 20 0 EIADMM C[C@@H]1CO[C@H](c2ccccc2)[C@@H](C)N1C(=O)c1c([O-])cccc1Cl ZINC000769812886 1046079640 /nfs/dbraw/zinc/07/96/40/1046079640.db2.gz UJQODZKQSPJMEC-VFVRVIDISA-N -1 1 345.826 4.036 20 0 EIADMM CC[N@@H+](Cc1ccc(Cl)s1)Cc1cc(=O)oc2cc(O)ccc12 ZINC000916569802 1046089213 /nfs/dbraw/zinc/08/92/13/1046089213.db2.gz VPBVRIJRFMICBP-UHFFFAOYSA-N -1 1 349.839 4.236 20 0 EIADMM [O-]c1cccc(CNCc2ccccc2Br)c1Cl ZINC000328502038 1046137012 /nfs/dbraw/zinc/13/70/12/1046137012.db2.gz XURNPAOQVWAMKM-UHFFFAOYSA-N -1 1 326.621 4.098 20 0 EIADMM CC(C)c1ccc(-c2nc(CN(C)C[C@H](C)C(=O)[O-])cs2)cc1 ZINC000263300780 1046269613 /nfs/dbraw/zinc/26/96/13/1046269613.db2.gz GNNYXSOIYTXZKI-ZDUSSCGKSA-N -1 1 332.469 4.086 20 0 EIADMM CC(C)(C)OC(=O)c1ccc(C(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000770850400 1046275357 /nfs/dbraw/zinc/27/53/57/1046275357.db2.gz ARDJZCFTKBCMFS-UHFFFAOYSA-N -1 1 347.798 4.253 20 0 EIADMM [O-]c1c(-c2nc(Cc3ccc4c[nH]nc4c3)no2)ccc2ccccc21 ZINC000771478839 1046411539 /nfs/dbraw/zinc/41/15/39/1046411539.db2.gz VVZNQVCSDQCHRX-UHFFFAOYSA-N -1 1 342.358 4.063 20 0 EIADMM CCC(=O)c1cccc(S(=O)(=O)[N-]c2c(C)cc(C)cc2C)c1 ZINC000126122623 1046441045 /nfs/dbraw/zinc/44/10/45/1046441045.db2.gz URHLXCKVGNTPSP-UHFFFAOYSA-N -1 1 331.437 4.005 20 0 EIADMM CCOc1cc(-c2noc(-c3ccccc3C)n2)cc(Cl)c1[O-] ZINC000445409546 1046667809 /nfs/dbraw/zinc/66/78/09/1046667809.db2.gz BKCRNAFKONJFIY-UHFFFAOYSA-N -1 1 330.771 4.470 20 0 EIADMM Cc1cnc(-c2cccc([N-]S(=O)(=O)c3cccc(Cl)c3)c2)o1 ZINC000066814683 1046674367 /nfs/dbraw/zinc/67/43/67/1046674367.db2.gz NZZKSYNURBQQOI-UHFFFAOYSA-N -1 1 348.811 4.104 20 0 EIADMM COc1cccc(SC)c1[N-]C(=O)c1occc1Br ZINC001129979003 1046823504 /nfs/dbraw/zinc/82/35/04/1046823504.db2.gz FQDBMTATZSTHPN-UHFFFAOYSA-N -1 1 342.214 4.025 20 0 EIADMM COc1cc(C(=O)N[C@H](c2ccccc2)C2CCC2)cc(Cl)c1[O-] ZINC000460191901 1047172588 /nfs/dbraw/zinc/17/25/88/1047172588.db2.gz JDKCJHDTJJPSQS-QGZVFWFLSA-N -1 1 345.826 4.325 20 0 EIADMM COc1cc(C(=O)NC[C@H](c2ccccc2)C(C)C)cc(Cl)c1[O-] ZINC000460212782 1047191910 /nfs/dbraw/zinc/19/19/10/1047191910.db2.gz ORWOJODLTIOIPV-HNNXBMFYSA-N -1 1 347.842 4.224 20 0 EIADMM O=C([O-])CC[C@@H]1CCCCN1Cc1ccc(F)c(C(F)(F)F)c1 ZINC000322234284 1047281610 /nfs/dbraw/zinc/28/16/10/1047281610.db2.gz JPXSZQXNRMKIIJ-LBPRGKRZSA-N -1 1 333.325 4.064 20 0 EIADMM CCC(C)(C)c1ccc(S(=O)(=O)[N-]c2[nH]nc(C3CC3)c2C)cc1 ZINC000760320285 1047317232 /nfs/dbraw/zinc/31/72/32/1047317232.db2.gz PFTATIZNKHITQQ-UHFFFAOYSA-N -1 1 347.484 4.084 20 0 EIADMM Cc1onc(-c2ccccc2)c1C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000129546326 1047425936 /nfs/dbraw/zinc/42/59/36/1047425936.db2.gz XFHFPNKHAKSKDW-UHFFFAOYSA-N -1 1 328.755 4.261 20 0 EIADMM CCC1(CC)CCC(NC(=O)c2c(C)nc(C(C)C)[n-]c2=O)CC1 ZINC000789876458 1047479152 /nfs/dbraw/zinc/47/91/52/1047479152.db2.gz DAXIRRCYUPTPTE-UHFFFAOYSA-N -1 1 333.476 4.093 20 0 EIADMM Cc1nc(Cl)ccc1NC(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000790251131 1047543237 /nfs/dbraw/zinc/54/32/37/1047543237.db2.gz ZYFSPOZHKMNSFA-UHFFFAOYSA-N -1 1 330.693 4.020 20 0 EIADMM CC(C)c1cccc(S(=O)(=O)[N-]c2ccc3c(c2)OC(C)(C)O3)c1 ZINC000460421069 1047785977 /nfs/dbraw/zinc/78/59/77/1047785977.db2.gz BJVIDCYONAJKFG-UHFFFAOYSA-N -1 1 347.436 4.118 20 0 EIADMM CC(=O)Nc1cc(NC(=O)c2ccc3ccccc3c2[O-])ccc1C ZINC000131031615 1047821748 /nfs/dbraw/zinc/82/17/48/1047821748.db2.gz GZYVOBQJVNXHHM-UHFFFAOYSA-N -1 1 334.375 4.065 20 0 EIADMM C[C@H]1c2ccc(Cl)n2CCN1C(=O)c1ccc2ccccc2c1[O-] ZINC000808254006 1047849935 /nfs/dbraw/zinc/84/99/35/1047849935.db2.gz ASZOFFQHUPKIGA-LBPRGKRZSA-N -1 1 340.810 4.217 20 0 EIADMM Cc1[n-][nH]c(=O)c1NC(=O)C1(c2ccc(C(C)C)cc2)CCCCC1 ZINC000615229454 1047996675 /nfs/dbraw/zinc/99/66/75/1047996675.db2.gz SBHHPAYRQYOKEM-UHFFFAOYSA-N -1 1 341.455 4.388 20 0 EIADMM COc1ccccc1C[C@@H](C)N(C)C(=O)c1cc2ccccc2cc1[O-] ZINC000131957770 1048174004 /nfs/dbraw/zinc/17/40/04/1048174004.db2.gz OVJFWOHSUVMSOU-OAHLLOKOSA-N -1 1 349.430 4.257 20 0 EIADMM Cc1nc(-c2ccc([N-]S(=O)(=O)c3ccc(C)cc3)cc2)oc1C ZINC000919958140 1048344451 /nfs/dbraw/zinc/34/44/51/1048344451.db2.gz CFZJELPLCKEUFI-UHFFFAOYSA-N -1 1 342.420 4.068 20 0 EIADMM O=c1cc(C(F)F)nc(SCc2nc(Cl)ccc2Cl)[n-]1 ZINC000809986307 1048588705 /nfs/dbraw/zinc/58/87/05/1048588705.db2.gz DUDQDBBOCRXSNI-UHFFFAOYSA-N -1 1 338.166 4.114 20 0 EIADMM CSCCc1ccccc1NC(=O)c1cc(SC)ccc1[O-] ZINC001170593042 1048589011 /nfs/dbraw/zinc/58/90/11/1048589011.db2.gz WSIUVFNHLKKPBY-UHFFFAOYSA-N -1 1 333.478 4.272 20 0 EIADMM CC(=Cc1ccc(C)cc1)C(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC000810111720 1048632436 /nfs/dbraw/zinc/63/24/36/1048632436.db2.gz UBSXFTOALJNFRG-KAMYIIQDSA-N -1 1 333.391 4.133 20 0 EIADMM O=C(N[C@H]1CCSc2ccc(F)cc21)c1c([O-])cccc1Cl ZINC000920432369 1048678734 /nfs/dbraw/zinc/67/87/34/1048678734.db2.gz WDSLVCUXIVRRKZ-LBPRGKRZSA-N -1 1 337.803 4.152 20 0 EIADMM Cc1ccc(C2=CCN(C(=O)c3c([O-])cccc3Cl)CC2)cc1 ZINC000920432326 1048678772 /nfs/dbraw/zinc/67/87/72/1048678772.db2.gz SMIPLFXDUCVNME-UHFFFAOYSA-N -1 1 327.811 4.284 20 0 EIADMM CN(Cc1ccc(C(F)(F)F)cc1)Cc1c(F)cc([O-])cc1F ZINC001144558734 1048728044 /nfs/dbraw/zinc/72/80/44/1048728044.db2.gz BNCSZFBALLJYHV-UHFFFAOYSA-N -1 1 331.284 4.321 20 0 EIADMM [O-]c1cc(F)c(CN2CCC(c3ccc(F)cc3F)CC2)c(F)c1 ZINC001144567485 1048733325 /nfs/dbraw/zinc/73/33/25/1048733325.db2.gz NCTXLGNHYFPQKX-UHFFFAOYSA-N -1 1 339.332 4.328 20 0 EIADMM Cc1cnc(-c2nc(=O)c3c(-c4ccc(C)c(C)c4)csc3[n-]2)nc1 ZINC000133652100 1048754656 /nfs/dbraw/zinc/75/46/56/1048754656.db2.gz IAQMMTDFKWNNNH-UHFFFAOYSA-N -1 1 348.431 4.034 20 0 EIADMM [O-]c1cc(F)c(CN(Cc2ccccc2)Cc2ccccn2)cc1F ZINC001144648714 1048772234 /nfs/dbraw/zinc/77/22/34/1048772234.db2.gz WLXOUFMLOZWDFZ-UHFFFAOYSA-N -1 1 340.373 4.268 20 0 EIADMM [O-]c1cc(F)c(CN2CCSC[C@H]2c2ccc(F)cc2)cc1F ZINC001144657773 1048778829 /nfs/dbraw/zinc/77/88/29/1048778829.db2.gz HXDRAPGWUULZMZ-INIZCTEOSA-N -1 1 339.382 4.100 20 0 EIADMM Cc1ccc(O[C@H]2CCCN(Cc3cc(F)c([O-])cc3F)C2)cc1 ZINC001144667584 1048784339 /nfs/dbraw/zinc/78/43/39/1048784339.db2.gz WKJDWOOZDUCPMN-INIZCTEOSA-N -1 1 333.378 4.022 20 0 EIADMM COC(=O)c1cc(C(F)(F)F)ncc1-c1c(Cl)ccc([O-])c1F ZINC001244541369 1048797466 /nfs/dbraw/zinc/79/74/66/1048797466.db2.gz BCUROJRWFGXUOH-UHFFFAOYSA-N -1 1 349.667 4.052 20 0 EIADMM O=C([N-]Cc1ccccc1C(F)(F)F)C(F)(F)c1ccc(F)cc1 ZINC000920845819 1048803439 /nfs/dbraw/zinc/80/34/39/1048803439.db2.gz WDGNYOITADTYLW-UHFFFAOYSA-N -1 1 347.258 4.253 20 0 EIADMM CC(=O)Nc1ccc(OC(=O)c2cc3cc(Cl)sc3[n-]2)cc1 ZINC000810521785 1048805564 /nfs/dbraw/zinc/80/55/64/1048805564.db2.gz RNHVWDBHQRABCQ-UHFFFAOYSA-N -1 1 334.784 4.060 20 0 EIADMM CC[C@H](C)N(Cc1ccccc1)C(=O)Cc1ccc([O-])c(Cl)c1 ZINC001144752186 1048844200 /nfs/dbraw/zinc/84/42/00/1048844200.db2.gz HNSVXSYMKHUJBG-AWEZNQCLSA-N -1 1 331.843 4.415 20 0 EIADMM C[C@@H]1CCc2nc(NC(=O)c3ccc4ccccc4c3[O-])sc2C1 ZINC001135684467 1048857013 /nfs/dbraw/zinc/85/70/13/1048857013.db2.gz ZUGZGRVOCXPRLK-LLVKDONJSA-N -1 1 338.432 4.379 20 0 EIADMM COc1ccc(Cl)cc1NC(=O)c1ccc2ccc(O)cc2c1[O-] ZINC001135688978 1048859241 /nfs/dbraw/zinc/85/92/41/1048859241.db2.gz LPIKHENWWKRSQU-UHFFFAOYSA-N -1 1 343.766 4.165 20 0 EIADMM CCN(Cc1cccs1)Cc1cc(=O)oc2cc([O-])c(Cl)cc12 ZINC000921207836 1048873975 /nfs/dbraw/zinc/87/39/75/1048873975.db2.gz IBSLHVMNPBIESM-UHFFFAOYSA-N -1 1 349.839 4.236 20 0 EIADMM O=C(Nc1cc(F)c(F)cc1F)c1ccc(C(F)(F)F)c([O-])c1 ZINC001144870168 1048877259 /nfs/dbraw/zinc/87/72/59/1048877259.db2.gz KGCRXNICPPPZTD-UHFFFAOYSA-N -1 1 335.203 4.081 20 0 EIADMM O=C([N-][C@@H](CF)c1ccc(F)cc1)C(F)(F)c1ccc(Cl)cc1 ZINC001132555078 1048921442 /nfs/dbraw/zinc/92/14/42/1048921442.db2.gz MXZYQOSJTPIEBW-AWEZNQCLSA-N -1 1 345.723 4.398 20 0 EIADMM CCOc1cccc2cc([C@H](C)NC(=O)c3cc(F)ccc3[O-])oc21 ZINC001135846818 1048926346 /nfs/dbraw/zinc/92/63/46/1048926346.db2.gz YUFIXWULIXAZBF-NSHDSACASA-N -1 1 343.354 4.167 20 0 EIADMM O=C(Nc1ccc(-c2nc3ccccc3[nH]2)cc1)c1ccc(F)c([O-])c1 ZINC001170872306 1048994432 /nfs/dbraw/zinc/99/44/32/1048994432.db2.gz AIRHBKYHJIORRO-UHFFFAOYSA-N -1 1 347.349 4.327 20 0 EIADMM CC(C)Oc1ccccc1C(F)(F)C(=O)Nc1c([O-])cccc1F ZINC001146491459 1049031282 /nfs/dbraw/zinc/03/12/82/1049031282.db2.gz BPSKAKAAQSNBJW-UHFFFAOYSA-N -1 1 339.313 4.049 20 0 EIADMM CC(C)(NC(=O)c1ccc2ccc(O)cc2c1[O-])c1cccc(F)c1 ZINC001146587823 1049035372 /nfs/dbraw/zinc/03/53/72/1049035372.db2.gz CMEKNGHVMVRHDU-UHFFFAOYSA-N -1 1 339.366 4.055 20 0 EIADMM CC(C)(CCCc1ccccc1)CNC(=O)c1ccc(F)c([O-])c1 ZINC001146961975 1049076382 /nfs/dbraw/zinc/07/63/82/1049076382.db2.gz BYTQIJCWSSMDOU-UHFFFAOYSA-N -1 1 329.415 4.310 20 0 EIADMM C[C@H](NC(=O)c1ccc(F)c([O-])c1)c1cccc(Cl)c1Cl ZINC001147410530 1049147555 /nfs/dbraw/zinc/14/75/55/1049147555.db2.gz MBXRYKSTBLUPAV-QMMMGPOBSA-N -1 1 328.170 4.329 20 0 EIADMM CC(C)OCc1cc(NC(=O)c2ccc(C(C)C)cc2[O-])ccc1O ZINC000811596815 1049161111 /nfs/dbraw/zinc/16/11/11/1049161111.db2.gz WHJBLAOBSIUVFQ-UHFFFAOYSA-N -1 1 343.423 4.399 20 0 EIADMM Cc1ccc([C@H]2[C@@H](C)CCCN2C(=O)c2ccc([O-])c(F)c2)cc1 ZINC001147796242 1049217222 /nfs/dbraw/zinc/21/72/22/1049217222.db2.gz QXKRZSBMHGQQTN-IFXJQAMLSA-N -1 1 327.399 4.453 20 0 EIADMM C[C@H](CNC(=O)c1cc2ccccc2cc1[O-])c1ccc(F)cc1F ZINC001148048522 1049256409 /nfs/dbraw/zinc/25/64/09/1049256409.db2.gz VVJJONATNDJMJQ-GFCCVEGCSA-N -1 1 341.357 4.357 20 0 EIADMM Cc1ccc([C@H]2C[C@@H](C)CCN2C(=O)Cc2ccc([O-])c(Cl)c2)o1 ZINC001148223359 1049281402 /nfs/dbraw/zinc/28/14/02/1049281402.db2.gz DBJGGPXDJFBDNM-BLLLJJGKSA-N -1 1 347.842 4.489 20 0 EIADMM O=S(=O)(/C=C/c1cccc(Cl)c1)[N-]c1cc(C2CC2)ccn1 ZINC000811837884 1049289455 /nfs/dbraw/zinc/28/94/55/1049289455.db2.gz IPVOTKSKWJNQMS-VQHVLOKHSA-N -1 1 334.828 4.025 20 0 EIADMM O=S(=O)(/C=C\c1cccc(Cl)c1)[N-]c1cc(C2CC2)ccn1 ZINC000811837883 1049289685 /nfs/dbraw/zinc/28/96/85/1049289685.db2.gz IPVOTKSKWJNQMS-CLFYSBASSA-N -1 1 334.828 4.025 20 0 EIADMM O=C(Nc1cnn2cc(F)ccc12)c1cccc(-c2ccccc2)c1[O-] ZINC001148866586 1049390621 /nfs/dbraw/zinc/39/06/21/1049390621.db2.gz BNEROFXATNOHLB-UHFFFAOYSA-N -1 1 347.349 4.098 20 0 EIADMM O=S(=O)([N-]c1ccc2nc(C3CC3)oc2c1)c1cccc(Cl)c1 ZINC000080326550 1049577421 /nfs/dbraw/zinc/57/74/21/1049577421.db2.gz KXWVJMVCEPXDMI-UHFFFAOYSA-N -1 1 348.811 4.159 20 0 EIADMM Cc1ccc(F)c([N-]S(=O)(=O)c2csnc2-c2ccccc2)c1 ZINC000821124355 1049602149 /nfs/dbraw/zinc/60/21/49/1049602149.db2.gz UIGRWYCKWPBHKV-UHFFFAOYSA-N -1 1 348.424 4.058 20 0 EIADMM CC[C@@H](C)N(CCc1ccccc1F)C(=O)c1cccc([O-])c1F ZINC001136451327 1049647736 /nfs/dbraw/zinc/64/77/36/1049647736.db2.gz UEGZNZYMVMFCBG-CYBMUJFWSA-N -1 1 333.378 4.154 20 0 EIADMM O=C(Nc1cccc(F)c1[O-])c1cc(F)c(C(F)(F)F)cc1F ZINC001171638533 1049778798 /nfs/dbraw/zinc/77/87/98/1049778798.db2.gz XUVGSJDJHIFHPL-UHFFFAOYSA-N -1 1 335.203 4.081 20 0 EIADMM CC(C)c1nn(-c2ccccc2)cc1C(=O)Nc1cccc(F)c1[O-] ZINC001171638520 1049778853 /nfs/dbraw/zinc/77/88/53/1049778853.db2.gz XJQVTFZQEWXERA-UHFFFAOYSA-N -1 1 339.370 4.093 20 0 EIADMM Cc1cc(C(=O)[N-]c2c(C)noc2C(C)C)oc1Br ZINC000830199902 1049789118 /nfs/dbraw/zinc/78/91/18/1049789118.db2.gz OVJXALZOHYQPNJ-UHFFFAOYSA-N -1 1 327.178 4.023 20 0 EIADMM CC[C@H](c1cccc(OC)c1)N(C)C(=O)c1c([O-])cccc1Cl ZINC000813817995 1049819184 /nfs/dbraw/zinc/81/91/84/1049819184.db2.gz IRJOMAKICNLEPZ-OAHLLOKOSA-N -1 1 333.815 4.278 20 0 EIADMM C[C@@]1(Cc2ccc(F)c(F)c2)CCCN1C(=O)c1ccc([O-])c(F)c1 ZINC001171938518 1049830273 /nfs/dbraw/zinc/83/02/73/1049830273.db2.gz HKHKSWOQXSBINH-IBGZPJMESA-N -1 1 349.352 4.047 20 0 EIADMM CC(C)[C@@H]1CCC[C@H](NC(=O)c2cc(Br)ccc2[O-])C1 ZINC001136701880 1049839329 /nfs/dbraw/zinc/83/93/29/1049839329.db2.gz OSSOVKOVCRFPSX-YPMHNXCESA-N -1 1 340.261 4.099 20 0 EIADMM Cc1ccccc1[C@H](NC(=O)c1cncc([O-])c1)[C@H]1CCC[C@@H](C)C1 ZINC001136731655 1049856812 /nfs/dbraw/zinc/85/68/12/1049856812.db2.gz DEWOABJJNXZISF-PTSWNOGYSA-N -1 1 338.451 4.393 20 0 EIADMM O=C(c1ccc(F)c([O-])c1)N1CCCC[C@H]1c1cc2ccccc2[nH]1 ZINC001136733788 1049858384 /nfs/dbraw/zinc/85/83/84/1049858384.db2.gz GYASANIENLYGNK-SFHVURJKSA-N -1 1 338.382 4.380 20 0 EIADMM O=C(Nc1nc(/C=C\c2ccccc2)cs1)c1cccc([O-])c1F ZINC001136762874 1049868315 /nfs/dbraw/zinc/86/83/15/1049868315.db2.gz BQZQXQLNOVKBMY-KTKRTIGZSA-N -1 1 340.379 4.411 20 0 EIADMM CC(C)CCc1nnc([N-]C(=O)c2ncoc2-c2ccccc2)s1 ZINC000617096491 1049949494 /nfs/dbraw/zinc/94/94/94/1049949494.db2.gz WXUBVVBVHRRPOO-UHFFFAOYSA-N -1 1 342.424 4.034 20 0 EIADMM Cc1ncc(Nc2c(F)ccc([O-])c2Cl)cc1Br ZINC001250228400 1050229737 /nfs/dbraw/zinc/22/97/37/1050229737.db2.gz ADDWLHFTVJRWCL-UHFFFAOYSA-N -1 1 331.572 4.394 20 0 EIADMM [O-]c1ccc(F)c(Nc2nc(F)ccc2Br)c1Cl ZINC001250230080 1050239405 /nfs/dbraw/zinc/23/94/05/1050239405.db2.gz UMKPWEGFRCLEQV-UHFFFAOYSA-N -1 1 335.535 4.225 20 0 EIADMM CC(C)(NC(=O)c1ccc([O-])cc1F)c1ccc(C(F)(F)F)cc1 ZINC001186337895 1050301975 /nfs/dbraw/zinc/30/19/75/1050301975.db2.gz ZOBOSAGZDKVEEQ-UHFFFAOYSA-N -1 1 341.304 4.215 20 0 EIADMM [O-]c1c(F)cccc1NC(=S)Nc1ccc(C(F)(F)F)cc1 ZINC000169015577 1050396005 /nfs/dbraw/zinc/39/60/05/1050396005.db2.gz GWWUWIIPODYSRS-UHFFFAOYSA-N -1 1 330.306 4.359 20 0 EIADMM [O-]C(c1cccc(Nc2cccnc2)c1)(C(F)(F)F)C(F)(F)F ZINC001173857484 1050589132 /nfs/dbraw/zinc/58/91/32/1050589132.db2.gz PFPOJJHDBRGRJE-UHFFFAOYSA-N -1 1 336.235 4.137 20 0 EIADMM O=c1ccn(-c2ccc(NCc3ccc(-c4ccccc4)o3)cc2)[n-]1 ZINC001179308808 1050667373 /nfs/dbraw/zinc/66/73/73/1050667373.db2.gz TUYKPJMKGUXFCK-UHFFFAOYSA-N -1 1 331.375 4.450 20 0 EIADMM CC(C)(C(=O)Nc1cc(F)c([O-])cc1Cl)c1ccc(F)cc1 ZINC001179656832 1050738990 /nfs/dbraw/zinc/73/89/90/1050738990.db2.gz WVYGTXCACDXFPZ-UHFFFAOYSA-N -1 1 325.742 4.240 20 0 EIADMM Cc1ccc(Cl)cc1OCC(=O)Nc1cc(F)c([O-])cc1Cl ZINC001179660092 1050740154 /nfs/dbraw/zinc/74/01/54/1050740154.db2.gz LKNIOROYVRLMIA-UHFFFAOYSA-N -1 1 344.169 4.164 20 0 EIADMM O=C(Nc1cc(F)c([O-])cc1Cl)[C@@H]1C[C@H]1c1ccc(F)cc1F ZINC001179660152 1050740300 /nfs/dbraw/zinc/74/03/00/1050740300.db2.gz MVDUEHOHHJSKQR-VHSXEESVSA-N -1 1 341.716 4.205 20 0 EIADMM O=C(c1ccc(Nc2cc([O-])c(F)c(F)c2)cc1)N1CCCCC1 ZINC001174071323 1050743631 /nfs/dbraw/zinc/74/36/31/1050743631.db2.gz IULBWIPWMTVBTN-UHFFFAOYSA-N -1 1 332.350 4.040 20 0 EIADMM O=C(Cc1cc(F)cc(F)c1F)Nc1cccc(C(F)(F)F)c1[O-] ZINC001179843294 1050792504 /nfs/dbraw/zinc/79/25/04/1050792504.db2.gz GAQIYBVTVNJIRD-UHFFFAOYSA-N -1 1 349.230 4.010 20 0 EIADMM CC1CCN(C(=O)c2ccc(Nc3ccc(F)c(F)c3[O-])cc2)CC1 ZINC001174160494 1050801010 /nfs/dbraw/zinc/80/10/10/1050801010.db2.gz YZYRKDDPOLOUGV-UHFFFAOYSA-N -1 1 346.377 4.286 20 0 EIADMM Cc1ccc(Cl)cc1NC(=O)Nc1cc(=O)n(-c2ccccc2)[n-]1 ZINC001188702765 1050827232 /nfs/dbraw/zinc/82/72/32/1050827232.db2.gz NBPIIPADGIOPNC-UHFFFAOYSA-N -1 1 342.786 4.184 20 0 EIADMM COc1cc([C@H](C)NC(=O)c2ccc([O-])c(F)c2)cc2ccccc21 ZINC001179986358 1050842123 /nfs/dbraw/zinc/84/21/23/1050842123.db2.gz GLOUBCVLGAINPS-LBPRGKRZSA-N -1 1 339.366 4.184 20 0 EIADMM CC1CCN(C(=O)c2cccc(Nc3cc([O-])c(F)c(F)c3)c2)CC1 ZINC001174205810 1050842205 /nfs/dbraw/zinc/84/22/05/1050842205.db2.gz RHWUIMIZNDZYTP-UHFFFAOYSA-N -1 1 346.377 4.286 20 0 EIADMM O=S(=O)(CC1CC1)[N-]c1ccccc1Oc1ccc(Cl)cc1 ZINC001188963079 1050874167 /nfs/dbraw/zinc/87/41/67/1050874167.db2.gz DGEXREPAIUWWHU-UHFFFAOYSA-N -1 1 337.828 4.284 20 0 EIADMM O=C(Nc1cc(Cl)ncc1[O-])Nc1cc(Cl)ccc1Cl ZINC001188969427 1050875308 /nfs/dbraw/zinc/87/53/08/1050875308.db2.gz YPHZWPZERBWOSU-UHFFFAOYSA-N -1 1 332.574 4.391 20 0 EIADMM Cc1nc(SCc2csc(-c3ccc(F)cc3)n2)[n-]c(=O)c1C ZINC001189061256 1050898203 /nfs/dbraw/zinc/89/82/03/1050898203.db2.gz LYLWVQXSFYCBOV-UHFFFAOYSA-N -1 1 347.440 4.354 20 0 EIADMM CCOc1ccc(CCN(C)C(=O)c2ccc3ccccc3c2[O-])cc1 ZINC001180239755 1050931765 /nfs/dbraw/zinc/93/17/65/1050931765.db2.gz WYJCIFPOOYHTQG-UHFFFAOYSA-N -1 1 349.430 4.259 20 0 EIADMM O=C(NCc1ccccc1SC(F)(F)F)c1ccc([O-])cc1F ZINC001180238673 1050931838 /nfs/dbraw/zinc/93/18/38/1050931838.db2.gz JOZMZINVEHGDIH-UHFFFAOYSA-N -1 1 345.317 4.073 20 0 EIADMM CCCCc1ccccc1[N-]S(=O)(=O)c1cccc(C(C)=O)c1 ZINC001189232451 1050932067 /nfs/dbraw/zinc/93/20/67/1050932067.db2.gz MTFZEZQBIPNFIE-UHFFFAOYSA-N -1 1 331.437 4.033 20 0 EIADMM CC(=O)c1cccc(S(=O)(=O)[N-]c2cccc3cc(C)ccc32)c1 ZINC001189241764 1050936530 /nfs/dbraw/zinc/93/65/30/1050936530.db2.gz WXRKBEVXVJMTCT-UHFFFAOYSA-N -1 1 339.416 4.152 20 0 EIADMM O=C(Nc1ncccc1[O-])Nc1c(Cl)cccc1C(F)(F)F ZINC001189447177 1050995291 /nfs/dbraw/zinc/99/52/91/1050995291.db2.gz KOUCDZRABJUIJT-UHFFFAOYSA-N -1 1 331.681 4.103 20 0 EIADMM CCS(=O)(=O)c1ccc(Nc2ccc(Cl)c(Cl)c2[O-])cc1 ZINC001174465294 1051009930 /nfs/dbraw/zinc/00/99/30/1051009930.db2.gz MJMJOEJDHAOHSQ-UHFFFAOYSA-N -1 1 346.235 4.236 20 0 EIADMM O=S(=O)(Cc1cc(F)ccc1F)[N-]c1ccccc1-c1ccco1 ZINC001189696497 1051039285 /nfs/dbraw/zinc/03/92/85/1051039285.db2.gz DLSISBNEUFTDKI-UHFFFAOYSA-N -1 1 349.358 4.167 20 0 EIADMM COc1cc(Nc2cc(Cl)c(C)c(Cl)c2[O-])cnc1OC ZINC001174547747 1051078633 /nfs/dbraw/zinc/07/86/33/1051078633.db2.gz VDFZRSQSOLERRP-UHFFFAOYSA-N -1 1 329.183 4.163 20 0 EIADMM O=C(NCc1ccc(Cl)cc1Cl)Nc1c([O-])cccc1F ZINC001190093373 1051112196 /nfs/dbraw/zinc/11/21/96/1051112196.db2.gz MVFDCPQIIMOSBS-UHFFFAOYSA-N -1 1 329.158 4.160 20 0 EIADMM Cc1noc(-c2ccccc2)c1NC(=O)Nc1cc([O-])c(F)cc1F ZINC001190368894 1051170769 /nfs/dbraw/zinc/17/07/69/1051170769.db2.gz KJBAPGXHSIKTMS-UHFFFAOYSA-N -1 1 345.305 4.278 20 0 EIADMM Cc1noc(-c2ccccc2)c1NC(=O)Nc1cccc(F)c1[O-] ZINC001190369519 1051171248 /nfs/dbraw/zinc/17/12/48/1051171248.db2.gz WGSSMQLYCKDWAK-UHFFFAOYSA-N -1 1 327.315 4.139 20 0 EIADMM O=S(=O)([N-]c1cccc(COC2CCCCC2)c1)c1ccccc1 ZINC000620593450 1051175236 /nfs/dbraw/zinc/17/52/36/1051175236.db2.gz BNYOJDAIWZUQGM-UHFFFAOYSA-N -1 1 345.464 4.337 20 0 EIADMM CCC(C)(C)c1ccc(S(=O)(=O)[N-]c2cccc(O)c2C)cc1 ZINC001190448487 1051189476 /nfs/dbraw/zinc/18/94/76/1051189476.db2.gz SHNWYPSVRIMXTA-UHFFFAOYSA-N -1 1 333.453 4.189 20 0 EIADMM Cc1cncc2cccc([N-]S(=O)(=O)c3ccc(C4CC4)cc3)c12 ZINC001190499748 1051193915 /nfs/dbraw/zinc/19/39/15/1051193915.db2.gz GSMAKNPWKKIYQC-UHFFFAOYSA-N -1 1 338.432 4.221 20 0 EIADMM Cc1nc(-c2ccccc2)oc1C(=O)Nc1ccc(Cl)cc1[O-] ZINC000153555221 1051195003 /nfs/dbraw/zinc/19/50/03/1051195003.db2.gz SQJGCVLMLGMEEG-UHFFFAOYSA-N -1 1 328.755 4.261 20 0 EIADMM COc1cc(C(=O)Nc2ccccc2OC(C)C)cc(Cl)c1[O-] ZINC000153580766 1051199568 /nfs/dbraw/zinc/19/95/68/1051199568.db2.gz VSHISRAXTYHTLI-UHFFFAOYSA-N -1 1 335.787 4.094 20 0 EIADMM COc1cc(C(=O)N(C)CCC2CCCCC2)cc(Cl)c1[O-] ZINC000153720907 1051219482 /nfs/dbraw/zinc/21/94/82/1051219482.db2.gz KDUZCPORIZWOTG-UHFFFAOYSA-N -1 1 325.836 4.097 20 0 EIADMM COc1ccc(-c2nnsc2[N-]c2c(F)ccc(F)c2F)cc1 ZINC001175026755 1051300472 /nfs/dbraw/zinc/30/04/72/1051300472.db2.gz XBRPJOFHWHXOPD-UHFFFAOYSA-N -1 1 337.326 4.375 20 0 EIADMM O=C(Nc1ccc(OCc2ccccc2)cc1)c1ccc([O-])cc1F ZINC000154621375 1051316203 /nfs/dbraw/zinc/31/62/03/1051316203.db2.gz QGCZRLGRLGUTOD-UHFFFAOYSA-N -1 1 337.350 4.363 20 0 EIADMM COc1cc(C(=O)Nc2cccc3cccc(N)c32)cc(Cl)c1[O-] ZINC001191146890 1051362726 /nfs/dbraw/zinc/36/27/26/1051362726.db2.gz LGWGWCSPWGFHGO-UHFFFAOYSA-N -1 1 342.782 4.042 20 0 EIADMM COc1cc(C(=O)NCc2ccc(C(C)(C)C)cc2)cc(Cl)c1[O-] ZINC001191148668 1051365150 /nfs/dbraw/zinc/36/51/50/1051365150.db2.gz PIRJTUKGDPDPMB-UHFFFAOYSA-N -1 1 347.842 4.282 20 0 EIADMM CCOc1cccc(Nc2ccc(F)c(Br)c2[O-])c1 ZINC001175093885 1051377932 /nfs/dbraw/zinc/37/79/32/1051377932.db2.gz LVLXEEACIFJPIG-UHFFFAOYSA-N -1 1 326.165 4.436 20 0 EIADMM O=C(c1cccc(F)c1Nc1c(F)ccc([O-])c1F)C(F)(F)F ZINC001175271072 1051509743 /nfs/dbraw/zinc/50/97/43/1051509743.db2.gz QOHXFYJPPZIODT-UHFFFAOYSA-N -1 1 335.203 4.298 20 0 EIADMM Cc1noc(C2CC2)c1[N-]C(=O)c1cnc(-c2ccccc2F)s1 ZINC000156580405 1051543878 /nfs/dbraw/zinc/54/38/78/1051543878.db2.gz CNNBKZAESVGPOP-UHFFFAOYSA-N -1 1 343.383 4.375 20 0 EIADMM CCS(=O)(=O)c1cccc(Nc2c(Cl)ccc([O-])c2Cl)c1 ZINC001175453671 1051626073 /nfs/dbraw/zinc/62/60/73/1051626073.db2.gz YQCCWYVADAROHS-UHFFFAOYSA-N -1 1 346.235 4.236 20 0 EIADMM CC(C)c1ccccc1[N-]S(=O)(=O)c1cc(F)c(F)c(F)c1 ZINC000157540903 1051647729 /nfs/dbraw/zinc/64/77/29/1051647729.db2.gz YTAJKRJGVHMSOQ-UHFFFAOYSA-N -1 1 329.343 4.028 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc(-c3ncco3)cc2)cc1Cl ZINC000157689998 1051667682 /nfs/dbraw/zinc/66/76/82/1051667682.db2.gz HPZUUEVRAIDPEM-UHFFFAOYSA-N -1 1 348.811 4.104 20 0 EIADMM CCNC(=O)c1ccc(Nc2cc(Cl)cc(Cl)c2[O-])cc1 ZINC001175632856 1051683838 /nfs/dbraw/zinc/68/38/38/1051683838.db2.gz JXQPBRINMHEZDP-UHFFFAOYSA-N -1 1 325.195 4.192 20 0 EIADMM C[C@H](NC(=O)c1ccc2ccc(O)cc2c1[O-])c1ccc(F)c(F)c1 ZINC001182759475 1051685541 /nfs/dbraw/zinc/68/55/41/1051685541.db2.gz YYSBZEMJRVTYKV-JTQLQIEISA-N -1 1 343.329 4.020 20 0 EIADMM O=C(NC1CC1)c1ccc(Nc2cc(Cl)cc(Cl)c2[O-])cc1 ZINC001175609339 1051696450 /nfs/dbraw/zinc/69/64/50/1051696450.db2.gz ZNEBEMMVYKMCPL-UHFFFAOYSA-N -1 1 337.206 4.335 20 0 EIADMM Cc1n[nH]c2ccc(Nc3ccc(F)c(Br)c3[O-])cc12 ZINC001175701391 1051711590 /nfs/dbraw/zinc/71/15/90/1051711590.db2.gz AUAOEKARIANMNZ-UHFFFAOYSA-N -1 1 336.164 4.222 20 0 EIADMM Cc1[nH]nc2ccc(Nc3ccc(F)c(Br)c3[O-])cc12 ZINC001175701391 1051711625 /nfs/dbraw/zinc/71/16/25/1051711625.db2.gz AUAOEKARIANMNZ-UHFFFAOYSA-N -1 1 336.164 4.222 20 0 EIADMM CC(C)(CNC(=O)c1ccc(C(F)(F)F)c([O-])c1)CC(F)(F)F ZINC000621225275 1051769053 /nfs/dbraw/zinc/76/90/53/1051769053.db2.gz JZMNQRIXGMAXIV-UHFFFAOYSA-N -1 1 343.267 4.119 20 0 EIADMM Cc1cc([C@H](C)NC(=O)c2cc([O-])cc(F)c2F)ccc1Cl ZINC001192679351 1051789874 /nfs/dbraw/zinc/78/98/74/1051789874.db2.gz SEUSOEDBWVWMBP-VIFPVBQESA-N -1 1 325.742 4.123 20 0 EIADMM O=C(c1c([O-])cnc2ccc(Cl)cc21)N1CCCCCCCC1 ZINC001183468137 1051848605 /nfs/dbraw/zinc/84/86/05/1051848605.db2.gz CYIUDGNPVAYUSO-UHFFFAOYSA-N -1 1 332.831 4.390 20 0 EIADMM [O-]c1c(Cl)cc(Cl)cc1Nc1cccc(N2CCOCC2)c1 ZINC001176017605 1051876926 /nfs/dbraw/zinc/87/69/26/1051876926.db2.gz HLZZEFAGXFYLBM-UHFFFAOYSA-N -1 1 339.222 4.279 20 0 EIADMM C[C@@H](NC(=O)Nc1cccc(C(F)(F)F)c1[O-])c1ccc(F)cc1 ZINC001193147679 1051881285 /nfs/dbraw/zinc/88/12/85/1051881285.db2.gz MMOWAEYLGVHGNR-SECBINFHSA-N -1 1 342.292 4.433 20 0 EIADMM O=c1oc2cc([O-])ccc2cc1Nc1ccc(-c2ccccn2)cc1 ZINC001176040362 1051884393 /nfs/dbraw/zinc/88/43/93/1051884393.db2.gz YTZGPEZFKHZIRH-UHFFFAOYSA-N -1 1 330.343 4.304 20 0 EIADMM CC(C)Oc1c(F)c(F)c([N-]c2noc3cccnc23)c(F)c1F ZINC001193291446 1051897305 /nfs/dbraw/zinc/89/73/05/1051897305.db2.gz LXXRLFGEBFXNAJ-UHFFFAOYSA-N -1 1 341.264 4.310 20 0 EIADMM CCN(CC)C(=O)c1ccc(F)c(Nc2cc(F)c([O-])cc2F)c1 ZINC001176069085 1051904877 /nfs/dbraw/zinc/90/48/77/1051904877.db2.gz NDYXPFGLQDZUSW-UHFFFAOYSA-N -1 1 338.329 4.035 20 0 EIADMM O=C(CCCC1CCCCC1)Nc1cc(=O)n(-c2ccccc2)[n-]1 ZINC001184223067 1051970405 /nfs/dbraw/zinc/97/04/05/1051970405.db2.gz WPMVHEMTKYWTDK-UHFFFAOYSA-N -1 1 327.428 4.267 20 0 EIADMM CCc1cccc(S(=O)(=O)[N-]c2ccc(C)c(-c3ncco3)c2)c1 ZINC000164648429 1052035597 /nfs/dbraw/zinc/03/55/97/1052035597.db2.gz KWYVYUYEXKNNHK-UHFFFAOYSA-N -1 1 342.420 4.013 20 0 EIADMM O=C([O-])CCC1CCN(Cc2ncc(-c3cccc(Cl)c3)o2)CC1 ZINC000324421796 1052038133 /nfs/dbraw/zinc/03/81/33/1052038133.db2.gz NMSNWPLXPIJDPZ-UHFFFAOYSA-N -1 1 348.830 4.072 20 0 EIADMM O=C(OCc1ccc(Cl)c2cccnc12)c1ccc([O-])cc1F ZINC000773577183 1052052532 /nfs/dbraw/zinc/05/25/32/1052052532.db2.gz SMQITSJTANPCRQ-UHFFFAOYSA-N -1 1 331.730 4.090 20 0 EIADMM Cc1ccnc(F)c1[N-]S(=O)(=O)c1ccc(-c2cccs2)cc1 ZINC001194142033 1052097487 /nfs/dbraw/zinc/09/74/87/1052097487.db2.gz MTPRBCCGTRHWPN-UHFFFAOYSA-N -1 1 348.424 4.058 20 0 EIADMM COC(=O)c1cc(Nc2c(F)cc(F)c([O-])c2F)c(Cl)s1 ZINC001176663528 1052157272 /nfs/dbraw/zinc/15/72/72/1052157272.db2.gz IGECXZUESHQKQP-UHFFFAOYSA-N -1 1 337.706 4.055 20 0 EIADMM CCOC(=O)c1ccc(C)c(Nc2c(F)cc(F)c([O-])c2F)c1 ZINC001176672022 1052159179 /nfs/dbraw/zinc/15/91/79/1052159179.db2.gz CNPRYKOZTGNJJI-UHFFFAOYSA-N -1 1 325.286 4.038 20 0 EIADMM COc1cc(Nc2c(F)cc(F)c([O-])c2F)ccc1Br ZINC001176671984 1052159501 /nfs/dbraw/zinc/15/95/01/1052159501.db2.gz BUEGIUUFXMBZJK-UHFFFAOYSA-N -1 1 348.118 4.324 20 0 EIADMM Cc1cc(Br)cc(Nc2c(F)cc(F)c([O-])c2F)c1N ZINC001176672023 1052159863 /nfs/dbraw/zinc/15/98/63/1052159863.db2.gz RJZPTFLGTHKXPN-UHFFFAOYSA-N -1 1 347.134 4.206 20 0 EIADMM COc1ccccc1-n1nc(C)cc1Nc1c(F)cc(F)c([O-])c1F ZINC001176663367 1052172518 /nfs/dbraw/zinc/17/25/18/1052172518.db2.gz HBYKLSHXDUONND-UHFFFAOYSA-N -1 1 349.312 4.056 20 0 EIADMM O=C(Nc1cc(F)cc(F)c1[O-])Oc1ccc(Br)cc1 ZINC001194605605 1052178318 /nfs/dbraw/zinc/17/83/18/1052178318.db2.gz QRBSQZLYJWHPSU-UHFFFAOYSA-N -1 1 344.111 4.044 20 0 EIADMM Cc1cccc(C)c1S(=O)(=O)[N-]c1ccc(-c2ccco2)cc1 ZINC001194639913 1052183773 /nfs/dbraw/zinc/18/37/73/1052183773.db2.gz WMPMEXMEICCGSA-UHFFFAOYSA-N -1 1 327.405 4.364 20 0 EIADMM CCCN(Cc1ccccc1)C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000622289834 1052184850 /nfs/dbraw/zinc/18/48/50/1052184850.db2.gz HNLMULKSUQZQTQ-UHFFFAOYSA-N -1 1 337.341 4.463 20 0 EIADMM Cc1ccc(Cl)cc1[N-]S(=O)(=O)c1ccc(-c2cnco2)cc1 ZINC001185221227 1052196835 /nfs/dbraw/zinc/19/68/35/1052196835.db2.gz DVYBYIMIPVUQPJ-UHFFFAOYSA-N -1 1 348.811 4.104 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2cccc(OC(F)F)c2)ccc1Cl ZINC001185525353 1052256340 /nfs/dbraw/zinc/25/63/40/1052256340.db2.gz ZIMLVAWYHSEDNA-UHFFFAOYSA-N -1 1 347.770 4.051 20 0 EIADMM COc1ccccc1C[C@@H](C)[N@@H+](C)Cc1cccc(C(=O)[O-])c1Cl ZINC000381474692 1053077508 /nfs/dbraw/zinc/07/75/08/1053077508.db2.gz CZEHDMWMPASDFM-CYBMUJFWSA-N -1 1 347.842 4.110 20 0 EIADMM CC(C)c1cccc(S(=O)(=O)[N-]c2ccc3ccn(C)c3c2)c1 ZINC001195158684 1053308952 /nfs/dbraw/zinc/30/89/52/1053308952.db2.gz CRNYGBOGNHUSKH-UHFFFAOYSA-N -1 1 328.437 4.103 20 0 EIADMM [O-]c1c(NC(=S)Nc2ccccc2F)cccc1C(F)(F)F ZINC001195784708 1053485856 /nfs/dbraw/zinc/48/58/56/1053485856.db2.gz SWMIYAPQCUOIIE-UHFFFAOYSA-N -1 1 330.306 4.359 20 0 EIADMM COc1cccc(NC(=S)Nc2cc([O-])c(Cl)cc2F)c1 ZINC001196049493 1053571370 /nfs/dbraw/zinc/57/13/70/1053571370.db2.gz NEUBRWBMVRJIHT-UHFFFAOYSA-N -1 1 326.780 4.002 20 0 EIADMM [O-]c1cc(NC(=S)Nc2ccc(C(F)(F)F)cc2)c(F)cc1F ZINC001196188191 1053598474 /nfs/dbraw/zinc/59/84/74/1053598474.db2.gz SPSMMHXTGOUVGR-UHFFFAOYSA-N -1 1 348.296 4.498 20 0 EIADMM [O-]c1cc(F)c(F)cc1NC(=S)Nc1ccc(C(F)(F)F)cc1 ZINC001196188865 1053598529 /nfs/dbraw/zinc/59/85/29/1053598529.db2.gz XIKRENHGGWQCCK-UHFFFAOYSA-N -1 1 348.296 4.498 20 0 EIADMM O=C(Nc1ccc(NC(=O)C2CC2)cc1)c1cc2ccccc2cc1[O-] ZINC000012435576 1053627330 /nfs/dbraw/zinc/62/73/30/1053627330.db2.gz XYXSXEGAFWOHOD-UHFFFAOYSA-N -1 1 346.386 4.146 20 0 EIADMM O=C(Nc1cc(F)c([O-])cc1Cl)[C@H]1CC[C@@H](C(F)(F)F)C1 ZINC000885678839 1053810449 /nfs/dbraw/zinc/81/04/49/1053810449.db2.gz WRMLKJWERCPTEQ-NKWVEPMBSA-N -1 1 325.689 4.102 20 0 EIADMM [O-]c1cc(F)c(NC(=S)Nc2ccccc2C(F)(F)F)cc1F ZINC001197263398 1053864836 /nfs/dbraw/zinc/86/48/36/1053864836.db2.gz NOEMIQTVUSSKPC-UHFFFAOYSA-N -1 1 348.296 4.498 20 0 EIADMM [O-]c1cc(F)c(F)cc1NC(=S)Nc1cccc(C(F)(F)F)c1 ZINC001198059847 1054054024 /nfs/dbraw/zinc/05/40/24/1054054024.db2.gz QHXBPAFOILVMBM-UHFFFAOYSA-N -1 1 348.296 4.498 20 0 EIADMM O=C(Nc1cccc(NC(=O)C2CC2)c1)c1cc2ccccc2cc1[O-] ZINC000031135684 1054059205 /nfs/dbraw/zinc/05/92/05/1054059205.db2.gz GZUMVGHOMXFUGD-UHFFFAOYSA-N -1 1 346.386 4.146 20 0 EIADMM Cc1ccccc1NC(=S)Nc1cccc([O-])c1Br ZINC001198435082 1054157006 /nfs/dbraw/zinc/15/70/06/1054157006.db2.gz IWECUFDWINYZOI-UHFFFAOYSA-N -1 1 337.242 4.272 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1CCC[C@H](OC2CCC2)CC1 ZINC000871333511 1054201090 /nfs/dbraw/zinc/20/10/90/1054201090.db2.gz JXMLTOWXUGHUJL-SFHVURJKSA-N -1 1 339.435 4.109 20 0 EIADMM O=C([N-]Cc1c(F)cccc1Cl)C(F)(F)c1ccccc1F ZINC000857435033 1054237641 /nfs/dbraw/zinc/23/76/41/1054237641.db2.gz SSTHJZLCSCPQSF-UHFFFAOYSA-N -1 1 331.696 4.026 20 0 EIADMM Cc1cc2cc[nH]c2c(C(=O)Nc2cccc(C(F)(F)F)c2[O-])c1 ZINC001198707338 1054244552 /nfs/dbraw/zinc/24/45/52/1054244552.db2.gz QFKCXYZJBHGVBR-UHFFFAOYSA-N -1 1 334.297 4.453 20 0 EIADMM O=C([N-][C@@H](C1CCCCC1)C(F)(F)F)C(F)(F)Cc1ccccc1 ZINC000857462707 1054252898 /nfs/dbraw/zinc/25/28/98/1054252898.db2.gz MRHAVIXHTNXNAS-AWEZNQCLSA-N -1 1 349.343 4.492 20 0 EIADMM [O-]c1cc(C(F)(F)F)cc(Cl)c1NC(=S)Nc1cccnc1 ZINC001199903327 1054486319 /nfs/dbraw/zinc/48/63/19/1054486319.db2.gz YIYMSMNVXPXYSQ-UHFFFAOYSA-N -1 1 347.749 4.268 20 0 EIADMM O=C(NCc1ccc(C(F)(F)F)cc1)Nc1ccc([O-])c(Cl)c1 ZINC000169046200 1054490488 /nfs/dbraw/zinc/49/04/88/1054490488.db2.gz HEIVAFHHUJGJSH-UHFFFAOYSA-N -1 1 344.720 4.386 20 0 EIADMM O=c1nc(N2CCC[C@@H](CCCc3ccccc3)C2)cc(Cl)[n-]1 ZINC000858455131 1054493413 /nfs/dbraw/zinc/49/34/13/1054493413.db2.gz RTNLOVMERZVDIQ-OAHLLOKOSA-N -1 1 331.847 4.075 20 0 EIADMM CCSCC[C@@H](C)N(C)C(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC000619582451 1054537046 /nfs/dbraw/zinc/53/70/46/1054537046.db2.gz CFSJAYNCSIJOJA-SNVBAGLBSA-N -1 1 335.391 4.015 20 0 EIADMM CC(C)(C)NC(=S)Nc1c([O-])cc(C(F)(F)F)cc1Cl ZINC001200909224 1054570048 /nfs/dbraw/zinc/57/00/48/1054570048.db2.gz YBVIQXJQWXPKTP-UHFFFAOYSA-N -1 1 326.771 4.149 20 0 EIADMM CSc1ccc(NC(=S)Nc2cc(F)c(F)cc2[O-])cc1 ZINC001201186137 1054708145 /nfs/dbraw/zinc/70/81/45/1054708145.db2.gz AAHJFHWMCUWRMA-UHFFFAOYSA-N -1 1 326.393 4.201 20 0 EIADMM C[C@H](CNC(=O)c1ccc(C(F)(F)F)c([O-])c1)Cc1cccs1 ZINC001137082147 1054721873 /nfs/dbraw/zinc/72/18/73/1054721873.db2.gz QDSDIRWAPHDONS-JTQLQIEISA-N -1 1 343.370 4.081 20 0 EIADMM CC(=O)c1cc(F)c([N-]C(=O)c2nc(C(C)(C)C)cs2)c(F)c1 ZINC000875499082 1054794746 /nfs/dbraw/zinc/79/47/46/1054794746.db2.gz TUHVVCXECAXZKU-UHFFFAOYSA-N -1 1 338.379 4.174 20 0 EIADMM CC(C)Cn1ccc2cc([N-]S(=O)(=O)c3ccccc3)ccc21 ZINC000063476068 1054812494 /nfs/dbraw/zinc/81/24/94/1054812494.db2.gz ACNAMISUUKGRKN-UHFFFAOYSA-N -1 1 328.437 4.098 20 0 EIADMM O=C(Nc1cc(F)c([O-])cc1F)Nc1ccccc1C(F)(F)F ZINC001202165161 1055064683 /nfs/dbraw/zinc/06/46/83/1055064683.db2.gz WEBYZQWCDWVMEX-UHFFFAOYSA-N -1 1 332.228 4.333 20 0 EIADMM O=C(Nc1cccc(C(F)(F)F)c1)Nc1cc(F)cc(F)c1[O-] ZINC001202297784 1055129269 /nfs/dbraw/zinc/12/92/69/1055129269.db2.gz WQZXTJWZODPNHP-UHFFFAOYSA-N -1 1 332.228 4.333 20 0 EIADMM O=C([N-]c1nnc(-c2ccccc2)s1)c1cc(-c2ccccc2)on1 ZINC000072988311 1055159533 /nfs/dbraw/zinc/15/95/33/1055159533.db2.gz UHWRVTHCOLOMJH-UHFFFAOYSA-N -1 1 348.387 4.112 20 0 EIADMM Oc1ccccc1-c1nnc(C[N@H+]2CCCCC[C@H]2c2ccco2)o1 ZINC000878116607 1055190443 /nfs/dbraw/zinc/19/04/43/1055190443.db2.gz JXGLMXVAOVJGGI-HNNXBMFYSA-N -1 1 339.395 4.153 20 0 EIADMM C[C@H](c1ccccc1)[N@@H+](Cc1nnc(-c2ccccc2O)o1)C1CC1 ZINC000878218902 1055212097 /nfs/dbraw/zinc/21/20/97/1055212097.db2.gz CGGNTYLSEBILQJ-CQSZACIVSA-N -1 1 335.407 4.168 20 0 EIADMM COc1cccc(N[C@H](C)c2cc(Br)cc(F)c2[O-])c1 ZINC000186243277 1055264736 /nfs/dbraw/zinc/26/47/36/1055264736.db2.gz JESUDJAJRSQOCO-SECBINFHSA-N -1 1 340.192 4.476 20 0 EIADMM CC(=O)n1ncc2ccc(Nc3cc(Cl)c([O-])cc3Cl)cc21 ZINC001212421255 1055730106 /nfs/dbraw/zinc/73/01/06/1055730106.db2.gz NHANNPVLZMESEC-UHFFFAOYSA-N -1 1 336.178 4.452 20 0 EIADMM O=C(CCOc1ccc(F)c(Cl)c1)Nc1ccc([O-])c(Cl)c1 ZINC000542816614 1056095332 /nfs/dbraw/zinc/09/53/32/1056095332.db2.gz JYLGKHYCQMSKIF-UHFFFAOYSA-N -1 1 344.169 4.246 20 0 EIADMM O=C(NCc1ccccc1N1CCCC1)c1cc2ccccc2cc1[O-] ZINC000108709964 1056097638 /nfs/dbraw/zinc/09/76/38/1056097638.db2.gz SISKFVHTUVSQRQ-UHFFFAOYSA-N -1 1 346.430 4.076 20 0 EIADMM O=C(c1ccc([O-])c(F)c1)N1CCC([C@@H](F)c2ccccc2F)CC1 ZINC000672083752 1056235110 /nfs/dbraw/zinc/23/51/10/1056235110.db2.gz QLWILISUXRYIRE-GOSISDBHSA-N -1 1 349.352 4.233 20 0 EIADMM C/C=C/C[C@H]1CCCN(c2ccc(-c3nc(C)c(C)c(=O)[n-]3)cn2)C1 ZINC000624778115 1056504314 /nfs/dbraw/zinc/50/43/14/1056504314.db2.gz KCVXLRZRJJJVFG-APHBUQMISA-N -1 1 338.455 4.044 20 0 EIADMM Cc1cc(F)c(S(=O)(=O)[N-]C[C@]2(C)CC[C@H](C)C2(C)C)c(F)c1 ZINC001212440578 1056690195 /nfs/dbraw/zinc/69/01/95/1056690195.db2.gz ZZLLWPLJVMXAAV-SJCJKPOMSA-N -1 1 345.455 4.014 20 0 EIADMM CSc1ccc(S(=O)(=O)[N-]c2ccc(F)c(C3CC3)c2)cc1 ZINC000499505292 1056827759 /nfs/dbraw/zinc/82/77/59/1056827759.db2.gz MGRHVVKSFPKWEZ-UHFFFAOYSA-N -1 1 337.441 4.226 20 0 EIADMM O=C(Nc1cccc(OCc2ccccc2)c1)c1cccc([O-])c1F ZINC001168693616 1056831221 /nfs/dbraw/zinc/83/12/21/1056831221.db2.gz IFSDOPLGGGPYOX-UHFFFAOYSA-N -1 1 337.350 4.363 20 0 EIADMM C[C@H](OC(=O)c1c([O-])cc(F)cc1F)c1ncc(-c2ccccc2)o1 ZINC000741311541 1058191700 /nfs/dbraw/zinc/19/17/00/1058191700.db2.gz AOFUZKCJWSMPRL-JTQLQIEISA-N -1 1 345.301 4.243 20 0 EIADMM CC(=O)c1ccc([O-])c(CCOC(=O)C[C@@H](C)c2ccccc2F)c1 ZINC000744930356 1059667544 /nfs/dbraw/zinc/66/75/44/1059667544.db2.gz GHQFBQXMRRPZPD-CYBMUJFWSA-N -1 1 344.382 4.013 20 0 EIADMM CC(=O)c1ccc([O-])c(CCOC(=O)CC/C=C/c2ccccc2)c1 ZINC000745066552 1059713150 /nfs/dbraw/zinc/71/31/50/1059713150.db2.gz ZHDIHYSBFHNFBK-WEVVVXLNSA-N -1 1 338.403 4.174 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1cccc([C@@H]2CCCOC2)c1 ZINC000766554819 1060548875 /nfs/dbraw/zinc/54/88/75/1060548875.db2.gz ACMHTOZJNQQBKJ-CQSZACIVSA-N -1 1 331.799 4.192 20 0 EIADMM O=C(c1c([O-])cccc1Cl)N1C[C@H](c2ccccc2)[C@H]2CCC[C@@H]21 ZINC000804347608 1061136326 /nfs/dbraw/zinc/13/63/26/1061136326.db2.gz IBJLWCKHRYCJNJ-INMHGKMJSA-N -1 1 341.838 4.454 20 0 EIADMM O=C(Nc1ccc2c(c1)OC1(CCCCC1)O2)c1ccccc1[O-] ZINC000021205709 212216709 /nfs/dbraw/zinc/21/67/09/212216709.db2.gz FJPCXAPUJJSLQE-UHFFFAOYSA-N -1 1 325.364 4.076 20 0 EIADMM CO[C@H]1CCC[C@@H](C(=O)Nc2cc(Cl)c([O-])c3ccccc23)C1 ZINC000529539034 1032429311 /nfs/dbraw/zinc/42/93/11/1032429311.db2.gz OCUQUPLPCIAYGD-NEPJUHHUSA-N -1 1 333.815 4.343 20 0 EIADMM C[C@@H]1C[C@H](C(=O)Nc2cc(Cl)c([O-])c3ccccc23)CCC1=O ZINC000529539830 1032429458 /nfs/dbraw/zinc/42/94/58/1032429458.db2.gz VSUFXDQPYKNVNL-GHMZBOCLSA-N -1 1 331.799 4.143 20 0 EIADMM O=C(Nc1ccc(F)cc1[O-])c1ccc(Cl)c(C(F)(F)F)c1 ZINC000533338964 1032664074 /nfs/dbraw/zinc/66/40/74/1032664074.db2.gz GPWUTCVOHPBLGH-UHFFFAOYSA-N -1 1 333.668 4.456 20 0 EIADMM O=C([O-])[C@@H]1C[C@@H](C2CCCCC2)CN1Cc1nc2ccccc2s1 ZINC000579735563 1018845080 /nfs/dbraw/zinc/84/50/80/1018845080.db2.gz FWZHKNUCTNYABS-ZBFHGGJFSA-N -1 1 344.480 4.152 20 0 EIADMM CCOc1cc(-c2noc([C@H]3CCCSC3)n2)cc(Cl)c1[O-] ZINC000579769373 1018878926 /nfs/dbraw/zinc/87/89/26/1018878926.db2.gz GNJQHYLDGSAXLF-VIFPVBQESA-N -1 1 340.832 4.105 20 0 EIADMM CCOc1cc(-c2noc([C@@H]3CCCSC3)n2)cc(Cl)c1[O-] ZINC000579769370 1018882001 /nfs/dbraw/zinc/88/20/01/1018882001.db2.gz GNJQHYLDGSAXLF-SECBINFHSA-N -1 1 340.832 4.105 20 0 EIADMM COc1ccc(-c2nc(-c3cccc(C(F)(F)F)c3)no2)c([O-])c1 ZINC000109036981 1019362330 /nfs/dbraw/zinc/36/23/30/1019362330.db2.gz MDVUCMZINPODIM-UHFFFAOYSA-N -1 1 336.269 4.137 20 0 EIADMM Cc1cc2cc([N-]S(=O)(=O)c3ccc(C(F)F)cc3)ccc2[nH]1 ZINC000579881123 1020011770 /nfs/dbraw/zinc/01/17/70/1020011770.db2.gz VCBNYPKPULQWTD-UHFFFAOYSA-N -1 1 336.363 4.215 20 0 EIADMM CCN(C(=O)c1cncc([O-])c1)C(c1ccccc1)c1ccccc1 ZINC000339917295 1020099878 /nfs/dbraw/zinc/09/98/78/1020099878.db2.gz QQKLKYSSRLFARY-UHFFFAOYSA-N -1 1 332.403 4.039 20 0 EIADMM CC[C@@H](C)c1cccc(NC(=O)c2cc(C(=O)OC(C)(C)C)n[n-]2)c1 ZINC001167320482 1021087075 /nfs/dbraw/zinc/08/70/75/1021087075.db2.gz BXFGZLSUDMKIJM-GFCCVEGCSA-N -1 1 343.427 4.131 20 0 EIADMM COC(=O)[N-]C(=S)N(c1cc(C)cc(Cl)c1)c1ccccc1N ZINC001210464053 1021107676 /nfs/dbraw/zinc/10/76/76/1021107676.db2.gz RKOXZOJKJXAHCG-UHFFFAOYSA-N -1 1 349.843 4.010 20 0 EIADMM CSCc1ccccc1[N-]S(=O)(=O)c1ccc(F)c(Cl)c1 ZINC000612664190 1021264831 /nfs/dbraw/zinc/26/48/31/1021264831.db2.gz ISMWKNHQUCXIDJ-UHFFFAOYSA-N -1 1 345.848 4.143 20 0 EIADMM COC(=O)c1oc(C(=O)[N-]c2cc(Cl)ccc2SC)cc1C ZINC001125404499 1021289653 /nfs/dbraw/zinc/28/96/53/1021289653.db2.gz REFPGUOWTDWINQ-UHFFFAOYSA-N -1 1 339.800 4.002 20 0 EIADMM Cc1c(=O)[n-]c(SCCC[C@@H]2CCOC2)nc1-c1ccccc1 ZINC000647119964 1021736078 /nfs/dbraw/zinc/73/60/78/1021736078.db2.gz ALAUYKHSPIUPGK-CQSZACIVSA-N -1 1 330.453 4.066 20 0 EIADMM COC(=O)c1c(Cl)nccc1Nc1cc(Cl)c([O-])c(Cl)c1 ZINC001210927786 1021868572 /nfs/dbraw/zinc/86/85/72/1021868572.db2.gz ZCFVYZHNKZUBJY-UHFFFAOYSA-N -1 1 347.585 4.278 20 0 EIADMM Cc1cc(NC(=O)c2ccc([O-])c(F)c2)ccc1Oc1ccncc1 ZINC000683887156 1021874807 /nfs/dbraw/zinc/87/48/07/1021874807.db2.gz KCVHCLAGMNZHTJ-UHFFFAOYSA-N -1 1 338.338 4.279 20 0 EIADMM Cc1ccc(SCCC(=O)Nc2cc([O-])c(F)cc2F)cc1C ZINC001625893746 1022172668 /nfs/dbraw/zinc/17/26/68/1022172668.db2.gz LYELPNAUFYQLDB-UHFFFAOYSA-N -1 1 337.391 4.408 20 0 EIADMM CSCc1ccc([N-]S(=O)(=O)c2cc(C)c(F)c(C)c2)cc1 ZINC000460835797 1022278344 /nfs/dbraw/zinc/27/83/44/1022278344.db2.gz MSJFEJUYELTFNR-UHFFFAOYSA-N -1 1 339.457 4.106 20 0 EIADMM CCOc1cc(C(=O)Nc2nc3ccccc3s2)cc(Cl)c1[O-] ZINC000186423423 1022592556 /nfs/dbraw/zinc/59/25/56/1022592556.db2.gz FKIMPUDDIYFGHG-UHFFFAOYSA-N -1 1 348.811 4.306 20 0 EIADMM Cc1ccc2[nH]c3c(c2c1)CN(C(=O)c1cc(Cl)ccc1[O-])CC3 ZINC000025543646 1022831802 /nfs/dbraw/zinc/83/18/02/1022831802.db2.gz APLKNLKBVCMIMM-UHFFFAOYSA-N -1 1 340.810 4.034 20 0 EIADMM COCOc1ccc(Nc2ccc(F)c(Br)c2[O-])cc1 ZINC001211643977 1023029416 /nfs/dbraw/zinc/02/94/16/1023029416.db2.gz OLEAULBTJRFCOM-UHFFFAOYSA-N -1 1 342.164 4.020 20 0 EIADMM CCN(Cc1ccc([O-])c(F)c1F)Cc1c(F)cccc1Cl ZINC001140892741 1023165032 /nfs/dbraw/zinc/16/50/32/1023165032.db2.gz YVQZGVCSCYPQEC-UHFFFAOYSA-N -1 1 329.749 4.485 20 0 EIADMM C[C@@H]1CCc2c(sc3nc(-c4cnn(C(C)(C)C)c4)[n-]c(=O)c23)C1 ZINC000408009424 1023227587 /nfs/dbraw/zinc/22/75/87/1023227587.db2.gz QMBZJSYRSNOYOF-SNVBAGLBSA-N -1 1 342.468 4.140 20 0 EIADMM Cc1nc(C(C)C)sc1[C@H](C)[N@@H+](C)Cc1ccccc1C(=O)[O-] ZINC000584724429 1023246874 /nfs/dbraw/zinc/24/68/74/1023246874.db2.gz BZCRUCCOGTVGER-ZDUSSCGKSA-N -1 1 332.469 4.466 20 0 EIADMM O=C(Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)c1cc(Cl)cc(Cl)c1 ZINC000032912929 1023267933 /nfs/dbraw/zinc/26/79/33/1023267933.db2.gz KXJZSDKYAOYRSH-UHFFFAOYSA-N -1 1 348.189 4.341 20 0 EIADMM O=C(Nc1ccc(Oc2ccc(F)cc2)nc1)c1ccc([O-])cc1F ZINC000181884195 1023272528 /nfs/dbraw/zinc/27/25/28/1023272528.db2.gz DMNVIEIGFDYVOA-UHFFFAOYSA-N -1 1 342.301 4.110 20 0 EIADMM CC(C)c1ccc(-c2nc(CN(C)[C@H]3C[C@@H](C(=O)[O-])C3)cs2)cc1 ZINC000659802477 1023283570 /nfs/dbraw/zinc/28/35/70/1023283570.db2.gz WSAUNAYDOKKZDK-WOVMCDHWSA-N -1 1 344.480 4.229 20 0 EIADMM CC[N@@H+](CCCCCC(=O)[O-])Cc1cc(Br)ccc1F ZINC000581493766 1023302999 /nfs/dbraw/zinc/30/29/99/1023302999.db2.gz IJMBIIVKSQIVLB-UHFFFAOYSA-N -1 1 346.240 4.055 20 0 EIADMM CC(C)c1ccc(Cl)c(S(=O)(=O)[N-]c2ncccc2Cl)c1 ZINC000581503712 1023312024 /nfs/dbraw/zinc/31/20/24/1023312024.db2.gz ZMYDYTHYLOILKZ-UHFFFAOYSA-N -1 1 345.251 4.313 20 0 EIADMM COC(=O)c1cc(Nc2c(Cl)ccc([O-])c2Cl)ccc1F ZINC001215854013 1023334090 /nfs/dbraw/zinc/33/40/90/1023334090.db2.gz ASLRAEPKZIQEAF-UHFFFAOYSA-N -1 1 330.142 4.368 20 0 EIADMM Cc1nc(-c2ccccc2)oc1C(=O)[N-]c1nc(C(C)(C)C)ns1 ZINC000073333090 1023334305 /nfs/dbraw/zinc/33/43/05/1023334305.db2.gz GYXWONSMBYGCTK-UHFFFAOYSA-N -1 1 342.424 4.051 20 0 EIADMM CC(C)c1ccc(C(=O)Nc2cccc(Cn3cccn3)c2)c([O-])c1 ZINC000613617909 1023340490 /nfs/dbraw/zinc/34/04/90/1023340490.db2.gz MVHRXXADMRNQCV-UHFFFAOYSA-N -1 1 335.407 4.013 20 0 EIADMM CC(C)=CCSC[C@@H](NCc1c(Cl)cccc1Cl)C(=O)[O-] ZINC000417620004 1023375058 /nfs/dbraw/zinc/37/50/58/1023375058.db2.gz CGPTXGFODFDFNJ-CQSZACIVSA-N -1 1 348.295 4.236 20 0 EIADMM O=C([O-])[C@@H]1C[C@H](NCc2csc(Cl)c2Cl)c2ccccc21 ZINC000417637520 1023391205 /nfs/dbraw/zinc/39/12/05/1023391205.db2.gz ZABGPKPTFJJQRN-NEPJUHHUSA-N -1 1 342.247 4.458 20 0 EIADMM CCC[C@H](C(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)c1ccccc1 ZINC000613666135 1023479818 /nfs/dbraw/zinc/47/98/18/1023479818.db2.gz TVMSWTKFKCSHRQ-KRWDZBQOSA-N -1 1 335.407 4.305 20 0 EIADMM [O-]c1cc(F)c(Cl)cc1-c1cc(F)ccc1OC[C@H]1CCOC1 ZINC000623048637 1023585437 /nfs/dbraw/zinc/58/54/37/1023585437.db2.gz PWXSCPICYZAZFF-JTQLQIEISA-N -1 1 340.753 4.406 20 0 EIADMM O=C([O-])CC[C@@H]1CCCCN1Cc1cc(Cl)ccc1OC(F)F ZINC000320340396 1023621809 /nfs/dbraw/zinc/62/18/09/1023621809.db2.gz AWHSFFXLODECRQ-ZDUSSCGKSA-N -1 1 347.789 4.161 20 0 EIADMM Cc1cccc(C)c1[C@@H](C)NC(=O)c1ccc(Br)c([O-])c1 ZINC000544943054 1023700682 /nfs/dbraw/zinc/70/06/82/1023700682.db2.gz JLLVZDIDNQZHTH-GFCCVEGCSA-N -1 1 348.240 4.263 20 0 EIADMM CC(C)OCc1ccc([N-]S(=O)(=O)c2cccc(Cl)c2)cc1 ZINC000511696999 1023829411 /nfs/dbraw/zinc/82/94/11/1023829411.db2.gz GLOXJBBMRTWDPR-UHFFFAOYSA-N -1 1 339.844 4.066 20 0 EIADMM Cc1ccc(Cl)cc1[N-]S(=O)(=O)c1ccc(Cl)cc1C ZINC000048653296 1024672199 /nfs/dbraw/zinc/67/21/99/1024672199.db2.gz ZFHKATZQZQSSJR-UHFFFAOYSA-N -1 1 330.236 4.411 20 0 EIADMM [O-]c1ccc(-c2noc([C@@H]3C[C@@H]3c3cc(F)ccc3F)n2)cc1F ZINC000445484441 1024877641 /nfs/dbraw/zinc/87/76/41/1024877641.db2.gz ZFCJMVTZGPLHJK-ZYHUDNBSSA-N -1 1 332.281 4.131 20 0 EIADMM CCCc1cnc(NC(=O)c2cc(Cl)c([O-])c(OCC)c2)s1 ZINC000186988382 1025153090 /nfs/dbraw/zinc/15/30/90/1025153090.db2.gz ZTUFLVPXRNLKOP-UHFFFAOYSA-N -1 1 340.832 4.106 20 0 EIADMM CC[C@H](C)c1ccc(S(=O)(=O)[N-]c2ccc3oc(C)nc3c2)cc1 ZINC000008110073 1025208067 /nfs/dbraw/zinc/20/80/67/1025208067.db2.gz GNWFXAWTUJVCTH-LBPRGKRZSA-N -1 1 344.436 4.451 20 0 EIADMM Cc1cnc(C(=O)N([C@H](C)c2ccccc2Cl)C2CC2)c([O-])c1 ZINC000426627020 1025809037 /nfs/dbraw/zinc/80/90/37/1025809037.db2.gz ZETZMNBJLDDESP-GFCCVEGCSA-N -1 1 330.815 4.115 20 0 EIADMM CC/C=C(\C)C(=O)Nc1nc(C)c(-c2n[n-]c(=S)n2C2CC2)s1 ZINC000171448967 1025878437 /nfs/dbraw/zinc/87/84/37/1025878437.db2.gz GUWLNBHNWVOHOA-VMPITWQZSA-N -1 1 349.485 4.002 20 0 EIADMM O=C(Cc1ccc(OC(F)(F)F)cc1)Nc1ccc([O-])c(Cl)c1 ZINC000111666497 1026315551 /nfs/dbraw/zinc/31/55/51/1026315551.db2.gz ZDKKGFVKTMAXCO-UHFFFAOYSA-N -1 1 345.704 4.125 20 0 EIADMM O=C([O-])C[C@H](NCc1cccc(Cl)c1Cl)c1ccsc1 ZINC000426677014 1026479768 /nfs/dbraw/zinc/47/97/68/1026479768.db2.gz IOZOAYOZWHSDEM-LBPRGKRZSA-N -1 1 330.236 4.361 20 0 EIADMM CCc1ccc(-c2ccc(CN[C@H](Cc3ccccc3)C(=O)[O-])o2)cc1 ZINC000426695334 1026480992 /nfs/dbraw/zinc/48/09/92/1026480992.db2.gz IVZNFQCILIOBPM-HXUWFJFHSA-N -1 1 349.430 4.295 20 0 EIADMM O=c1cc(C(F)F)nc(SCc2ccc(Br)cc2)[n-]1 ZINC000582353202 1026484000 /nfs/dbraw/zinc/48/40/00/1026484000.db2.gz UPGMLNNQAOXCCX-UHFFFAOYSA-N -1 1 347.184 4.175 20 0 EIADMM COc1ccc([C@@H](CCC(=O)[O-])NCc2ccsc2Cl)cc1 ZINC000426724319 1026503831 /nfs/dbraw/zinc/50/38/31/1026503831.db2.gz RHQNGOQALFBEND-CQSZACIVSA-N -1 1 339.844 4.106 20 0 EIADMM O=C([O-])Cc1ccccc1CNCc1ccc(-c2ccccc2)cc1F ZINC000426710474 1026508644 /nfs/dbraw/zinc/50/86/44/1026508644.db2.gz WLDDBOWOYMBAFH-UHFFFAOYSA-N -1 1 349.405 4.410 20 0 EIADMM CC1([C@H](NCc2ccc(-c3ccccc3)o2)C(=O)[O-])CCCCC1 ZINC000426734481 1026515696 /nfs/dbraw/zinc/51/56/96/1026515696.db2.gz APRQCFCBXNZGSF-GOSISDBHSA-N -1 1 327.424 4.460 20 0 EIADMM O=C([O-])C[C@H](NCc1ccccc1F)c1cc(Cl)cc(Cl)c1 ZINC000426753611 1026540514 /nfs/dbraw/zinc/54/05/14/1026540514.db2.gz JNOAOPWESFVHOO-HNNXBMFYSA-N -1 1 342.197 4.438 20 0 EIADMM O=C([O-])[C@@H](NCc1ccc(Cl)c(F)c1)c1ccc(Cl)c(F)c1 ZINC000426756144 1026541727 /nfs/dbraw/zinc/54/17/27/1026541727.db2.gz IHCBFIHPYRWDGS-AWEZNQCLSA-N -1 1 346.160 4.187 20 0 EIADMM O=C([O-])C[C@H](NCc1ccc(Cl)c(F)c1)c1ccc(F)cc1F ZINC000426806631 1026563143 /nfs/dbraw/zinc/56/31/43/1026563143.db2.gz KITSIHMGPCRDLO-HNNXBMFYSA-N -1 1 343.732 4.063 20 0 EIADMM O=C([O-])[C@H](NCc1cc(C(F)(F)F)ccc1Cl)c1ccccc1 ZINC000426798184 1026568758 /nfs/dbraw/zinc/56/87/58/1026568758.db2.gz IKXADAPOIJVKSP-CQSZACIVSA-N -1 1 343.732 4.274 20 0 EIADMM CCc1ccc([C@@H](NCc2cc3ccccc3s2)C(=O)[O-])cc1 ZINC000426800811 1026569680 /nfs/dbraw/zinc/56/96/80/1026569680.db2.gz PCNKTWDOSQSCQX-GOSISDBHSA-N -1 1 325.433 4.379 20 0 EIADMM Cc1cc(CN[C@@H](CC(=O)[O-])c2ccc(F)cc2F)ccc1Cl ZINC000426829427 1026573012 /nfs/dbraw/zinc/57/30/12/1026573012.db2.gz PDTQVFPDQGTXLS-INIZCTEOSA-N -1 1 339.769 4.232 20 0 EIADMM O=C([O-])C[C@@H](NCc1ccc(F)cc1Cl)c1cccc(Cl)c1 ZINC000426821657 1026579657 /nfs/dbraw/zinc/57/96/57/1026579657.db2.gz VRZAVRUFVOLEEI-OAHLLOKOSA-N -1 1 342.197 4.438 20 0 EIADMM Cc1cc(Cl)ccc1CN[C@@H](CC(=O)[O-])c1ccc(F)cc1F ZINC000426833096 1026591981 /nfs/dbraw/zinc/59/19/81/1026591981.db2.gz KTERCFNMYPHISN-INIZCTEOSA-N -1 1 339.769 4.232 20 0 EIADMM Cc1nc2ccc(NC(=O)c3ccc(C(F)(F)F)c([O-])c3)cc2o1 ZINC000684870345 1026627419 /nfs/dbraw/zinc/62/74/19/1026627419.db2.gz AVMYJTOMSWHLBO-UHFFFAOYSA-N -1 1 336.269 4.113 20 0 EIADMM C[C@H](c1ccccc1F)N(C)C(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684870780 1026632869 /nfs/dbraw/zinc/63/28/69/1026632869.db2.gz PHKNWNCDSULTLL-SNVBAGLBSA-N -1 1 341.304 4.383 20 0 EIADMM CC(C)(CNC(=O)c1ccc(C(F)(F)F)c([O-])c1)c1cccs1 ZINC000684874882 1026648279 /nfs/dbraw/zinc/64/82/79/1026648279.db2.gz ZVVOAJKBRVWBCB-UHFFFAOYSA-N -1 1 343.370 4.180 20 0 EIADMM CCN(Cc1cccc([O-])c1Cl)Cc1ccc(OC)cc1OC ZINC000507326886 1026746557 /nfs/dbraw/zinc/74/65/57/1026746557.db2.gz AEWLEVFBHROLLW-UHFFFAOYSA-N -1 1 335.831 4.085 20 0 EIADMM CN(Cc1c(F)cccc1Cl)C(=O)c1cc(Cl)ccc1[O-] ZINC000021914459 1026765935 /nfs/dbraw/zinc/76/59/35/1026765935.db2.gz MVLUZADIWAMIBL-UHFFFAOYSA-N -1 1 328.170 4.110 20 0 EIADMM CCOC(=O)c1cnc(C(C)=Cc2ccc(C(C)(C)C)cc2)[n-]c1=O ZINC000432696767 1026785414 /nfs/dbraw/zinc/78/54/14/1026785414.db2.gz DEMGRVMFPFVDIM-QBFSEMIESA-N -1 1 340.423 4.217 20 0 EIADMM CC[C@@H](C)Cc1c(C)sc2[nH]c(-c3ccc([O-])cn3)nc(=O)c12 ZINC000427441418 1026855479 /nfs/dbraw/zinc/85/54/79/1026855479.db2.gz AWFHTUXYJISGFN-SECBINFHSA-N -1 1 329.425 4.062 20 0 EIADMM Cn1c2ccccc2nc1[C@H]1CCCN1Cc1cccc([O-])c1Cl ZINC000507630319 1026859142 /nfs/dbraw/zinc/85/91/42/1026859142.db2.gz OWXKKTDOTKGZNS-MRXNPFEDSA-N -1 1 341.842 4.269 20 0 EIADMM O=C([O-])C[C@@H]1CCCN(Cc2ccc(Cl)c(C(F)(F)F)c2)C1 ZINC000519810357 1027004276 /nfs/dbraw/zinc/00/42/76/1027004276.db2.gz DPGLSCLFOOVVEH-JTQLQIEISA-N -1 1 335.753 4.046 20 0 EIADMM CCCC[C@@H](CCC)CNC(=O)c1c(C)nc(C(C)(C)C)[n-]c1=O ZINC000440829701 1027070982 /nfs/dbraw/zinc/07/09/82/1027070982.db2.gz WNJFGVHUHPKCDG-CQSZACIVSA-N -1 1 335.492 4.124 20 0 EIADMM COC[C@@H]([N-]c1nc(-c2cccc(Cl)c2)no1)c1ccccc1 ZINC000301926426 1027150215 /nfs/dbraw/zinc/15/02/15/1027150215.db2.gz HJRTUHMCJHLVOU-OAHLLOKOSA-N -1 1 329.787 4.190 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2cccc(OC3CCCC3)c2)cc1F ZINC000614784281 1027687937 /nfs/dbraw/zinc/68/79/37/1027687937.db2.gz BTOYTTKVWMLBHU-UHFFFAOYSA-N -1 1 349.427 4.256 20 0 EIADMM CCc1nc(CNCc2cccc(-c3ccccc3)c2)ccc1C(=O)[O-] ZINC000426645362 1027952642 /nfs/dbraw/zinc/95/26/42/1027952642.db2.gz DCMPYIAUXAPKIB-UHFFFAOYSA-N -1 1 346.430 4.299 20 0 EIADMM COc1cc(C(=O)N(C)Cc2cc3ccccc3o2)cc(Cl)c1[O-] ZINC000153938413 1028062486 /nfs/dbraw/zinc/06/24/86/1028062486.db2.gz MTVPYTRAVLMCKX-UHFFFAOYSA-N -1 1 345.782 4.073 20 0 EIADMM COc1cc(C(=O)N2CC[C@@H](C)C[C@@H]2c2ccco2)cc(Cl)c1[O-] ZINC000153928115 1028066913 /nfs/dbraw/zinc/06/69/13/1028066913.db2.gz XMHDYIGAPMTWEH-BXUZGUMPSA-N -1 1 349.814 4.261 20 0 EIADMM Cc1cnc2c(cccc2S(=O)(=O)[N-]c2ccsc2Cl)c1 ZINC000189745365 1028213125 /nfs/dbraw/zinc/21/31/25/1028213125.db2.gz KZHWFSIYKWVGLJ-UHFFFAOYSA-N -1 1 338.841 4.059 20 0 EIADMM C[C@@H](NC(=O)c1ccc([O-])cc1F)c1ccc(-c2ccncc2)cc1 ZINC000154955447 1028328542 /nfs/dbraw/zinc/32/85/42/1028328542.db2.gz DWJWHMROVZYSFF-CYBMUJFWSA-N -1 1 336.366 4.084 20 0 EIADMM CCOc1cc(-c2noc(Cc3ccc(C)cc3)n2)cc(Cl)c1[O-] ZINC000445416155 1028535946 /nfs/dbraw/zinc/53/59/46/1028535946.db2.gz FHAYFEJRFAXEKQ-UHFFFAOYSA-N -1 1 344.798 4.394 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cnc(-c4ccco4)s3)n2)c(Cl)c1 ZINC000445449849 1028538398 /nfs/dbraw/zinc/53/83/98/1028538398.db2.gz PXBVIFOZTKEOFV-UHFFFAOYSA-N -1 1 345.767 4.479 20 0 EIADMM COc1ccccc1[C@@H](C)Cc1nc(-c2ccc([O-])cc2Cl)no1 ZINC000445450716 1028540622 /nfs/dbraw/zinc/54/06/22/1028540622.db2.gz VOLWIKMSOQBPDB-NSHDSACASA-N -1 1 344.798 4.450 20 0 EIADMM COc1cccc([C@@H](C)c2nc(-c3ccc([O-])cc3Cl)no2)c1 ZINC000445450310 1028540792 /nfs/dbraw/zinc/54/07/92/1028540792.db2.gz RXRWWUFXBVMEST-SNVBAGLBSA-N -1 1 330.771 4.256 20 0 EIADMM CCOc1ccc(-c2nc(-c3ccc([O-])cc3Cl)no2)cc1OC ZINC000445442514 1028565218 /nfs/dbraw/zinc/56/52/18/1028565218.db2.gz CLYNEKIDFGYVNZ-UHFFFAOYSA-N -1 1 346.770 4.170 20 0 EIADMM [O-]c1ccc(-c2noc([C@H]3C[C@]34CCc3ccccc34)n2)c(Cl)c1 ZINC000445445792 1028574117 /nfs/dbraw/zinc/57/41/17/1028574117.db2.gz KIWYQCGHUHCOJI-BEFAXECRSA-N -1 1 338.794 4.467 20 0 EIADMM C[C@@H](Sc1ccccn1)c1nc(-c2ccc([O-])cc2Cl)no1 ZINC000445452476 1028577949 /nfs/dbraw/zinc/57/79/49/1028577949.db2.gz RARRQJVXDGRXSI-SECBINFHSA-N -1 1 333.800 4.344 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cc(-c4ccccc4)[nH]n3)n2)c(Cl)c1 ZINC000445456297 1028610519 /nfs/dbraw/zinc/61/05/19/1028610519.db2.gz UBMRAIDJXOGKEZ-UHFFFAOYSA-N -1 1 338.754 4.153 20 0 EIADMM COc1ccc(/C=C(/C)c2nc(-c3ccc([O-])cc3F)no2)cc1F ZINC000445456723 1028611003 /nfs/dbraw/zinc/61/10/03/1028611003.db2.gz KDLYDIFOOFMBTR-YFHOEESVSA-N -1 1 344.317 4.290 20 0 EIADMM COc1ccccc1/C(C)=C\c1nc(-c2ccc([O-])cc2F)no1 ZINC000445457055 1028612759 /nfs/dbraw/zinc/61/27/59/1028612759.db2.gz QWGNAEHZLIMZJF-LUAWRHEFSA-N -1 1 326.327 4.150 20 0 EIADMM [O-]c1ccc(-c2noc(C3(c4cccc(F)c4)CCC3)n2)c(F)c1 ZINC000445457061 1028613827 /nfs/dbraw/zinc/61/38/27/1028613827.db2.gz QXZZNTTZEAQZQA-UHFFFAOYSA-N -1 1 328.318 4.190 20 0 EIADMM C[C@@H](Cc1nc(-c2ccc([O-])cc2F)no1)c1ccc(F)cc1F ZINC000445460095 1028618071 /nfs/dbraw/zinc/61/80/71/1028618071.db2.gz MWOORDPEJLUPQP-VIFPVBQESA-N -1 1 334.297 4.206 20 0 EIADMM [O-]c1ccc(-c2noc(C3(c4cccc(Cl)c4)CC3)n2)cc1F ZINC000445477002 1028624024 /nfs/dbraw/zinc/62/40/24/1028624024.db2.gz LCFFBJNTGPSEOP-UHFFFAOYSA-N -1 1 330.746 4.315 20 0 EIADMM [O-]c1ccc(-c2noc(-c3ccc(OCC4CC4)cc3)n2)cc1F ZINC000445477964 1028625392 /nfs/dbraw/zinc/62/53/92/1028625392.db2.gz BIBLGSGVNKZLEX-UHFFFAOYSA-N -1 1 326.327 4.037 20 0 EIADMM CC(C)c1cccc(OCc2nc(-c3ccc([O-])c(F)c3)no2)c1 ZINC000445480218 1028626620 /nfs/dbraw/zinc/62/66/20/1028626620.db2.gz LORJCYHRHUEVBW-UHFFFAOYSA-N -1 1 328.343 4.284 20 0 EIADMM Cc1ccc2nc(C)c(-c3nc(-c4ccc([O-])c(F)c4)no3)cc2c1 ZINC000445479263 1028626991 /nfs/dbraw/zinc/62/69/91/1028626991.db2.gz FTWNLPRDCDWULT-UHFFFAOYSA-N -1 1 335.338 4.413 20 0 EIADMM [O-]c1ccc(-c2noc(Cc3cccc(C(F)(F)F)c3)n2)cc1F ZINC000445480397 1028628140 /nfs/dbraw/zinc/62/81/40/1028628140.db2.gz JZPNCJVKKAMBNP-UHFFFAOYSA-N -1 1 338.260 4.191 20 0 EIADMM [O-]c1ccc(-c2noc(CSc3ccc4c(c3)CCC4)n2)cc1F ZINC000445482294 1028629755 /nfs/dbraw/zinc/62/97/55/1028629755.db2.gz SEJYOAOMZGCEMM-UHFFFAOYSA-N -1 1 342.395 4.362 20 0 EIADMM [O-]c1ccc(-c2noc([C@H]3CCSc4ccccc43)n2)cc1F ZINC000445481196 1028631091 /nfs/dbraw/zinc/63/10/91/1028631091.db2.gz KYEDZRNHJWENMR-LBPRGKRZSA-N -1 1 328.368 4.209 20 0 EIADMM C[C@H](C(=O)N=c1cc(-c2ccc(Cl)s2)[n-][nH]1)c1ccsc1 ZINC000536045639 1028803548 /nfs/dbraw/zinc/80/35/48/1028803548.db2.gz MGWHLTYCSLOLAG-QMMMGPOBSA-N -1 1 337.857 4.017 20 0 EIADMM COCc1cccc(S(=O)(=O)[N-]c2ccccc2CCC(C)C)c1 ZINC000524300968 1028854542 /nfs/dbraw/zinc/85/45/42/1028854542.db2.gz YJDZEIUPEKFASY-UHFFFAOYSA-N -1 1 347.480 4.222 20 0 EIADMM CSCc1ccc([N-]S(=O)(=O)c2ccc(C)c(Cl)c2)cc1 ZINC000524300630 1028856206 /nfs/dbraw/zinc/85/62/06/1028856206.db2.gz DFSKEYUIBWHDJY-UHFFFAOYSA-N -1 1 341.885 4.312 20 0 EIADMM O=C(CCc1cc(Cl)cs1)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC000347069018 1028860198 /nfs/dbraw/zinc/86/01/98/1028860198.db2.gz MSJMQFMUYHCVBS-UHFFFAOYSA-N -1 1 347.827 4.069 20 0 EIADMM C[C@H](C(=O)N=c1cc(-c2ccc(Cl)s2)[n-][nH]1)c1cccs1 ZINC000536076666 1028887942 /nfs/dbraw/zinc/88/79/42/1028887942.db2.gz KWNHBHHYHVXZOK-QMMMGPOBSA-N -1 1 337.857 4.017 20 0 EIADMM CCc1nc(SCc2cnc3ccc(C)cc3c2)[n-]c(=O)c1C ZINC000583704517 1029065286 /nfs/dbraw/zinc/06/52/86/1029065286.db2.gz IUDJMYMFCIFCPQ-UHFFFAOYSA-N -1 1 325.437 4.202 20 0 EIADMM CSc1ccc([O-])c(C(=O)Nc2cc(C3C(C)(C)C3(C)C)[nH]n2)c1 ZINC001143451489 1029123774 /nfs/dbraw/zinc/12/37/74/1029123774.db2.gz AOSWEZPZMLWXLQ-UHFFFAOYSA-N -1 1 345.468 4.239 20 0 EIADMM CCC(=O)c1cccc([N-]S(=O)(=O)c2ccccc2C(C)C)c1 ZINC000468355331 1029240975 /nfs/dbraw/zinc/24/09/75/1029240975.db2.gz FYUBVQKUZXAQLE-UHFFFAOYSA-N -1 1 331.437 4.204 20 0 EIADMM CCc1cccc(S(=O)(=O)[N-]c2ccc(-c3ccccn3)cc2)c1 ZINC000583967162 1029434306 /nfs/dbraw/zinc/43/43/06/1029434306.db2.gz OXSYWUAGPOWERU-UHFFFAOYSA-N -1 1 338.432 4.112 20 0 EIADMM CSCc1cccc([N-]S(=O)(=O)c2cccc(C(C)C)c2)c1 ZINC000525156997 1029489189 /nfs/dbraw/zinc/48/91/89/1029489189.db2.gz UCSLNVDFVGHUDT-UHFFFAOYSA-N -1 1 335.494 4.474 20 0 EIADMM CCOc1cc(C(=O)Nc2c(C)noc2C(C)C)cc(Cl)c1[O-] ZINC000928789597 1029493641 /nfs/dbraw/zinc/49/36/41/1029493641.db2.gz NYVOFHYZFQYXCK-UHFFFAOYSA-N -1 1 338.791 4.116 20 0 EIADMM [O-]c1ccc(Cc2nc([C@@H]3CCOC4(CCCC4)C3)no2)cc1Cl ZINC000897180122 1029510731 /nfs/dbraw/zinc/51/07/31/1029510731.db2.gz PMOYFQYXUIMLGD-CYBMUJFWSA-N -1 1 348.830 4.226 20 0 EIADMM Cc1nc(-c2ccc(NCC[C@H]3CCC(F)(F)C3)nc2)[n-]c(=O)c1C ZINC000897239990 1029604874 /nfs/dbraw/zinc/60/48/74/1029604874.db2.gz VMMRUSLYZMRBRM-CYBMUJFWSA-N -1 1 348.397 4.098 20 0 EIADMM CC(C)(C)c1ccc(S(=O)(=O)[N-]c2cc(F)c(F)c(F)c2)cc1 ZINC000525480861 1029650024 /nfs/dbraw/zinc/65/00/24/1029650024.db2.gz QGGQNWWHJRENCO-UHFFFAOYSA-N -1 1 343.370 4.202 20 0 EIADMM Cc1nc(-c2ccc(NCC(C)(C)c3ccccc3)nc2)[n-]c(=O)c1C ZINC000301343139 1029712348 /nfs/dbraw/zinc/71/23/48/1029712348.db2.gz GHABFYLOVDSMOC-UHFFFAOYSA-N -1 1 348.450 4.251 20 0 EIADMM COc1cc(C)cc([N-]S(=O)(=O)c2cccc3ccccc32)c1C ZINC000447264028 1029949158 /nfs/dbraw/zinc/94/91/58/1029949158.db2.gz MCPWCRHAQOUHES-UHFFFAOYSA-N -1 1 341.432 4.266 20 0 EIADMM C[C@@H]1C[C@@H](c2cccnc2)N(C(=O)c2cc3ccccc3cc2[O-])C1 ZINC000182851516 1029995241 /nfs/dbraw/zinc/99/52/41/1029995241.db2.gz MQBJJVGBRCJJAH-KUHUBIRLSA-N -1 1 332.403 4.164 20 0 EIADMM Cc1nc(C(C)(C)C)[n-]c(=O)c1C(=O)N(C)C[C@H](C)C1CCCCC1 ZINC000530040755 1030077094 /nfs/dbraw/zinc/07/70/94/1030077094.db2.gz VOBKUBZSLWLAEV-ZDUSSCGKSA-N -1 1 347.503 4.077 20 0 EIADMM CC(C)CCOc1ccccc1CNC(=O)c1c(F)ccc([O-])c1F ZINC000685428443 1030298901 /nfs/dbraw/zinc/29/89/01/1030298901.db2.gz MBKXZIMYPHXNEC-UHFFFAOYSA-N -1 1 349.377 4.025 20 0 EIADMM CCOc1cc(C(=O)Nc2nc(CC)c(C)s2)cc(Cl)c1[O-] ZINC000186660304 1030299780 /nfs/dbraw/zinc/29/97/80/1030299780.db2.gz YUQPFPRRVAKVFH-UHFFFAOYSA-N -1 1 340.832 4.024 20 0 EIADMM CCOc1cc(C(=O)N(C)[C@H](CC)c2ccncc2)cc(Cl)c1[O-] ZINC000186824500 1030307792 /nfs/dbraw/zinc/30/77/92/1030307792.db2.gz IXHFWGFYPWUVSO-OAHLLOKOSA-N -1 1 348.830 4.063 20 0 EIADMM O=C(N[C@@H]1CCC[C@H](c2ccccc2)C1)c1c(F)ccc([O-])c1F ZINC000685482827 1030369992 /nfs/dbraw/zinc/36/99/92/1030369992.db2.gz SHZILTVQBVEPGD-UONOGXRCSA-N -1 1 331.362 4.127 20 0 EIADMM CC(C)[C@@H]1C[C@@H](CNC(=O)c2c(F)ccc([O-])c2F)c2ccccc21 ZINC000685485797 1030371177 /nfs/dbraw/zinc/37/11/77/1030371177.db2.gz FMUQGBRNPDMASI-WFASDCNBSA-N -1 1 345.389 4.327 20 0 EIADMM CC(C)c1c(NC(=O)c2ccc([O-])cc2F)cnn1-c1ccccc1 ZINC000191029394 1030598853 /nfs/dbraw/zinc/59/88/53/1030598853.db2.gz GKNWZHXXTFFQFX-UHFFFAOYSA-N -1 1 339.370 4.093 20 0 EIADMM C[C@H]1CC[C@H](C(=O)[O-])CN1Cc1ccc(Cl)c(C(F)(F)F)c1 ZINC000263311180 1030823263 /nfs/dbraw/zinc/82/32/63/1030823263.db2.gz HZMWCCTYOGJBKV-ONGXEEELSA-N -1 1 335.753 4.044 20 0 EIADMM C[C@@H]1[C@@H](CC(F)(F)F)C[C@H](C)N1C(=O)c1cc(Cl)ccc1[O-] ZINC000452665757 1031246831 /nfs/dbraw/zinc/24/68/31/1031246831.db2.gz SFHVOJABTGVYHJ-IVZWLZJFSA-N -1 1 335.753 4.237 20 0 EIADMM C[C@H]1CC[C@H](c2noc(-c3cc(Oc4ccccc4)ccc3[O-])n2)O1 ZINC000528232973 1031278978 /nfs/dbraw/zinc/27/89/78/1031278978.db2.gz IKUNXFAAELZUMU-YVEFUNNKSA-N -1 1 338.363 4.475 20 0 EIADMM Cc1oc2ncnc([N-]C(=O)c3cc(-c4ccc(C)cc4)no3)c2c1C ZINC000118199245 1031381549 /nfs/dbraw/zinc/38/15/49/1031381549.db2.gz NNAGHZSHMGJFNU-UHFFFAOYSA-N -1 1 348.362 4.055 20 0 EIADMM C[C@H](Sc1ccccc1Cl)C(=O)Nc1ccc(F)cc1[O-] ZINC000532621061 1031430759 /nfs/dbraw/zinc/43/07/59/1031430759.db2.gz NZUHSTBMPIXJMN-VIFPVBQESA-N -1 1 325.792 4.304 20 0 EIADMM O=C(CSCc1ccc(Cl)cc1)Nc1ccc(F)cc1[O-] ZINC000532621029 1031432270 /nfs/dbraw/zinc/43/22/70/1031432270.db2.gz HQHWHPFFFNABFP-UHFFFAOYSA-N -1 1 325.792 4.057 20 0 EIADMM O=C(Nc1ccc(F)cc1[O-])c1ccc(COc2ccc(F)cc2)o1 ZINC000532622186 1031432789 /nfs/dbraw/zinc/43/27/89/1031432789.db2.gz JHIGKWCGJJYZJW-UHFFFAOYSA-N -1 1 345.301 4.095 20 0 EIADMM O=C(Nc1ccc(F)cc1[O-])c1cc(-c2cccc(Cl)c2)no1 ZINC000531756012 1031534872 /nfs/dbraw/zinc/53/48/72/1031534872.db2.gz FVULBJFHROACJJ-UHFFFAOYSA-N -1 1 332.718 4.092 20 0 EIADMM Cc1c(Cl)cc(Nc2cnc(N3CCCC3)nc2)c([O-])c1Cl ZINC001211936553 1031824480 /nfs/dbraw/zinc/82/44/80/1031824480.db2.gz XHNRTLFUPPQAMV-UHFFFAOYSA-N -1 1 339.226 4.141 20 0 EIADMM COc1ccc2sc(C(=O)Nc3ccc(F)cc3[O-])c(C)c2c1 ZINC000532012899 1031976067 /nfs/dbraw/zinc/97/60/67/1031976067.db2.gz RBFGOLSBZNAISU-UHFFFAOYSA-N -1 1 331.368 4.315 20 0 EIADMM CCN(C(=O)c1cc(Br)ccc1[O-])[C@@H]1CCCC[C@@H]1C ZINC001143552878 1033787637 /nfs/dbraw/zinc/78/76/37/1033787637.db2.gz GHAMQURGSXAQQK-SMDDNHRTSA-N -1 1 340.261 4.196 20 0 EIADMM C[C@@H]1CN(c2ccccc2NCc2cccc([O-])c2Cl)C[C@@H](C)O1 ZINC000645145953 1033840617 /nfs/dbraw/zinc/84/06/17/1033840617.db2.gz UGRWRVWTORJWBX-ZIAGYGMSSA-N -1 1 346.858 4.271 20 0 EIADMM CCOc1cc2c(cc1NCc1cccc([O-])c1Cl)O[C@H](C)C2 ZINC000645166631 1033950892 /nfs/dbraw/zinc/95/08/92/1033950892.db2.gz NBQCJGNLDBUNPD-LLVKDONJSA-N -1 1 333.815 4.380 20 0 EIADMM CCc1noc(C)c1[N-]C(=O)c1coc(-c2ccccc2Cl)n1 ZINC000345272656 1035172532 /nfs/dbraw/zinc/17/25/32/1035172532.db2.gz SNNMKYHGCFAZTO-UHFFFAOYSA-N -1 1 331.759 4.106 20 0 EIADMM Cc1cc(C)c([N-]S(=O)(=O)c2ccccc2C(C)(C)C)c(C)n1 ZINC000414454519 1035585500 /nfs/dbraw/zinc/58/55/00/1035585500.db2.gz GGHNCXPOCDVHCK-UHFFFAOYSA-N -1 1 332.469 4.105 20 0 EIADMM [O-]c1ccc(-c2nc(-c3ccc(C(F)(F)F)s3)no2)c(F)c1 ZINC000904973981 1035692973 /nfs/dbraw/zinc/69/29/73/1035692973.db2.gz ZYUKNUCDMFLWOR-UHFFFAOYSA-N -1 1 330.262 4.329 20 0 EIADMM O=C(Nc1nc(-c2cc3ccccc3o2)n[nH]1)c1ccccc1Cl ZINC000485106576 1035708897 /nfs/dbraw/zinc/70/88/97/1035708897.db2.gz LJIZUYWKHWGBFI-UHFFFAOYSA-N -1 1 338.754 4.124 20 0 EIADMM CCOc1cc(C(=O)N2Cc3ccccc3[C@H](C)C2)cc(Cl)c1[O-] ZINC000913412022 1035715213 /nfs/dbraw/zinc/71/52/13/1035715213.db2.gz AJGNGSQUVOBYHA-GFCCVEGCSA-N -1 1 345.826 4.204 20 0 EIADMM CCC(=O)c1cccc(S(=O)(=O)[N-]c2c(CC)cccc2CC)c1 ZINC000195654097 1035877874 /nfs/dbraw/zinc/87/78/74/1035877874.db2.gz IHLGZHRVXCHNPY-UHFFFAOYSA-N -1 1 345.464 4.205 20 0 EIADMM COc1cc([C@@H](C)NCc2cc(C)c(C(=O)[O-])o2)cc2ccccc21 ZINC000905797639 1035894916 /nfs/dbraw/zinc/89/49/16/1035894916.db2.gz FYCNAWFZXYUVIJ-CYBMUJFWSA-N -1 1 339.391 4.299 20 0 EIADMM Cc1csc(-c2cccc([N-]S(=O)(=O)c3cccc(F)c3)c2)n1 ZINC000588077657 1036204858 /nfs/dbraw/zinc/20/48/58/1036204858.db2.gz GKDZXLBZIGNHQS-UHFFFAOYSA-N -1 1 348.424 4.058 20 0 EIADMM Cc1nc(-c2ccc(C(=O)Nc3c([O-])cccc3F)cc2)cs1 ZINC000669612406 1036227835 /nfs/dbraw/zinc/22/78/35/1036227835.db2.gz PCUSFACBJIJWJO-UHFFFAOYSA-N -1 1 328.368 4.216 20 0 EIADMM CSc1cccc(C)c1[N-]S(=O)(=O)c1ccc(C(F)F)cc1 ZINC000572276575 1036484397 /nfs/dbraw/zinc/48/43/97/1036484397.db2.gz UPOWARMQRWSRQG-UHFFFAOYSA-N -1 1 343.420 4.455 20 0 EIADMM Cc1ccc(C(=O)Nc2cccc([O-])c2Br)c(C(C)C)n1 ZINC000908708404 1036921414 /nfs/dbraw/zinc/92/14/14/1036921414.db2.gz VDEVDFPQQZTQLW-UHFFFAOYSA-N -1 1 349.228 4.234 20 0 EIADMM O=C([O-])CC[C@H]1CCCN(Cc2ncc(-c3cccc(Cl)c3)o2)C1 ZINC000261854598 1037052074 /nfs/dbraw/zinc/05/20/74/1037052074.db2.gz JUOUSFQQMYCQIP-CYBMUJFWSA-N -1 1 348.830 4.072 20 0 EIADMM Cc1cccc(OCCCCC(=O)Nc2cc([O-])c(F)cc2F)c1 ZINC000909976513 1037222171 /nfs/dbraw/zinc/22/21/71/1037222171.db2.gz ARIVUFZTXRKFHN-UHFFFAOYSA-N -1 1 335.350 4.167 20 0 EIADMM O=C(Nc1ccc2nc(C(F)F)[nH]c2c1)c1c([O-])cccc1Cl ZINC000760810550 1037295487 /nfs/dbraw/zinc/29/54/87/1037295487.db2.gz SSHJUGRZJQVUMC-UHFFFAOYSA-N -1 1 337.713 4.112 20 0 EIADMM CCc1ccccc1S(=O)(=O)[N-]c1ccc(CC(F)(F)F)cc1 ZINC000488283872 1037476827 /nfs/dbraw/zinc/47/68/27/1037476827.db2.gz XVKKPZFHRYCUIF-UHFFFAOYSA-N -1 1 343.370 4.155 20 0 EIADMM Cc1cc(O[C@H](C)C(=O)Nc2c([O-])cccc2F)ccc1C(C)C ZINC000605438399 1037787913 /nfs/dbraw/zinc/78/79/13/1037787913.db2.gz SYUTUIBRTZPORB-CYBMUJFWSA-N -1 1 331.387 4.369 20 0 EIADMM CC(C)c1cc(C(=O)[N-]c2cc(F)cc(Br)c2F)on1 ZINC000489368821 1037996250 /nfs/dbraw/zinc/99/62/50/1037996250.db2.gz HBTDJWDQDXXCJE-UHFFFAOYSA-N -1 1 345.143 4.091 20 0 EIADMM O=c1ccn(-c2ccc(Nc3cccc(OCC(F)(F)F)c3)cc2)[n-]1 ZINC001212173959 1038122999 /nfs/dbraw/zinc/12/29/99/1038122999.db2.gz XLBDUYXRDRHYAP-UHFFFAOYSA-N -1 1 349.312 4.263 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2ccc3c(cnn3C(C)C)c2)c(C)c1 ZINC000489739705 1038228205 /nfs/dbraw/zinc/22/82/05/1038228205.db2.gz PAYCTKFLYXKQGU-UHFFFAOYSA-N -1 1 343.452 4.035 20 0 EIADMM COc1cc(C)c(S(=O)(=O)[N-]c2ccccc2C(F)F)cc1C ZINC000424062798 1038485534 /nfs/dbraw/zinc/48/55/34/1038485534.db2.gz HVSDEYNVIHYENE-UHFFFAOYSA-N -1 1 341.379 4.050 20 0 EIADMM CCCOc1ccc(S(=O)(=O)[N-]c2ccccc2C(F)F)cc1 ZINC000424061459 1038485554 /nfs/dbraw/zinc/48/55/54/1038485554.db2.gz FNRDVHXEKNOPDQ-UHFFFAOYSA-N -1 1 341.379 4.214 20 0 EIADMM CSCc1ccc([N-]S(=O)(=O)c2cccc(Cl)c2)cc1 ZINC000608955620 1038989161 /nfs/dbraw/zinc/98/91/61/1038989161.db2.gz FWMMLXIKNLUMNU-UHFFFAOYSA-N -1 1 327.858 4.004 20 0 EIADMM Cc1nc(-c2ccc(N3CCC[C@@H](C(C)(C)C)C3)nc2)[n-]c(=O)c1C ZINC000481055813 1038995818 /nfs/dbraw/zinc/99/58/18/1038995818.db2.gz IICSRMIVMKKPLK-MRXNPFEDSA-N -1 1 340.471 4.124 20 0 EIADMM CCOc1ccc(F)c([N-]C(=O)c2coc(-c3ccccc3)n2)c1F ZINC000534035214 1039041638 /nfs/dbraw/zinc/04/16/38/1039041638.db2.gz RBRFCJXUFPMOSH-UHFFFAOYSA-N -1 1 344.317 4.271 20 0 EIADMM CC[C@H](CC(=O)Nc1ccc([O-])c(F)c1F)c1ccc(OC)cc1 ZINC000456786211 1039604041 /nfs/dbraw/zinc/60/40/41/1039604041.db2.gz OCULCMDRBMWPIR-LLVKDONJSA-N -1 1 335.350 4.201 20 0 EIADMM CC[C@H](C)c1ccccc1OCC(=O)Nc1ccc([O-])c(F)c1F ZINC000456793773 1039611149 /nfs/dbraw/zinc/61/11/49/1039611149.db2.gz OLWFDSCLTPVIKX-NSHDSACASA-N -1 1 335.350 4.201 20 0 EIADMM Cc1ccc(OCCCC(=O)Nc2ccc([O-])c(F)c2F)c(C)c1 ZINC000456791544 1039612969 /nfs/dbraw/zinc/61/29/69/1039612969.db2.gz YJWYZTQOCCDCTF-UHFFFAOYSA-N -1 1 335.350 4.085 20 0 EIADMM COc1cc([N-]S(=O)(=O)c2ccc3ccccc3c2)c(C)cc1C ZINC000478701483 1039877291 /nfs/dbraw/zinc/87/72/91/1039877291.db2.gz IGZJMXCFMRGYDJ-UHFFFAOYSA-N -1 1 341.432 4.266 20 0 EIADMM CC(C)c1cccc(S(=O)(=O)[N-]c2ccc(-c3ncc[nH]3)cc2)c1 ZINC000476931481 1040021515 /nfs/dbraw/zinc/02/15/15/1040021515.db2.gz XJGNVHRAFDEIEP-UHFFFAOYSA-N -1 1 341.436 4.001 20 0 EIADMM COc1cc(C(=O)N2C[C@H](C)C[C@H]2c2ccccc2)cc(Cl)c1[O-] ZINC000553337672 1040145856 /nfs/dbraw/zinc/14/58/56/1040145856.db2.gz RMEYYGNPJBKMFW-WBMJQRKESA-N -1 1 345.826 4.278 20 0 EIADMM [O-]c1cccc(CN2CC[C@@H](O)[C@H]2c2ccc(Cl)cc2)c1Cl ZINC000425365498 1040337680 /nfs/dbraw/zinc/33/76/80/1040337680.db2.gz LAXCNSZVIXBWOB-NVXWUHKLSA-N -1 1 338.234 4.007 20 0 EIADMM Cc1nc(-c2ccc(N[C@@H]3CC[C@@H]3c3ccccc3)nc2)[n-]c(=O)c1C ZINC000664486909 1040374989 /nfs/dbraw/zinc/37/49/89/1040374989.db2.gz FMVUKWXVHHIVTN-QZTJIDSGSA-N -1 1 346.434 4.219 20 0 EIADMM Cc1ccc(C)c(C(=O)Nc2cc(C)cc(Br)c2[O-])c1 ZINC000482632528 1040397220 /nfs/dbraw/zinc/39/72/20/1040397220.db2.gz CGBYPSQRAIZXED-UHFFFAOYSA-N -1 1 334.213 4.332 20 0 EIADMM CCOc1cc(C(=O)N[C@H]2CC[C@H](CC)CC2)cc(Cl)c1[O-] ZINC000479593396 1040512491 /nfs/dbraw/zinc/51/24/91/1040512491.db2.gz PSSRNURZARUPNT-AULYBMBSSA-N -1 1 325.836 4.143 20 0 EIADMM Cc1cc(Br)c([O-])c(NC(=O)[C@@H](C)c2ccccc2)c1 ZINC000477490092 1040540057 /nfs/dbraw/zinc/54/00/57/1040540057.db2.gz FBLAFZKXLGTNMI-NSHDSACASA-N -1 1 334.213 4.205 20 0 EIADMM [O-]c1ccc(-c2noc(C3(c4cccc(F)c4)CC3)n2)c(Cl)c1 ZINC000445450844 1040768726 /nfs/dbraw/zinc/76/87/26/1040768726.db2.gz XJDKBRMNKBPWIO-UHFFFAOYSA-N -1 1 330.746 4.315 20 0 EIADMM CCCc1ccc(S(=O)(=O)[N-]c2cc3[nH]ccc3cc2C)cc1 ZINC000436152969 1040907196 /nfs/dbraw/zinc/90/71/96/1040907196.db2.gz NWRQXUPPQLQJPF-UHFFFAOYSA-N -1 1 328.437 4.230 20 0 EIADMM Cc1c(CSC(C)C)cccc1[N-]S(=O)(=O)c1ccccc1 ZINC000460823362 1040961424 /nfs/dbraw/zinc/96/14/24/1040961424.db2.gz QAUZVJJZZVDHFY-UHFFFAOYSA-N -1 1 335.494 4.437 20 0 EIADMM CC(C)(C)c1ccccc1S(=O)(=O)[N-]c1cc(F)c(F)c(F)c1 ZINC000460839904 1040982878 /nfs/dbraw/zinc/98/28/78/1040982878.db2.gz XUAAHYTXUJMYQC-UHFFFAOYSA-N -1 1 343.370 4.202 20 0 EIADMM CCCOc1ccc([N-]S(=O)(=O)c2cccc(Cl)c2)c(C)c1 ZINC000515699216 1041003651 /nfs/dbraw/zinc/00/36/51/1041003651.db2.gz GSLHMFBHCQMPEU-UHFFFAOYSA-N -1 1 339.844 4.238 20 0 EIADMM COc1ccc(CCCCC(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000554433086 1041114523 /nfs/dbraw/zinc/11/45/23/1041114523.db2.gz RUBXNKIXWYKQKD-UHFFFAOYSA-N -1 1 333.815 4.406 20 0 EIADMM O=C(Nc1ccc2oc3ccccc3c2c1)C(=O)c1ccc([O-])cc1 ZINC000554447043 1041135471 /nfs/dbraw/zinc/13/54/71/1041135471.db2.gz GTVLSNOHBCNJSQ-UHFFFAOYSA-N -1 1 331.327 4.113 20 0 EIADMM CSCC1CCN([C@H](C(=O)[O-])c2ccc(Cl)c(Cl)c2)CC1 ZINC000903915982 1041230758 /nfs/dbraw/zinc/23/07/58/1041230758.db2.gz GNMCJTRTUYFXER-AWEZNQCLSA-N -1 1 348.295 4.194 20 0 EIADMM CN(Cc1cccc(C(F)(F)F)c1)C(=O)c1cc(Cl)ccc1[O-] ZINC000436485552 1041285292 /nfs/dbraw/zinc/28/52/92/1041285292.db2.gz IHJOGWNZIOJADM-UHFFFAOYSA-N -1 1 343.732 4.337 20 0 EIADMM O=C([O-])C[C@@H](NCc1cnc(C2CCCC2)s1)c1ccccc1F ZINC000904046235 1041301676 /nfs/dbraw/zinc/30/16/76/1041301676.db2.gz XVYTYQDWOJLFJP-MRXNPFEDSA-N -1 1 348.443 4.245 20 0 EIADMM CCCCN(C(=O)c1cc(Cl)c([O-])c(OCC)c1)[C@@H](C)CC ZINC000436523471 1041308419 /nfs/dbraw/zinc/30/84/19/1041308419.db2.gz SWCMWQFWRWZYTH-LBPRGKRZSA-N -1 1 327.852 4.485 20 0 EIADMM C[C@H]1C[C@@H](c2ccc(F)cc2)CN1C(=O)c1ccc(Cl)cc1[O-] ZINC000436536506 1041319907 /nfs/dbraw/zinc/31/99/07/1041319907.db2.gz MOARQGDRSDEJOV-WCQYABFASA-N -1 1 333.790 4.203 20 0 EIADMM CCCC[C@H]1CCC[C@@H]1NC(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC000436552235 1041328791 /nfs/dbraw/zinc/32/87/91/1041328791.db2.gz BLYLGJLCNVFVFH-FZMZJTMJSA-N -1 1 325.836 4.143 20 0 EIADMM C[C@H](CC(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)c1ccc(F)cc1 ZINC000515994140 1041333344 /nfs/dbraw/zinc/33/33/44/1041333344.db2.gz CMJKQBKEHZZUTD-GFCCVEGCSA-N -1 1 339.370 4.054 20 0 EIADMM Cn1cccc1[C@H]1CCCCN1C(=O)c1cc2ccccc2cc1[O-] ZINC000436576849 1041342309 /nfs/dbraw/zinc/34/23/09/1041342309.db2.gz RNIPATSSMZWKAQ-LJQANCHMSA-N -1 1 334.419 4.251 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1Cc2ccccc2C2(CC2)C1 ZINC000436561243 1041342899 /nfs/dbraw/zinc/34/28/99/1041342899.db2.gz FEUUPYAAMVKKLT-UHFFFAOYSA-N -1 1 329.399 4.233 20 0 EIADMM COc1cc(-c2nc3cc(Cl)ccc3c(=O)[nH]2)cc(Cl)c1[O-] ZINC000436597954 1041354702 /nfs/dbraw/zinc/35/47/02/1041354702.db2.gz XQRGQNOTBSJOFY-UHFFFAOYSA-N -1 1 337.162 4.023 20 0 EIADMM O=C(c1cc(F)ccc1[O-])N1CCCC[C@@H]1c1ccc(F)cc1F ZINC000436599805 1041357811 /nfs/dbraw/zinc/35/78/11/1041357811.db2.gz CGDRVRCIWVVXEG-MRXNPFEDSA-N -1 1 335.325 4.177 20 0 EIADMM C[C@@]1(CCc2ccccc2)CCN(C(=O)c2cc(F)ccc2[O-])C1 ZINC000436585761 1041361528 /nfs/dbraw/zinc/36/15/28/1041361528.db2.gz QOLWQFWQSBNJTD-HXUWFJFHSA-N -1 1 327.399 4.016 20 0 EIADMM CC(C)c1ccc(C(=O)Nc2cccc(Oc3cccnn3)c2)c([O-])c1 ZINC000436588135 1041365658 /nfs/dbraw/zinc/36/56/58/1041365658.db2.gz HFGYYXUPZPUPGK-UHFFFAOYSA-N -1 1 349.390 4.350 20 0 EIADMM C[C@@H]([C@H]1Cc2ccccc2O1)N(C)C(=O)c1ccc2ccccc2c1[O-] ZINC000436609840 1041369840 /nfs/dbraw/zinc/36/98/40/1041369840.db2.gz WPDCLCYPRZIVIH-VBKZILBWSA-N -1 1 347.414 4.010 20 0 EIADMM C[C@@H]([C@H]1Cc2ccccc2O1)N(C)C(=O)c1cc2ccccc2cc1[O-] ZINC000436609207 1041371346 /nfs/dbraw/zinc/37/13/46/1041371346.db2.gz VRHAVKUAADJBFI-LHSJRXKWSA-N -1 1 347.414 4.010 20 0 EIADMM CCC(C)(C)[C@@H]1CCCN1C(=O)c1ccc(Br)cc1[O-] ZINC000436611228 1041372345 /nfs/dbraw/zinc/37/23/45/1041372345.db2.gz ZGBJKAJYEZRWJL-AWEZNQCLSA-N -1 1 340.261 4.196 20 0 EIADMM C[C@@H](Oc1ccccc1NC(=O)c1ccc(O)cc1[O-])c1ccccc1 ZINC000436624239 1041377177 /nfs/dbraw/zinc/37/71/77/1041377177.db2.gz IYXIVQZMVZNWFV-CQSZACIVSA-N -1 1 349.386 4.490 20 0 EIADMM C[C@H](C1CCCCC1)N(C)C(=O)c1cc(Br)ccc1[O-] ZINC000436635913 1041382724 /nfs/dbraw/zinc/38/27/24/1041382724.db2.gz PIPDHEXRUFRXEL-LLVKDONJSA-N -1 1 340.261 4.196 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N1CCC(Cc2ccc(F)cc2)CC1 ZINC000436622713 1041390703 /nfs/dbraw/zinc/39/07/03/1041390703.db2.gz FCAQLHINUKSWIR-UHFFFAOYSA-N -1 1 347.817 4.280 20 0 EIADMM Cc1nc2cc([N-]S(=O)(=O)c3ccc(CC(C)C)cc3)ccc2o1 ZINC000516102401 1041394608 /nfs/dbraw/zinc/39/46/08/1041394608.db2.gz GKEQBUDQDHHVKD-UHFFFAOYSA-N -1 1 344.436 4.136 20 0 EIADMM O=C(Nc1cccc(COC2CCCCC2)c1)c1ccc(O)cc1[O-] ZINC000436666532 1041406206 /nfs/dbraw/zinc/40/62/06/1041406206.db2.gz UITAUQXMBOTDAF-UHFFFAOYSA-N -1 1 341.407 4.199 20 0 EIADMM CC(C)c1ccc(C(=O)Nc2nc(C3CCOCC3)cs2)c([O-])c1 ZINC000436696979 1041427205 /nfs/dbraw/zinc/42/72/05/1041427205.db2.gz KNTBKKHZZGKBBX-UHFFFAOYSA-N -1 1 346.452 4.118 20 0 EIADMM Cc1[nH]nc(-c2ccccc2)c1NC(=O)c1ccc(C(C)C)cc1[O-] ZINC000436702325 1041433632 /nfs/dbraw/zinc/43/36/32/1041433632.db2.gz CPTAUJJMBOQOMO-UHFFFAOYSA-N -1 1 335.407 4.466 20 0 EIADMM O=C(C(=O)N1CCCCC[C@@H]1/C=C/c1ccccc1)c1ccc([O-])cc1 ZINC000436704463 1041435478 /nfs/dbraw/zinc/43/54/78/1041435478.db2.gz PBYMNVYKUDGSQV-YFPIXMDGSA-N -1 1 349.430 4.060 20 0 EIADMM O=C(c1cc(F)ccc1[O-])N1C[C@H](c2ccccc2)[C@@H]2CCCC[C@H]21 ZINC000436704236 1041435649 /nfs/dbraw/zinc/43/56/49/1041435649.db2.gz GMMGQJITKYKACC-QXAKKESOSA-N -1 1 339.410 4.330 20 0 EIADMM CN(Cc1ccc(Cl)c(F)c1)C(=O)c1ccc(Cl)cc1[O-] ZINC000436712425 1041439606 /nfs/dbraw/zinc/43/96/06/1041439606.db2.gz ARNWEESAGDSLFJ-UHFFFAOYSA-N -1 1 328.170 4.110 20 0 EIADMM O=C(NC12CCC(C(F)(F)F)(CC1)CC2)c1cc(Cl)ccc1[O-] ZINC000436715656 1041440794 /nfs/dbraw/zinc/44/07/94/1041440794.db2.gz LWHUSGKKPCXIRM-UHFFFAOYSA-N -1 1 347.764 4.431 20 0 EIADMM O=C(Nc1ccc(-c2csnn2)cc1)c1cc2ccccc2cc1[O-] ZINC000436718865 1041441084 /nfs/dbraw/zinc/44/10/84/1041441084.db2.gz XSMDTANCDDOKEV-UHFFFAOYSA-N -1 1 347.399 4.316 20 0 EIADMM COc1ccc(C(=O)Nc2cnn(CCC(C)C)c2C(C)C)c([O-])c1 ZINC000436740530 1041448622 /nfs/dbraw/zinc/44/86/22/1041448622.db2.gz RHILEGSISDEWSU-UHFFFAOYSA-N -1 1 345.443 4.019 20 0 EIADMM O=C(c1ccc(C(F)(F)F)cc1[O-])N1CCC[C@H]1Cc1ccccc1 ZINC000436763913 1041459844 /nfs/dbraw/zinc/45/98/44/1041459844.db2.gz NGWPPSXCUZLWLL-HNNXBMFYSA-N -1 1 349.352 4.258 20 0 EIADMM C[C@@H](NC(=O)c1ccc([O-])cc1F)c1ccc(F)c2ccccc21 ZINC000436748805 1041461573 /nfs/dbraw/zinc/46/15/73/1041461573.db2.gz HHNBNTKLSXDEEA-LLVKDONJSA-N -1 1 327.330 4.315 20 0 EIADMM CN(Cc1ccccc1Cl)C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436750899 1041463875 /nfs/dbraw/zinc/46/38/75/1041463875.db2.gz ILDJQTPFAFNJDY-UHFFFAOYSA-N -1 1 343.732 4.337 20 0 EIADMM C[C@@H]1C[C@@H](c2ccccc2)CN1C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436752920 1041465690 /nfs/dbraw/zinc/46/56/90/1041465690.db2.gz SQOWIQXKAWKXNR-TZMCWYRMSA-N -1 1 349.352 4.429 20 0 EIADMM C[C@H](c1ccc(C(F)(F)F)cc1)N(C)C(=O)c1cc(F)ccc1[O-] ZINC000436757216 1041466505 /nfs/dbraw/zinc/46/65/05/1041466505.db2.gz HNCPTGZJKKSCAM-SNVBAGLBSA-N -1 1 341.304 4.383 20 0 EIADMM C[C@H](CCCC(F)(F)F)NC(=O)c1ccc2ccccc2c1[O-] ZINC000436812615 1041493359 /nfs/dbraw/zinc/49/33/59/1041493359.db2.gz BHPTZFVFVAVERX-LLVKDONJSA-N -1 1 325.330 4.396 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1C[C@@H]2CCCN2c2ccccc21 ZINC000538745100 1041521268 /nfs/dbraw/zinc/52/12/68/1041521268.db2.gz SFJLFBKDOZBKFL-INIZCTEOSA-N -1 1 344.414 4.175 20 0 EIADMM Cc1ccc(C(=O)CCCc2nc(-c3ccc([O-])cc3F)no2)cc1 ZINC000436869416 1041527172 /nfs/dbraw/zinc/52/71/72/1041527172.db2.gz AGRATDBTBBPELM-UHFFFAOYSA-N -1 1 340.354 4.095 20 0 EIADMM CCOc1cc(-c2noc(-c3c(C)coc3C)n2)cc(Cl)c1[O-] ZINC000436867378 1041527427 /nfs/dbraw/zinc/52/74/27/1041527427.db2.gz BTIJMCPLWHBTEO-UHFFFAOYSA-N -1 1 334.759 4.371 20 0 EIADMM Cc1nc(CC2CC2)sc1-c1nc(-c2ccc([O-])cc2Cl)no1 ZINC000436869219 1041528152 /nfs/dbraw/zinc/52/81/52/1041528152.db2.gz MHRKGKCYCBVXMD-UHFFFAOYSA-N -1 1 347.827 4.480 20 0 EIADMM [O-]c1ccc(-c2noc([C@H]3CCCc4c(O)cccc43)n2)c(Cl)c1 ZINC000436870163 1041528600 /nfs/dbraw/zinc/52/86/00/1041528600.db2.gz PJDQKXHSBBIWSM-ZDUSSCGKSA-N -1 1 342.782 4.269 20 0 EIADMM Cc1ccc2c(c1)CC[C@H](c1nc(-c3ccc([O-])cc3Cl)no1)O2 ZINC000436869882 1041528784 /nfs/dbraw/zinc/52/87/84/1041528784.db2.gz FPAWCMUICXLQHI-MRXNPFEDSA-N -1 1 342.782 4.470 20 0 EIADMM C[C@H](Cc1nc(-c2ccc([O-])cc2F)no1)c1c[nH]c2ccccc21 ZINC000436876625 1041535762 /nfs/dbraw/zinc/53/57/62/1041535762.db2.gz AJBDKMNEMBSLJH-LLVKDONJSA-N -1 1 337.354 4.409 20 0 EIADMM [O-]c1ccc(-c2noc(/C=C/c3cc(F)c(F)c(F)c3)n2)cc1F ZINC000436880890 1041538801 /nfs/dbraw/zinc/53/88/01/1041538801.db2.gz UHBKPDQDOKQUCQ-DAFODLJHSA-N -1 1 336.244 4.169 20 0 EIADMM COc1ccc(N(CCC(C)C)C(=O)c2cc(F)ccc2[O-])cc1 ZINC000436906620 1041546589 /nfs/dbraw/zinc/54/65/89/1041546589.db2.gz DSMQWQRRXHAUJZ-UHFFFAOYSA-N -1 1 331.387 4.233 20 0 EIADMM O=C(c1cc(F)ccc1[O-])N1CCC[C@@H](c2ccc(F)cc2)CC1 ZINC000436907299 1041546884 /nfs/dbraw/zinc/54/68/84/1041546884.db2.gz SEBRLDGEGVVXKN-CYBMUJFWSA-N -1 1 331.362 4.080 20 0 EIADMM CSc1ccc([O-])c(-c2nc(-c3nccc4ccccc43)no2)c1 ZINC000904592557 1041548062 /nfs/dbraw/zinc/54/80/62/1041548062.db2.gz VAULWAHNYODHND-UHFFFAOYSA-N -1 1 335.388 4.379 20 0 EIADMM CC(=O)Nc1ccc([O-])c(-c2nc(-c3cccc4ccccc43)no2)c1 ZINC000436896198 1041551136 /nfs/dbraw/zinc/55/11/36/1041551136.db2.gz MCOUAZKXHUIJNS-UHFFFAOYSA-N -1 1 345.358 4.221 20 0 EIADMM [O-]c1c(-c2nc(-c3ccc4c(c3)OCCO4)no2)ccc2ccccc21 ZINC000436900919 1041553375 /nfs/dbraw/zinc/55/33/75/1041553375.db2.gz FIOKYPUMLABMEC-UHFFFAOYSA-N -1 1 346.342 4.034 20 0 EIADMM O=C([O-])c1ccc2nc(/C=C/c3cc(F)c(O)c(F)c3)sc2c1 ZINC000436915626 1041556306 /nfs/dbraw/zinc/55/63/06/1041556306.db2.gz RGZSKCHCGHZSEE-DAFODLJHSA-N -1 1 333.315 4.149 20 0 EIADMM CC[C@@H]1CN(C(=O)c2c(F)ccc([O-])c2F)CC[C@H]1c1ccccc1 ZINC000540586807 1041556618 /nfs/dbraw/zinc/55/66/18/1041556618.db2.gz RKQWIZAJPDNIPB-UKRRQHHQSA-N -1 1 345.389 4.326 20 0 EIADMM O=C(c1cc(F)ccc1[O-])N1CCC(c2cccc(Cl)c2)CC1 ZINC000436922814 1041558909 /nfs/dbraw/zinc/55/89/09/1041558909.db2.gz QIBSVVFQHMWXCV-UHFFFAOYSA-N -1 1 333.790 4.205 20 0 EIADMM CCCN(C(=O)c1ccc(Cl)cc1[O-])[C@H]1CCCc2cccnc21 ZINC000436956319 1041575378 /nfs/dbraw/zinc/57/53/78/1041575378.db2.gz QFQDNXZRZLZGHK-INIZCTEOSA-N -1 1 344.842 4.370 20 0 EIADMM CC[C@H](C)Oc1cccc(NC(=O)c2cc(Cl)c([O-])c(OC)c2)c1 ZINC000436993182 1041583692 /nfs/dbraw/zinc/58/36/92/1041583692.db2.gz ZHMBIHKXSDBQCH-NSHDSACASA-N -1 1 349.814 4.484 20 0 EIADMM Cc1ccc([C@@H]2CCN(C(=O)c3cc4ccccc4cc3[O-])C2)cc1 ZINC000541506767 1041974548 /nfs/dbraw/zinc/97/45/48/1041974548.db2.gz AMEWXWNGJJCHCY-LJQANCHMSA-N -1 1 331.415 4.484 20 0 EIADMM CCC(C)(C)OCc1ccccc1[N-]S(=O)(=O)c1ccccc1 ZINC000541805608 1042124464 /nfs/dbraw/zinc/12/44/64/1042124464.db2.gz ZHGOMLRIRYCBAM-UHFFFAOYSA-N -1 1 333.453 4.193 20 0 EIADMM CN(CCC1CCCCC1)C(=O)c1cc(Br)ccc1[O-] ZINC000303157689 1042330542 /nfs/dbraw/zinc/33/05/42/1042330542.db2.gz SNZPMUDJMMMTST-UHFFFAOYSA-N -1 1 340.261 4.197 20 0 EIADMM Cc1c(F)cccc1S(=O)(=O)[N-]c1ccc(CC(F)(F)F)cc1 ZINC000438761905 1042336920 /nfs/dbraw/zinc/33/69/20/1042336920.db2.gz SZBWHNHFBRIZBI-UHFFFAOYSA-N -1 1 347.333 4.040 20 0 EIADMM CC[C@@H](c1nnc(NC(=O)c2ccccc2[O-])s1)c1ccccc1 ZINC000303283140 1042389753 /nfs/dbraw/zinc/38/97/53/1042389753.db2.gz JEUYKSPAKYICHK-CYBMUJFWSA-N -1 1 339.420 4.038 20 0 EIADMM CCOc1ccc(S(=O)(=O)[N-]c2ccccc2)c2ccccc12 ZINC000003149456 1042846714 /nfs/dbraw/zinc/84/67/14/1042846714.db2.gz AMHSZUQEKYUXNN-UHFFFAOYSA-N -1 1 327.405 4.039 20 0 EIADMM Cc1coc(-c2cc([N-]S(=O)(=O)c3cccc(C)c3)ccc2C)n1 ZINC000178147288 1042859197 /nfs/dbraw/zinc/85/91/97/1042859197.db2.gz CTVJHDZDBABOLE-UHFFFAOYSA-N -1 1 342.420 4.068 20 0 EIADMM Cc1ccc(F)c(C(=O)Nc2cc(C)cc(Br)c2[O-])c1 ZINC000182904739 1043035104 /nfs/dbraw/zinc/03/51/04/1043035104.db2.gz APHMBFXROMLYAV-UHFFFAOYSA-N -1 1 338.176 4.163 20 0 EIADMM CSc1ccc(C(=O)Nc2cc(C)cc(Br)c2[O-])o1 ZINC000182919893 1043035703 /nfs/dbraw/zinc/03/57/03/1043035703.db2.gz BLDRPBGUCGMIAV-UHFFFAOYSA-N -1 1 342.214 4.030 20 0 EIADMM Cc1cc(Br)c([O-])c(NC(=O)c2ccc3[nH]ccc3c2)c1 ZINC000182934355 1043035958 /nfs/dbraw/zinc/03/59/58/1043035958.db2.gz BHIYEVGUSADMSD-UHFFFAOYSA-N -1 1 345.196 4.197 20 0 EIADMM Cc1cc(C(=O)Nc2ccc([O-])c(Cl)c2)c(Br)s1 ZINC000509165451 1043156206 /nfs/dbraw/zinc/15/62/06/1043156206.db2.gz JYLDSIXOJDXNQW-UHFFFAOYSA-N -1 1 346.633 4.430 20 0 EIADMM CC[C@H](O[C@H]1CCC[C@@H](C)C1)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000509167239 1043158374 /nfs/dbraw/zinc/15/83/74/1043158374.db2.gz DCNANQXAVWYVAL-FFSVYQOJSA-N -1 1 325.836 4.358 20 0 EIADMM [O-]c1cccnc1-c1nc(-c2ccc(Oc3ccc(F)cc3)cc2)no1 ZINC001212481032 1043435650 /nfs/dbraw/zinc/43/56/50/1043435650.db2.gz WJZYWQQHQSPDIJ-UHFFFAOYSA-N -1 1 349.321 4.436 20 0 EIADMM O=C(OCc1ccc(Cl)nc1)c1ccc(Cl)c(Cl)c1[O-] ZINC000730362823 1043499099 /nfs/dbraw/zinc/49/90/99/1043499099.db2.gz WUUXZWIMGOHTMM-UHFFFAOYSA-N -1 1 332.570 4.104 20 0 EIADMM O=C(COC(=O)c1ccc(Cl)c(Cl)c1[O-])C1CCCCC1 ZINC000730359698 1043503275 /nfs/dbraw/zinc/50/32/75/1043503275.db2.gz MHMDIRAQIKRKNS-UHFFFAOYSA-N -1 1 331.195 4.005 20 0 EIADMM O=C(/C=C\c1ccc(Br)o1)Nc1ccc([O-])c(Cl)c1 ZINC000701130708 1043699195 /nfs/dbraw/zinc/69/91/95/1043699195.db2.gz IRWBISRNZHNICX-UTCJRWHESA-N -1 1 342.576 4.053 20 0 EIADMM O=C(Nc1ccc(OC(F)F)cc1)Nc1ccc([O-])c(Cl)c1 ZINC000190920930 1043751270 /nfs/dbraw/zinc/75/12/70/1043751270.db2.gz BFWDYNYBSZVVHJ-UHFFFAOYSA-N -1 1 328.702 4.291 20 0 EIADMM Cc1cc(C)c(NC(=O)c2ccc([O-])c(F)c2)cc1Br ZINC000681639133 1043764540 /nfs/dbraw/zinc/76/45/40/1043764540.db2.gz IGQLGCCLSCKRJY-UHFFFAOYSA-N -1 1 338.176 4.163 20 0 EIADMM CCOc1cc(C)ccc1NC(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC000442733160 1043818635 /nfs/dbraw/zinc/81/86/35/1043818635.db2.gz YORMHOWTWPOGPF-UHFFFAOYSA-N -1 1 335.787 4.014 20 0 EIADMM CCCOc1ccc(S(=O)(=O)[N-]c2ccc3ccoc3c2)cc1 ZINC000442840429 1043863067 /nfs/dbraw/zinc/86/30/67/1043863067.db2.gz WRLMZVRFEYBLDF-UHFFFAOYSA-N -1 1 331.393 4.022 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1ccc(OCC(F)(F)F)cc1 ZINC000732306600 1043894911 /nfs/dbraw/zinc/89/49/11/1043894911.db2.gz HBEJFXDMUXZYAH-UHFFFAOYSA-N -1 1 345.704 4.239 20 0 EIADMM COc1cc(C(=O)N(CCC(C)C)C2CCCC2)cc(Cl)c1[O-] ZINC000442947572 1043913453 /nfs/dbraw/zinc/91/34/53/1043913453.db2.gz VEEUEJCYIBUGKI-UHFFFAOYSA-N -1 1 339.863 4.485 20 0 EIADMM COc1cc(C(=O)N2C[C@@H](c3ccccc3)C[C@@H]2C)cc(Cl)c1[O-] ZINC000442981948 1043948798 /nfs/dbraw/zinc/94/87/98/1043948798.db2.gz WKQAKNHWOQWYKT-WFASDCNBSA-N -1 1 345.826 4.072 20 0 EIADMM COc1cc(C(=O)N2C[C@@H](c3ccccc3)C[C@H]2C)cc(Cl)c1[O-] ZINC000442981945 1043949629 /nfs/dbraw/zinc/94/96/29/1043949629.db2.gz WKQAKNHWOQWYKT-DOMZBBRYSA-N -1 1 345.826 4.072 20 0 EIADMM CCC(C)(C)[C@@H]1CCCN1C(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC000443058379 1043995454 /nfs/dbraw/zinc/99/54/54/1043995454.db2.gz KLEQXJUTZJCAPK-AWEZNQCLSA-N -1 1 325.836 4.095 20 0 EIADMM CCOc1cc(C(=O)N(Cc2ccccc2)C2CC2)cc(Cl)c1[O-] ZINC000193074119 1043998109 /nfs/dbraw/zinc/99/81/09/1043998109.db2.gz LWJFSIGJQVOBID-UHFFFAOYSA-N -1 1 345.826 4.249 20 0 EIADMM O=C([N-]c1cc(-c2ccccc2F)no1)c1cc(-c2ccccc2)no1 ZINC000732831033 1044019436 /nfs/dbraw/zinc/01/94/36/1044019436.db2.gz ZFVHUADNZNAYDV-UHFFFAOYSA-N -1 1 349.321 4.388 20 0 EIADMM COc1cc(-c2nc([C@@H]3CCCCS3)no2)cc(Cl)c1[O-] ZINC000443195649 1044081860 /nfs/dbraw/zinc/08/18/60/1044081860.db2.gz SGKVMCXIWGEVAZ-NSHDSACASA-N -1 1 326.805 4.062 20 0 EIADMM COc1cc(-c2nc([C@@H](C)c3cccs3)no2)cc(Cl)c1[O-] ZINC000443202224 1044091860 /nfs/dbraw/zinc/09/18/60/1044091860.db2.gz JRUYUOYQAZEMLD-QMMMGPOBSA-N -1 1 336.800 4.318 20 0 EIADMM COc1cc(C(=O)N2CC[C@H](c3ccccc3)[C@H]2C)cc(Cl)c1[O-] ZINC000443302007 1044165760 /nfs/dbraw/zinc/16/57/60/1044165760.db2.gz OCZSDARFNGTFBH-DOMZBBRYSA-N -1 1 345.826 4.072 20 0 EIADMM CN(C(=O)c1ccc(NC(=O)OC(C)(C)C)cc1[O-])C1CCCCC1 ZINC000093911624 1044427741 /nfs/dbraw/zinc/42/77/41/1044427741.db2.gz SHCISSDEBFFDAM-UHFFFAOYSA-N -1 1 348.443 4.144 20 0 EIADMM C=Cc1ccc(CCNC(=O)c2cc(Cl)c([O-])c(OCC)c2)cc1 ZINC000428289025 1044718190 /nfs/dbraw/zinc/71/81/90/1044718190.db2.gz ROXZPPMEKQYQJY-UHFFFAOYSA-N -1 1 345.826 4.060 20 0 EIADMM O=C([O-])C[C@H](NCc1cc(Cl)sc1Cl)c1cccs1 ZINC000312582850 1044828278 /nfs/dbraw/zinc/82/82/78/1044828278.db2.gz NHVVDPQKDRICHZ-QMMMGPOBSA-N -1 1 336.265 4.422 20 0 EIADMM COc1ccc(Cl)c(NC(=O)c2cc3ccccc3cc2[O-])c1 ZINC000390886940 1044898515 /nfs/dbraw/zinc/89/85/15/1044898515.db2.gz WRQIEWJDLCKXMG-UHFFFAOYSA-N -1 1 327.767 4.460 20 0 EIADMM Cc1cc(N2CCCC[C@@H]2C)ccc1NC(=O)c1cc(F)ccc1[O-] ZINC001137540917 1045181824 /nfs/dbraw/zinc/18/18/24/1045181824.db2.gz ZHBNVZSNCUGUCV-AWEZNQCLSA-N -1 1 342.414 4.471 20 0 EIADMM CC[C@H]([N-]C(=O)C(F)(F)c1ccc(F)cc1)c1cc(F)ccc1F ZINC000740799542 1045224268 /nfs/dbraw/zinc/22/42/68/1045224268.db2.gz PYCLIKUFDBIFMY-HNNXBMFYSA-N -1 1 343.295 4.463 20 0 EIADMM CCOc1cc(C(=O)NCC(CC)(CC)SC)cc(Cl)c1[O-] ZINC000762610882 1045312198 /nfs/dbraw/zinc/31/21/98/1045312198.db2.gz FOZOISCQSKPABL-UHFFFAOYSA-N -1 1 345.892 4.096 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1CCC(c2ccc(O)cc2)CC1 ZINC000055234311 1045675307 /nfs/dbraw/zinc/67/53/07/1045675307.db2.gz WUWPPUKPBBXKAN-UHFFFAOYSA-N -1 1 347.414 4.271 20 0 EIADMM COc1ccc(C(=O)Nc2nc(C)c(-c3ccccc3)s2)c([O-])c1 ZINC000029913309 1045973561 /nfs/dbraw/zinc/97/35/61/1045973561.db2.gz FLTMLSITLIEVQP-UHFFFAOYSA-N -1 1 340.404 4.085 20 0 EIADMM C[C@@H]1CO[C@@H](c2ccccc2)[C@H](C)N1C(=O)c1c([O-])cccc1Cl ZINC000769812865 1046080317 /nfs/dbraw/zinc/08/03/17/1046080317.db2.gz UJQODZKQSPJMEC-FHSNZYRGSA-N -1 1 345.826 4.036 20 0 EIADMM COc1cc(NCc2cccc([O-])c2Cl)ccc1Br ZINC000328429372 1046129832 /nfs/dbraw/zinc/12/98/32/1046129832.db2.gz ASORLYNIKUCNFY-UHFFFAOYSA-N -1 1 342.620 4.429 20 0 EIADMM CSc1cccc(C)c1[N-]C(=O)c1scnc1Br ZINC000770192126 1046156028 /nfs/dbraw/zinc/15/60/28/1046156028.db2.gz FGYWKOCOVWQCSF-UHFFFAOYSA-N -1 1 343.271 4.188 20 0 EIADMM CN(CCC(=O)[O-])Cc1nc(-c2cc(Cl)ccc2Cl)cs1 ZINC000263410025 1046281561 /nfs/dbraw/zinc/28/15/61/1046281561.db2.gz LCMUUWSFPJUEBE-UHFFFAOYSA-N -1 1 345.251 4.023 20 0 EIADMM CC(C)(C)C[C@H]([N-]C(=O)C(F)(F)Cc1ccccc1)C(F)(F)F ZINC000793779074 1046339489 /nfs/dbraw/zinc/33/94/89/1046339489.db2.gz FOGPKYPYXGXJNX-LBPRGKRZSA-N -1 1 337.332 4.348 20 0 EIADMM Cc1ccccc1[C@@H]1CN(Cc2cccc([O-])c2Cl)[C@@H](C)CO1 ZINC000508708466 1046351717 /nfs/dbraw/zinc/35/17/17/1046351717.db2.gz AUJUOJMCOPSAPZ-KSSFIOAISA-N -1 1 331.843 4.316 20 0 EIADMM COc1cccc(SC)c1[N-]C(=O)c1cc(Br)co1 ZINC001129824223 1046741993 /nfs/dbraw/zinc/74/19/93/1046741993.db2.gz REZYGGKHEIWNDL-UHFFFAOYSA-N -1 1 342.214 4.025 20 0 EIADMM Cc1cnc(Cl)c([N-]S(=O)(=O)c2ccc(C(C)(C)C)s2)c1 ZINC000786880800 1046882128 /nfs/dbraw/zinc/88/21/28/1046882128.db2.gz PANPEFQRJBJOLC-UHFFFAOYSA-N -1 1 344.889 4.203 20 0 EIADMM CCc1onc(C)c1CSc1nc(-c2ccccc2)c(C)c(=O)[n-]1 ZINC000917469705 1046909308 /nfs/dbraw/zinc/90/93/08/1046909308.db2.gz WTIUCYCGEHYKSI-UHFFFAOYSA-N -1 1 341.436 4.309 20 0 EIADMM C[C@H]1[C@H](Cc2ccccc2)CCN1C(=O)c1c([O-])cccc1Cl ZINC000746693144 1047029271 /nfs/dbraw/zinc/02/92/71/1047029271.db2.gz BRBQGNWRNYNFAY-ZFWWWQNUSA-N -1 1 329.827 4.139 20 0 EIADMM Cc1ccc(F)cc1[N-]S(=O)(=O)c1ccc(OC2CCCC2)cc1 ZINC000917716922 1047073779 /nfs/dbraw/zinc/07/37/79/1047073779.db2.gz LFKMFFKRFDJVMO-UHFFFAOYSA-N -1 1 349.427 4.256 20 0 EIADMM O=C(N[C@@H](c1ccccc1)C1CCCCC1)C(=O)c1ccc([O-])cc1 ZINC000806457880 1047265323 /nfs/dbraw/zinc/26/53/23/1047265323.db2.gz BVHPHQDCCRGMPK-IBGZPJMESA-N -1 1 337.419 4.013 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc3oc(C4CC4)nc3c2)cc1C ZINC000032097212 1047305989 /nfs/dbraw/zinc/30/59/89/1047305989.db2.gz HJNBEAMMFROJOL-UHFFFAOYSA-N -1 1 342.420 4.123 20 0 EIADMM Cc1nc(-c2ccccc2)ccc1C(=O)Nc1nc(Cl)ccc1[O-] ZINC000789930470 1047486604 /nfs/dbraw/zinc/48/66/04/1047486604.db2.gz PYRADTVYNHIGSI-UHFFFAOYSA-N -1 1 339.782 4.063 20 0 EIADMM COc1cc(NCc2cccc([O-])c2Cl)c(OC)cc1Cl ZINC000328077425 1047538233 /nfs/dbraw/zinc/53/82/33/1047538233.db2.gz BAPDWMATIPTJAD-UHFFFAOYSA-N -1 1 328.195 4.328 20 0 EIADMM O=C(Nc1cc(F)cc(F)c1[O-])c1cccc(Oc2nccs2)c1 ZINC001142542833 1047603238 /nfs/dbraw/zinc/60/32/38/1047603238.db2.gz VIGFLFHUSUBUNB-UHFFFAOYSA-N -1 1 348.330 4.172 20 0 EIADMM CC(C)c1ccccc1S(=O)(=O)[N-]c1ccc([C@H]2CCOC2)cc1 ZINC000556266474 1047644756 /nfs/dbraw/zinc/64/47/56/1047644756.db2.gz AETBDWBDRXVKGI-INIZCTEOSA-N -1 1 345.464 4.115 20 0 EIADMM CC(C)c1cc([N-]S(=O)(=O)c2cc(C(C)C)ccc2Cl)[nH]n1 ZINC000556303455 1047662107 /nfs/dbraw/zinc/66/21/07/1047662107.db2.gz URUCHWZMTXCUGB-UHFFFAOYSA-N -1 1 341.864 4.111 20 0 EIADMM CC(C)c1ccc(Cl)c(S(=O)(=O)[N-]c2cccc(O)c2F)c1 ZINC000556347002 1047691710 /nfs/dbraw/zinc/69/17/10/1047691710.db2.gz RPOOXXFVUATZIF-UHFFFAOYSA-N -1 1 343.807 4.109 20 0 EIADMM C[C@@H](Sc1nc(C(F)(F)F)cc(=O)[n-]1)c1ncc(C(C)(C)C)o1 ZINC000476461256 1047819789 /nfs/dbraw/zinc/81/97/89/1047819789.db2.gz OGBFUDUAZUHMHU-SSDOTTSWSA-N -1 1 347.362 4.340 20 0 EIADMM C[C@H]1c2ccc(Cl)n2CCN1C(=O)c1cc2ccccc2cc1[O-] ZINC000808250728 1047847391 /nfs/dbraw/zinc/84/73/91/1047847391.db2.gz TYHSUPSELXZNET-LBPRGKRZSA-N -1 1 340.810 4.217 20 0 EIADMM O=C(Nc1cc(F)ccc1SCC(F)F)c1ccc(F)c([O-])c1 ZINC001136921966 1047899859 /nfs/dbraw/zinc/89/98/59/1047899859.db2.gz SRFLOXNXIBBJLI-UHFFFAOYSA-N -1 1 345.317 4.280 20 0 EIADMM O=C(c1ccc2ccc(O)cc2c1[O-])N(CC1CC1)C1CCCCC1 ZINC001143696668 1048158543 /nfs/dbraw/zinc/15/85/43/1048158543.db2.gz MMMDCOFHTMDIKP-UHFFFAOYSA-N -1 1 339.435 4.436 20 0 EIADMM Cc1ccc2cccc(NC(=O)Cc3ccc([O-])c(Cl)c3)c2n1 ZINC001143704171 1048164499 /nfs/dbraw/zinc/16/44/99/1048164499.db2.gz ZBWVYJICXALIIX-UHFFFAOYSA-N -1 1 326.783 4.083 20 0 EIADMM Cc1ccc(C[N-]C(=O)C(F)(F)c2cc(Cl)ccc2Cl)o1 ZINC001131601795 1048276087 /nfs/dbraw/zinc/27/60/87/1048276087.db2.gz QKQHPBPIONPKIM-UHFFFAOYSA-N -1 1 334.149 4.303 20 0 EIADMM C[C@@H]1CN(c2ccc(NCc3cccc([O-])c3Cl)cc2)C[C@@H](C)O1 ZINC000815130390 1048341197 /nfs/dbraw/zinc/34/11/97/1048341197.db2.gz FGXDOUPZLWJWJY-ZIAGYGMSSA-N -1 1 346.858 4.271 20 0 EIADMM COc1ccc([C@@H]2CCN(C(=O)c3ccc4ccccc4c3[O-])C2)cc1 ZINC000132987068 1048556158 /nfs/dbraw/zinc/55/61/58/1048556158.db2.gz UVDGOKVKFPHBRW-QGZVFWFLSA-N -1 1 347.414 4.184 20 0 EIADMM CC1(c2cc([N-]C(=O)c3c(F)c(F)cc(F)c3F)no2)CCCC1 ZINC001135373851 1048691673 /nfs/dbraw/zinc/69/16/73/1048691673.db2.gz QVWPSOAUTXJZPK-UHFFFAOYSA-N -1 1 342.292 4.315 20 0 EIADMM [O-]c1cc(F)c(CN(Cc2ccccc2)Cc2cccnc2)c(F)c1 ZINC001144554887 1048724046 /nfs/dbraw/zinc/72/40/46/1048724046.db2.gz LBKVEYHHFONUKL-UHFFFAOYSA-N -1 1 340.373 4.268 20 0 EIADMM [O-]c1cc(F)c(CN2CCC[C@@H]2c2cc(F)cc(F)c2)cc1F ZINC001144664104 1048780558 /nfs/dbraw/zinc/78/05/58/1048780558.db2.gz VLWOQWHIMKUMNC-MRXNPFEDSA-N -1 1 325.305 4.286 20 0 EIADMM CCC[C@@H](C(=O)c1ccccc1)N(C)Cc1cc(F)c([O-])cc1F ZINC001144663837 1048781839 /nfs/dbraw/zinc/78/18/39/1048781839.db2.gz KVCLSCPCLJFCTH-KRWDZBQOSA-N -1 1 333.378 4.154 20 0 EIADMM CC(C)c1ccc(CN(C(=O)c2ccc([O-])c(F)c2)C2CC2)cc1 ZINC001135649579 1048840554 /nfs/dbraw/zinc/84/05/54/1048840554.db2.gz KJJZHVVDFVLAEN-UHFFFAOYSA-N -1 1 327.399 4.460 20 0 EIADMM CC(C)c1ccc(CN(C(=O)c2cccc([O-])c2F)C2CC2)cc1 ZINC001135649462 1048840872 /nfs/dbraw/zinc/84/08/72/1048840872.db2.gz FHJUGPZRHBYPKH-UHFFFAOYSA-N -1 1 327.399 4.460 20 0 EIADMM CC[C@@H](C)N(Cc1ccccc1)C(=O)c1ncc2ccccc2c1[O-] ZINC001144752156 1048843410 /nfs/dbraw/zinc/84/34/10/1048843410.db2.gz GFCAJMFKKJZBFH-OAHLLOKOSA-N -1 1 334.419 4.381 20 0 EIADMM COc1cccc([C@H]2CCCN2C(=O)c2cc(Cl)ccc2[O-])c1 ZINC001135937646 1048997266 /nfs/dbraw/zinc/99/72/66/1048997266.db2.gz VYZBFWXCTFQVIP-MRXNPFEDSA-N -1 1 331.799 4.032 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1CCSC[C@H]1c1ccccc1 ZINC001146848297 1049066146 /nfs/dbraw/zinc/06/61/46/1049066146.db2.gz SFRPSABMRYSFCI-IBGZPJMESA-N -1 1 349.455 4.476 20 0 EIADMM Cc1cccnc1[C@H](NC(=O)c1ccc2ccccc2c1[O-])C(C)C ZINC001147035404 1049078651 /nfs/dbraw/zinc/07/86/51/1049078651.db2.gz VFPHEQPYJAGDRT-GOSISDBHSA-N -1 1 334.419 4.376 20 0 EIADMM O=C(Nc1ccccc1SCC(F)(F)F)c1cccc([O-])c1F ZINC001136136277 1049147277 /nfs/dbraw/zinc/14/72/77/1049147277.db2.gz HONFMOPCMMYRIO-UHFFFAOYSA-N -1 1 345.317 4.438 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1cc(-c2ccc(F)cc2)on1 ZINC000135425569 1049169835 /nfs/dbraw/zinc/16/98/35/1049169835.db2.gz YWVXSHORFBSDLS-UHFFFAOYSA-N -1 1 332.718 4.092 20 0 EIADMM CCN(Cc1ccc(Cl)cc1)C(=O)c1ncc2ccccc2c1[O-] ZINC001136184945 1049258293 /nfs/dbraw/zinc/25/82/93/1049258293.db2.gz IKMAXZAKSOXLJP-UHFFFAOYSA-N -1 1 340.810 4.256 20 0 EIADMM O=C(Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)[C@@H]1CCC[C@@H]2CCCC[C@H]12 ZINC001136190949 1049269091 /nfs/dbraw/zinc/26/90/91/1049269091.db2.gz UMGWVPYWNCWPOM-RRQGHBQHSA-N -1 1 339.439 4.327 20 0 EIADMM O=C(Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)[C@@H]1CCC[C@H]2CCCC[C@H]21 ZINC001136190948 1049270085 /nfs/dbraw/zinc/27/00/85/1049270085.db2.gz UMGWVPYWNCWPOM-KBRIMQKVSA-N -1 1 339.439 4.327 20 0 EIADMM Cc1ccc([C@@H]2C[C@H](C)CCN2C(=O)Cc2ccc([O-])c(Cl)c2)o1 ZINC001148223365 1049282725 /nfs/dbraw/zinc/28/27/25/1049282725.db2.gz DBJGGPXDJFBDNM-WBMJQRKESA-N -1 1 347.842 4.489 20 0 EIADMM Cc1c(Cl)nccc1[N-]S(=O)(=O)c1ccc(C(C)(C)C)cc1 ZINC000811836315 1049285915 /nfs/dbraw/zinc/28/59/15/1049285915.db2.gz NWTNGANSLSDIEZ-UHFFFAOYSA-N -1 1 338.860 4.142 20 0 EIADMM C[C@@H](NC(=O)c1cccc([O-])c1F)c1ccccc1C(F)(F)F ZINC001148256887 1049287862 /nfs/dbraw/zinc/28/78/62/1049287862.db2.gz JRYUQDTWQBXJMI-SECBINFHSA-N -1 1 327.277 4.041 20 0 EIADMM C[C@@](O)(C(=O)Nc1cc(Cl)c([O-])c2ccccc12)c1ccccc1 ZINC001148252475 1049288488 /nfs/dbraw/zinc/28/84/88/1049288488.db2.gz KBSQBDRMZRBLIO-IBGZPJMESA-N -1 1 341.794 4.045 20 0 EIADMM O=C(c1c([O-])cnc2c(F)cccc21)N1CCCC[C@H]1CC1CCC1 ZINC001148513465 1049323923 /nfs/dbraw/zinc/32/39/23/1049323923.db2.gz VVCFGXIWXYBSFZ-AWEZNQCLSA-N -1 1 342.414 4.264 20 0 EIADMM C[C@@H]1c2ccccc2CCN1C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC001148790229 1049371386 /nfs/dbraw/zinc/37/13/86/1049371386.db2.gz JCEUKSFOMRCRQL-LLVKDONJSA-N -1 1 335.325 4.171 20 0 EIADMM O=C(/C=C/c1ccco1)Nc1c([O-])cc(Br)cc1Cl ZINC000819786902 1049376429 /nfs/dbraw/zinc/37/64/29/1049376429.db2.gz GMBAXTSWIWWYDD-ONEGZZNKSA-N -1 1 342.576 4.053 20 0 EIADMM CC(C)c1nsc([N-]C(=O)c2cc(-c3ccccc3)ns2)n1 ZINC001133192574 1049384137 /nfs/dbraw/zinc/38/41/37/1049384137.db2.gz KEZKVLPULNYZCM-UHFFFAOYSA-N -1 1 330.438 4.037 20 0 EIADMM O=C(Nc1ccc2n[nH]cc2c1)c1cccc(-c2ccccc2)c1[O-] ZINC001148861128 1049390389 /nfs/dbraw/zinc/39/03/89/1049390389.db2.gz MNBXEJRNYWFSNH-UHFFFAOYSA-N -1 1 329.359 4.188 20 0 EIADMM Cc1cccnc1CCCNC(=O)c1cccc(-c2ccccc2)c1[O-] ZINC001148861726 1049391781 /nfs/dbraw/zinc/39/17/81/1049391781.db2.gz VNNZNLCJZHWJJK-UHFFFAOYSA-N -1 1 346.430 4.125 20 0 EIADMM O=C([N-]c1cscc1Cl)c1cc(-c2ccc3c(c2)CCO3)no1 ZINC001133289820 1049462141 /nfs/dbraw/zinc/46/21/41/1049462141.db2.gz DGSNWXWQUXMTKJ-UHFFFAOYSA-N -1 1 346.795 4.244 20 0 EIADMM CC1(C)CN(C(=O)c2ccc3ccc(O)cc3c2[O-])[C@@H]1c1ccccc1 ZINC001136401289 1049586227 /nfs/dbraw/zinc/58/62/27/1049586227.db2.gz NXWLHIKCWKLECL-HXUWFJFHSA-N -1 1 347.414 4.474 20 0 EIADMM C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)Nc1cccc(F)c1[O-] ZINC001171637690 1049778814 /nfs/dbraw/zinc/77/88/14/1049778814.db2.gz PTOIGVJIFSPPEW-QMMMGPOBSA-N -1 1 344.169 4.244 20 0 EIADMM CC[C@@H](c1cccc(OC)c1)N(C)C(=O)c1c([O-])cccc1Cl ZINC000813817994 1049819430 /nfs/dbraw/zinc/81/94/30/1049819430.db2.gz IRJOMAKICNLEPZ-HNNXBMFYSA-N -1 1 333.815 4.278 20 0 EIADMM O=C(N[C@@H](c1ccc(Cl)cc1)C1CCC1)c1ccc([O-])c(F)c1 ZINC001136712538 1049842584 /nfs/dbraw/zinc/84/25/84/1049842584.db2.gz FVAPDYGEYWRLMJ-QGZVFWFLSA-N -1 1 333.790 4.456 20 0 EIADMM CC(C)(C)CCCCNC(=O)c1cc(Br)ccc1[O-] ZINC001136720265 1049846897 /nfs/dbraw/zinc/84/68/97/1049846897.db2.gz IOTJKOSGPSMCMH-UHFFFAOYSA-N -1 1 328.250 4.101 20 0 EIADMM Cc1ccccc1[C@H](NC(=O)c1cncc([O-])c1)[C@H]1CCC[C@H](C)C1 ZINC001136731654 1049856548 /nfs/dbraw/zinc/85/65/48/1049856548.db2.gz DEWOABJJNXZISF-DKICVRJWSA-N -1 1 338.451 4.393 20 0 EIADMM CSc1c(F)cccc1[N-]C(=O)c1cnc([C@H]2CCCO2)s1 ZINC000617274742 1049973913 /nfs/dbraw/zinc/97/39/13/1049973913.db2.gz HPFHKAWOBGKKIA-LLVKDONJSA-N -1 1 338.429 4.108 20 0 EIADMM O=C(NCc1ccc(C(F)(F)F)cc1)Nc1cc(F)cc(F)c1[O-] ZINC000168981262 1050085970 /nfs/dbraw/zinc/08/59/70/1050085970.db2.gz CYLNGUKSEDNAKV-UHFFFAOYSA-N -1 1 346.255 4.011 20 0 EIADMM CC1CCC(C[N-]S(=O)(=O)c2cc(Cl)sc2Cl)CC1 ZINC001185909009 1050186903 /nfs/dbraw/zinc/18/69/03/1050186903.db2.gz PLVSFQVEFCYVQZ-UHFFFAOYSA-N -1 1 342.313 4.160 20 0 EIADMM O=C(c1ccc([O-])c(F)c1)N1CCC2(CCCc3ccccc32)CC1 ZINC001186209182 1050271640 /nfs/dbraw/zinc/27/16/40/1050271640.db2.gz PVGPODLLDQOXCC-UHFFFAOYSA-N -1 1 339.410 4.042 20 0 EIADMM O=S(=O)([N-]CCCCCc1ccccc1)c1sccc1Cl ZINC001186508242 1050347106 /nfs/dbraw/zinc/34/71/06/1050347106.db2.gz WNIZDOLUKCIRFX-UHFFFAOYSA-N -1 1 343.901 4.093 20 0 EIADMM O=C(NCc1ccc(C(F)(F)F)cc1)Nc1c(F)cc([O-])cc1F ZINC001186817007 1050424860 /nfs/dbraw/zinc/42/48/60/1050424860.db2.gz YFJMSIPVDUTKDP-UHFFFAOYSA-N -1 1 346.255 4.011 20 0 EIADMM [O-]c1cnccc1-c1nc(-c2cc(Cl)ccc2C(F)(F)F)no1 ZINC001212721439 1050431651 /nfs/dbraw/zinc/43/16/51/1050431651.db2.gz QPMMAPJGKNKBLO-UHFFFAOYSA-N -1 1 341.676 4.176 20 0 EIADMM Cc1ccc(-c2ccccc2-c2noc(-c3ccncc3[O-])n2)cc1 ZINC001212721486 1050434324 /nfs/dbraw/zinc/43/43/24/1050434324.db2.gz SOHBHGPDYGLAKV-UHFFFAOYSA-N -1 1 329.359 4.480 20 0 EIADMM Cc1cc(C(=O)N(C)C)ccc1Nc1ccc(Cl)c(Cl)c1[O-] ZINC001212733514 1050458164 /nfs/dbraw/zinc/45/81/64/1050458164.db2.gz YXDMWEFFFJNGDS-UHFFFAOYSA-N -1 1 339.222 4.453 20 0 EIADMM CC(C)c1cccc(CC(=O)Nc2cccc(C(F)(F)F)c2[O-])n1 ZINC001178450301 1050462302 /nfs/dbraw/zinc/46/23/02/1050462302.db2.gz CATLDSTYOKGELX-UHFFFAOYSA-N -1 1 338.329 4.111 20 0 EIADMM O=S(=O)([N-]c1ccc(Cl)cc1F)c1cc2c(s1)CCCC2 ZINC001187206697 1050507011 /nfs/dbraw/zinc/50/70/11/1050507011.db2.gz IDYXNKQATDCYGA-UHFFFAOYSA-N -1 1 345.848 4.220 20 0 EIADMM CC(C)(CCC(=O)NCCc1c(F)cc([O-])cc1F)c1ccccc1 ZINC001178785003 1050553725 /nfs/dbraw/zinc/55/37/25/1050553725.db2.gz MQZYNMFXHVIIJS-UHFFFAOYSA-N -1 1 347.405 4.087 20 0 EIADMM O=C(Nc1cccc(C(F)(F)F)c1[O-])c1cc(C(F)(F)F)c[nH]1 ZINC001187702497 1050600518 /nfs/dbraw/zinc/60/05/18/1050600518.db2.gz JDANSGPCWXMUEI-UHFFFAOYSA-N -1 1 338.207 4.010 20 0 EIADMM Cc1ccc(N)cc1S(=O)(=O)[N-]c1cccc(-c2ccccc2)c1 ZINC001173911260 1050622980 /nfs/dbraw/zinc/62/29/80/1050622980.db2.gz GHTGQPHYQDBHTA-UHFFFAOYSA-N -1 1 338.432 4.045 20 0 EIADMM Cc1cc(CO)cc(Nc2cc(Br)cc(Cl)c2[O-])c1 ZINC001212759686 1050655196 /nfs/dbraw/zinc/65/51/96/1050655196.db2.gz UPERZWCQNHMUBT-UHFFFAOYSA-N -1 1 342.620 4.352 20 0 EIADMM CN(C)C(=O)c1ccc(Nc2cc(Cl)cc(Cl)c2[O-])cc1 ZINC001174008210 1050679118 /nfs/dbraw/zinc/67/91/18/1050679118.db2.gz ULGGKVRKMRFWMB-UHFFFAOYSA-N -1 1 325.195 4.144 20 0 EIADMM COc1ccc(OC)c(OC)c1Nc1ccc(Cl)c(Cl)c1[O-] ZINC001174055713 1050694848 /nfs/dbraw/zinc/69/48/48/1050694848.db2.gz NFUMYWZUHWOEMW-UHFFFAOYSA-N -1 1 344.194 4.468 20 0 EIADMM Cc1cc(NC(=O)c2ncc(C(F)(F)F)[n-]2)cc(C(F)(F)F)c1 ZINC001188288169 1050743586 /nfs/dbraw/zinc/74/35/86/1050743586.db2.gz MEVQLZVRUNKSHK-UHFFFAOYSA-N -1 1 337.223 4.008 20 0 EIADMM Cc1cc(NC(=O)c2nc(C(F)(F)F)c[n-]2)cc(C(F)(F)F)c1 ZINC001188288169 1050743600 /nfs/dbraw/zinc/74/36/00/1050743600.db2.gz MEVQLZVRUNKSHK-UHFFFAOYSA-N -1 1 337.223 4.008 20 0 EIADMM CC(C)CNC(=O)c1ccc(Nc2cc([O-])c(Cl)cc2F)cc1 ZINC001174079171 1050753173 /nfs/dbraw/zinc/75/31/73/1050753173.db2.gz MWVPWXVXBSDWFP-UHFFFAOYSA-N -1 1 336.794 4.314 20 0 EIADMM O=C(Nc1ccccc1-c1cc[nH]n1)c1ccc([O-])c(C(F)(F)F)c1 ZINC001188589038 1050811312 /nfs/dbraw/zinc/81/13/12/1050811312.db2.gz LOJJBVBTPLJYCW-UHFFFAOYSA-N -1 1 347.296 4.053 20 0 EIADMM O=C(Nc1cc(O)cc(Cl)c1)c1ccc([O-])c(C(F)(F)F)c1 ZINC001188588678 1050811567 /nfs/dbraw/zinc/81/15/67/1050811567.db2.gz FYUZSAFQADXXKC-UHFFFAOYSA-N -1 1 331.677 4.022 20 0 EIADMM CCOc1cccc([N-]S(=O)(=O)c2ccc(F)c3ccccc32)c1 ZINC001189386507 1050978042 /nfs/dbraw/zinc/97/80/42/1050978042.db2.gz YYEHGRFSOJQTSD-UHFFFAOYSA-N -1 1 345.395 4.178 20 0 EIADMM Cc1cnc(SCc2cc(F)c(C(F)(F)F)cc2F)[n-]c1=O ZINC001189399492 1050984543 /nfs/dbraw/zinc/98/45/43/1050984543.db2.gz RVUYKNBBMODOEG-UHFFFAOYSA-N -1 1 336.285 4.080 20 0 EIADMM Nc1ccc(Nc2cc(Br)cc(Cl)c2[O-])c(F)c1 ZINC001174483225 1050992244 /nfs/dbraw/zinc/99/22/44/1050992244.db2.gz GTSVYJOHPUJOGL-UHFFFAOYSA-N -1 1 331.572 4.273 20 0 EIADMM Cc1csc([N-]S(=O)(=O)Cc2ccccc2C(F)(F)F)c1 ZINC001189501138 1051000678 /nfs/dbraw/zinc/00/06/78/1051000678.db2.gz KQSFURBOYVFMIJ-UHFFFAOYSA-N -1 1 335.372 4.017 20 0 EIADMM CNc1ncc2cc(Nc3c(Cl)ccc([O-])c3Cl)ccc2n1 ZINC001174535522 1051029739 /nfs/dbraw/zinc/02/97/39/1051029739.db2.gz VOIRIVDWIGGYKJ-UHFFFAOYSA-N -1 1 335.194 4.428 20 0 EIADMM [O-]c1cc(Cl)c(Nc2ccc(N3CCOCC3)cc2)cc1Cl ZINC001174708490 1051141157 /nfs/dbraw/zinc/14/11/57/1051141157.db2.gz CCNDGALVPHMBOC-UHFFFAOYSA-N -1 1 339.222 4.279 20 0 EIADMM O=C(Nc1ccccc1C(F)F)c1cnc(-c2ccccc2)[n-]c1=O ZINC001190269567 1051142347 /nfs/dbraw/zinc/14/23/47/1051142347.db2.gz FUADUKFQJUMBNK-UHFFFAOYSA-N -1 1 341.317 4.039 20 0 EIADMM CCC(C)(C)c1ccc(S(=O)(=O)[N-]c2ccc3ncoc3c2)cc1 ZINC001190422477 1051181529 /nfs/dbraw/zinc/18/15/29/1051181529.db2.gz DOBUGECILOCOPC-UHFFFAOYSA-N -1 1 344.436 4.316 20 0 EIADMM O=S(=O)([N-]c1ccc(C2CCC2)nc1)c1ccc(C2CC2)cc1 ZINC001190471355 1051193479 /nfs/dbraw/zinc/19/34/79/1051193479.db2.gz FVROFDRQYAVUFB-UHFFFAOYSA-N -1 1 328.437 4.027 20 0 EIADMM COc1cc(C(=O)N2CCC[C@H]2C2CCCCC2)cc(Cl)c1[O-] ZINC000153616545 1051202407 /nfs/dbraw/zinc/20/24/07/1051202407.db2.gz QMQJPEGTBQOTPI-HNNXBMFYSA-N -1 1 337.847 4.239 20 0 EIADMM COc1cc(C(=O)Nc2cccc([C@H](C)OC)c2)cc(Cl)c1[O-] ZINC000153733159 1051219947 /nfs/dbraw/zinc/21/99/47/1051219947.db2.gz OAAQYYLPZFSTCG-JTQLQIEISA-N -1 1 335.787 4.014 20 0 EIADMM CC[C@@H](CC(C)C)C(=O)Nc1cc(OC)cc(Br)c1[O-] ZINC001181829656 1051324336 /nfs/dbraw/zinc/32/43/36/1051324336.db2.gz BAGWQVPZUUNYJG-JTQLQIEISA-N -1 1 344.249 4.174 20 0 EIADMM CCCCc1ccc(S(=O)(=O)[N-]c2ccc(C(=O)CC)cc2)cc1 ZINC001191254567 1051395441 /nfs/dbraw/zinc/39/54/41/1051395441.db2.gz XFXADLJASYWUMM-UHFFFAOYSA-N -1 1 345.464 4.423 20 0 EIADMM CCCCc1ccc(S(=O)(=O)[N-]c2ccc3onc(C)c3c2)cc1 ZINC001191248780 1051410591 /nfs/dbraw/zinc/41/05/91/1051410591.db2.gz IWRAUEDUOZISHJ-UHFFFAOYSA-N -1 1 344.436 4.280 20 0 EIADMM CC1(C)CCC(C)(C[N-]S(=O)(=O)c2ccc(C(F)F)o2)CC1 ZINC001191394089 1051439507 /nfs/dbraw/zinc/43/95/07/1051439507.db2.gz FXXLGWQFBDDHMA-UHFFFAOYSA-N -1 1 335.416 4.102 20 0 EIADMM C[C@H]1CCC[C@H](C)N1C(=O)c1ccccc1C(=O)c1ccc([O-])cc1 ZINC001191487708 1051466699 /nfs/dbraw/zinc/46/66/99/1051466699.db2.gz JNBBGKWNJJYTJW-GJZGRUSLSA-N -1 1 337.419 4.026 20 0 EIADMM CC[C@@H](C)C[C@H](C)NC(=O)c1ccccc1C(=O)c1ccc([O-])cc1 ZINC001191511169 1051471527 /nfs/dbraw/zinc/47/15/27/1051471527.db2.gz YKMOLNMTCPOZAS-CABCVRRESA-N -1 1 339.435 4.178 20 0 EIADMM CC(=O)c1cccc(Br)c1Nc1c(F)ccc([O-])c1F ZINC001175270708 1051509040 /nfs/dbraw/zinc/50/90/40/1051509040.db2.gz HWGMWJSSGHUKNU-UHFFFAOYSA-N -1 1 342.139 4.379 20 0 EIADMM COc1ncc(Nc2c(Cl)ccc(Br)c2[O-])s1 ZINC001175393621 1051569310 /nfs/dbraw/zinc/56/93/10/1051569310.db2.gz UOVKWUHHCHRJKQ-UHFFFAOYSA-N -1 1 335.610 4.017 20 0 EIADMM [O-]c1c(Cl)cc(Br)cc1Nc1cccc2c[nH]nc21 ZINC001175640067 1051687023 /nfs/dbraw/zinc/68/70/23/1051687023.db2.gz YZSKOYOLKZODGB-UHFFFAOYSA-N -1 1 338.592 4.428 20 0 EIADMM CC(C)(C)c1ccc(C(=O)Nc2ccc(-c3ccncn3)cc2)c([O-])c1 ZINC001192322817 1051689925 /nfs/dbraw/zinc/68/99/25/1051689925.db2.gz PGAOAFHVLDYFQM-UHFFFAOYSA-N -1 1 347.418 4.399 20 0 EIADMM CCCC[C@H](CC)COCCCNC(=O)c1c(F)ccc([O-])c1F ZINC001192551921 1051755592 /nfs/dbraw/zinc/75/55/92/1051755592.db2.gz IPSGTZGFSCVOGQ-ZDUSSCGKSA-N -1 1 343.414 4.023 20 0 EIADMM O=C(Nc1cc(-c2cccc(F)c2)ccn1)c1cc([O-])cc(F)c1F ZINC001192652169 1051781450 /nfs/dbraw/zinc/78/14/50/1051781450.db2.gz VWBIUEWFZHCRJP-UHFFFAOYSA-N -1 1 344.292 4.124 20 0 EIADMM O=C(Nc1ccc(-c2cccc(O)c2)cc1)c1cc([O-])cc(F)c1F ZINC001192670188 1051787582 /nfs/dbraw/zinc/78/75/82/1051787582.db2.gz FMRKPOJFLZEWJJ-UHFFFAOYSA-N -1 1 341.313 4.295 20 0 EIADMM CC(C)[C@H](C(=O)Nc1nc(Cl)ccc1[O-])c1cccc(Cl)c1 ZINC001183209794 1051811791 /nfs/dbraw/zinc/81/17/91/1051811791.db2.gz NHNFJXRNHAADPS-AWEZNQCLSA-N -1 1 339.222 4.472 20 0 EIADMM O=C(CCc1ccc(Cl)cc1Cl)Nc1nc(Cl)ccc1[O-] ZINC001183210700 1051812626 /nfs/dbraw/zinc/81/26/26/1051812626.db2.gz VVQLWLGOWCTACJ-UHFFFAOYSA-N -1 1 345.613 4.319 20 0 EIADMM O=c1oc2cc([O-])ccc2cc1Nc1ccc(-c2cccnc2)cc1 ZINC001175886795 1051814399 /nfs/dbraw/zinc/81/43/99/1051814399.db2.gz UXMVVEYCPZZFIV-UHFFFAOYSA-N -1 1 330.343 4.304 20 0 EIADMM C[C@H](NC(=O)c1ccc(Br)c([O-])c1)[C@H]1CCC[C@H](C)C1 ZINC001183706135 1051887122 /nfs/dbraw/zinc/88/71/22/1051887122.db2.gz FKJKXSQSIIEZIB-SRVKXCTJSA-N -1 1 340.261 4.099 20 0 EIADMM CC(C)c1csc(C(=O)Nc2cccc(C(F)(F)F)c2[O-])n1 ZINC001193518593 1051943055 /nfs/dbraw/zinc/94/30/55/1051943055.db2.gz ZVPOHNKUMVIJGZ-UHFFFAOYSA-N -1 1 330.331 4.243 20 0 EIADMM [O-]c1cc(F)cc(F)c1Nc1ccc(OCc2ccccc2)nc1 ZINC001176305003 1052009060 /nfs/dbraw/zinc/00/90/60/1052009060.db2.gz DAJZDJRVUWREHU-UHFFFAOYSA-N -1 1 328.318 4.388 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccccc2N(C)C)c2ccccc12 ZINC001193857588 1052015477 /nfs/dbraw/zinc/01/54/77/1052015477.db2.gz NCPSGQINGIUMAK-UHFFFAOYSA-N -1 1 340.448 4.015 20 0 EIADMM CCc1cc(Nc2cc(S(=O)(=O)CC)ccc2[O-])ccc1Cl ZINC001176391046 1052032098 /nfs/dbraw/zinc/03/20/98/1052032098.db2.gz JAUBGEJGTHGILW-UHFFFAOYSA-N -1 1 339.844 4.145 20 0 EIADMM O=C(OCc1ncc(-c2ccc(Cl)cc2)o1)c1ccc([O-])cc1F ZINC000773572102 1052040882 /nfs/dbraw/zinc/04/08/82/1052040882.db2.gz UVGFAGPJPLDJMC-UHFFFAOYSA-N -1 1 347.729 4.197 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2ccc(-c3cccs3)cc2)cc1O ZINC001194161388 1052092051 /nfs/dbraw/zinc/09/20/51/1052092051.db2.gz BIENCSXHLCISHQ-UHFFFAOYSA-N -1 1 345.445 4.230 20 0 EIADMM Cc1cc(O)cc([N-]S(=O)(=O)c2ccc3c(Cl)cccc3c2)c1 ZINC001194243360 1052114430 /nfs/dbraw/zinc/11/44/30/1052114430.db2.gz PLRLLNKYXJJUND-UHFFFAOYSA-N -1 1 347.823 4.308 20 0 EIADMM Cc1cc(Br)ncc1Nc1c(F)cc(F)c([O-])c1F ZINC001176664862 1052156814 /nfs/dbraw/zinc/15/68/14/1052156814.db2.gz WJWBGYHAFTWBHP-UHFFFAOYSA-N -1 1 333.107 4.019 20 0 EIADMM COC(=O)c1cc(Cl)sc1Nc1c(F)cc(F)c([O-])c1F ZINC001176664641 1052156887 /nfs/dbraw/zinc/15/68/87/1052156887.db2.gz VVYHQOVCWDSQAE-UHFFFAOYSA-N -1 1 337.706 4.055 20 0 EIADMM CCc1nc(Cl)c(Nc2c(F)cc(F)c([O-])c2F)c(Cl)n1 ZINC001176663777 1052157099 /nfs/dbraw/zinc/15/70/99/1052157099.db2.gz IHMSMZRTJPEIKZ-UHFFFAOYSA-N -1 1 338.116 4.212 20 0 EIADMM Cc1c(Br)nccc1Nc1c(F)cc(F)c([O-])c1F ZINC001176664688 1052157778 /nfs/dbraw/zinc/15/77/78/1052157778.db2.gz XGLMTZGRXKAQPM-UHFFFAOYSA-N -1 1 333.107 4.019 20 0 EIADMM CO[C@H]1CCOc2c(Nc3c(F)cc(F)c([O-])c3F)cccc21 ZINC001176673074 1052159244 /nfs/dbraw/zinc/15/92/44/1052159244.db2.gz DJLMIRMTTMESCW-LBPRGKRZSA-N -1 1 325.286 4.023 20 0 EIADMM COc1cccc(Nc2c(F)cc(F)c([O-])c2F)c1Br ZINC001176672044 1052160413 /nfs/dbraw/zinc/16/04/13/1052160413.db2.gz RUNCITMMQMMZMJ-UHFFFAOYSA-N -1 1 348.118 4.324 20 0 EIADMM CCOC(=O)c1ccc(Nc2c(F)cc(F)c([O-])c2F)c(Cl)c1 ZINC001176673745 1052161309 /nfs/dbraw/zinc/16/13/09/1052161309.db2.gz ZGXMGYSPDYYVPD-UHFFFAOYSA-N -1 1 345.704 4.383 20 0 EIADMM Cc1cccc(C)c1S(=O)(=O)[N-]c1cccc2c1CCCCC2=O ZINC001194642340 1052183744 /nfs/dbraw/zinc/18/37/44/1052183744.db2.gz CRASUGIRHDUEBZ-UHFFFAOYSA-N -1 1 343.448 4.013 20 0 EIADMM CC[C@@H](Cc1ccc(C)cc1)N(CC)C(=O)c1cc(F)ccc1[O-] ZINC000622395626 1052252502 /nfs/dbraw/zinc/25/25/02/1052252502.db2.gz SJWXFAQFHJYSGS-KRWDZBQOSA-N -1 1 329.415 4.323 20 0 EIADMM CC(C)c1ccc(-c2nc(CN3CCC[C@@H](C(=O)[O-])C3)cs2)cc1 ZINC000164535448 1052261775 /nfs/dbraw/zinc/26/17/75/1052261775.db2.gz DXRBVSMXLCBNOQ-MRXNPFEDSA-N -1 1 344.480 4.230 20 0 EIADMM CC(C)[C@@H](CC(F)(F)F)NC(=O)c1cc2ccccc2cc1[O-] ZINC000622543225 1052321504 /nfs/dbraw/zinc/32/15/04/1052321504.db2.gz DJHYEVBDXGLAOF-CQSZACIVSA-N -1 1 325.330 4.252 20 0 EIADMM Cc1ccc(C[C@@H]2CCCN(C(=O)c3cc(Cl)ccc3[O-])C2)cc1 ZINC000622902974 1052535881 /nfs/dbraw/zinc/53/58/81/1052535881.db2.gz DDXBKPWAMANAPH-INIZCTEOSA-N -1 1 343.854 4.449 20 0 EIADMM O=C(Nc1cccc(-c2cccs2)c1)c1c[n-]c(C(F)(F)F)n1 ZINC001194783408 1053090562 /nfs/dbraw/zinc/09/05/62/1053090562.db2.gz NBDAZJLEBALNPS-UHFFFAOYSA-N -1 1 337.326 4.409 20 0 EIADMM CC(C)c1cccc(S(=O)(=O)[N-]c2cc(Cl)nc(Cl)c2)c1 ZINC001195115942 1053275538 /nfs/dbraw/zinc/27/55/38/1053275538.db2.gz IRJSFFYLYHCISF-UHFFFAOYSA-N -1 1 345.251 4.313 20 0 EIADMM CC(C)(C)Oc1cccc(CNCc2cc(F)c(C(=O)[O-])c(F)c2)c1 ZINC000864513889 1053300482 /nfs/dbraw/zinc/30/04/82/1053300482.db2.gz KORQWBQAGGCVGV-UHFFFAOYSA-N -1 1 349.377 4.130 20 0 EIADMM Cc1ccc([O-])c(C(=O)N(C)Cc2sc3ccccc3c2Cl)n1 ZINC001195324574 1053361482 /nfs/dbraw/zinc/36/14/82/1053361482.db2.gz RGRLWOYYQLWINF-UHFFFAOYSA-N -1 1 346.839 4.236 20 0 EIADMM O=C(NC1(c2cccc3ccccc32)CC1)c1cc([O-])cnc1Cl ZINC001195316116 1053375373 /nfs/dbraw/zinc/37/53/73/1053375373.db2.gz ZTLFHBJIJILSAM-UHFFFAOYSA-N -1 1 338.794 4.013 20 0 EIADMM COc1cccc(Cl)c1[N-]S(=O)(=O)c1c(C)cccc1Cl ZINC001195317340 1053377658 /nfs/dbraw/zinc/37/76/58/1053377658.db2.gz WPXQPDFPYXCNCX-UHFFFAOYSA-N -1 1 346.235 4.111 20 0 EIADMM O=C([N-]c1nnc(C2CCCCC2)s1)c1conc1C1CCCC1 ZINC000864968853 1053397348 /nfs/dbraw/zinc/39/73/48/1053397348.db2.gz BJKVMXCEUBJYJA-UHFFFAOYSA-N -1 1 346.456 4.484 20 0 EIADMM CCc1cc(=O)[nH]c(C[N@H+](CC)C(c2ccccc2)c2ccccc2)n1 ZINC001195476934 1053416765 /nfs/dbraw/zinc/41/67/65/1053416765.db2.gz LHLCEQWRSGPAJW-UHFFFAOYSA-N -1 1 347.462 4.356 20 0 EIADMM CCOC(=O)NC(=S)[N-]c1ccccc1Oc1ccccc1C ZINC001195484768 1053420152 /nfs/dbraw/zinc/42/01/52/1053420152.db2.gz QKPGMPCLMXUKJC-UHFFFAOYSA-N -1 1 330.409 4.230 20 0 EIADMM CC[C@H](C)CO[N-]C(=O)Cc1sc(C)nc1-c1ccc(C)cc1 ZINC000794863349 1053582900 /nfs/dbraw/zinc/58/29/00/1053582900.db2.gz HWLZYAAZCYXDOW-LBPRGKRZSA-N -1 1 332.469 4.063 20 0 EIADMM [O-]c1cc(F)c(NC(=S)Nc2ccc(C(F)(F)F)cc2)c(F)c1 ZINC001196187594 1053599524 /nfs/dbraw/zinc/59/95/24/1053599524.db2.gz BQHSJBNAWMGJHV-UHFFFAOYSA-N -1 1 348.296 4.498 20 0 EIADMM COc1cc(C)c(S(=O)(=O)[N-]c2csc3ccccc23)c(C)c1 ZINC001196848112 1053777373 /nfs/dbraw/zinc/77/73/73/1053777373.db2.gz BWDGYPQRARCYLD-UHFFFAOYSA-N -1 1 347.461 4.328 20 0 EIADMM O=C(Nc1c([O-])cc(Br)cc1Cl)[C@@H]1CCC[C@H]2C[C@H]21 ZINC000854432418 1053813843 /nfs/dbraw/zinc/81/38/43/1053813843.db2.gz OFTJRYZXZSBJSF-FXBDTBDDSA-N -1 1 344.636 4.183 20 0 EIADMM Cc1ccc(-c2nnc(-c3ccc([O-])cc3Br)o2)cc1 ZINC001252690138 1053964967 /nfs/dbraw/zinc/96/49/67/1053964967.db2.gz GMJFKXBWDQLRAO-UHFFFAOYSA-N -1 1 331.169 4.180 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc3oc(C(C)(C)C)nc3c2)cc1 ZINC000032097427 1054092789 /nfs/dbraw/zinc/09/27/89/1054092789.db2.gz GGEUAQUGLXHYIL-UHFFFAOYSA-N -1 1 344.436 4.235 20 0 EIADMM O=S(=O)([N-]c1ccc2n[nH]cc2c1)c1ccccc1-c1ccccc1 ZINC000032591551 1054107201 /nfs/dbraw/zinc/10/72/01/1054107201.db2.gz HPGBMZVHOLTFBS-UHFFFAOYSA-N -1 1 349.415 4.031 20 0 EIADMM C[C@@H](C(=O)[N-]OCCCC(F)(F)F)c1ccc(C(F)(F)F)cc1 ZINC000871215435 1054169549 /nfs/dbraw/zinc/16/95/49/1054169549.db2.gz BMBCFOBXLMTQHX-SECBINFHSA-N -1 1 343.267 4.199 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1CCC[C@@H](OC2CCC2)CC1 ZINC000871332900 1054200126 /nfs/dbraw/zinc/20/01/26/1054200126.db2.gz CZHFNGYWEXBGBB-QGZVFWFLSA-N -1 1 339.435 4.109 20 0 EIADMM CC(=O)c1ccc([N-]S(=O)(=O)c2ccc3occc3c2)cc1Cl ZINC001198869501 1054295908 /nfs/dbraw/zinc/29/59/08/1054295908.db2.gz VOWPQRCYFOARPM-UHFFFAOYSA-N -1 1 349.795 4.090 20 0 EIADMM CC(C)Oc1cccc(F)c1[N-]S(=O)(=O)c1ccc2occc2c1 ZINC001198870268 1054296744 /nfs/dbraw/zinc/29/67/44/1054296744.db2.gz LLBLJIJJJCNDTF-UHFFFAOYSA-N -1 1 349.383 4.160 20 0 EIADMM Cc1cc(Br)c([O-])c(NC(=O)[C@H]2C[C@H](C)C[C@H](C)C2)c1 ZINC001152518509 1054316909 /nfs/dbraw/zinc/31/69/09/1054316909.db2.gz SJIZJBXJLNZSKV-IAZYJMLFSA-N -1 1 340.261 4.474 20 0 EIADMM Cc1noc(C2CC2)c1[N-]C(=O)c1ccc(SC(F)(F)F)o1 ZINC000867342673 1054518357 /nfs/dbraw/zinc/51/83/57/1054518357.db2.gz ANIDPACIZMXILC-UHFFFAOYSA-N -1 1 332.303 4.318 20 0 EIADMM CCCc1csc(NC(=O)c2ccc(C(F)(F)F)c([O-])c2)n1 ZINC001153364519 1054620343 /nfs/dbraw/zinc/62/03/43/1054620343.db2.gz IVEBACDOYVDSGT-UHFFFAOYSA-N -1 1 330.331 4.072 20 0 EIADMM Cc1cc(C)cc(NC(=S)Nc2ccc(-n3ccc(=O)[n-]3)cc2)c1 ZINC001201207605 1054719283 /nfs/dbraw/zinc/71/92/83/1054719283.db2.gz PAQUOXJIDVAXLN-UHFFFAOYSA-N -1 1 338.436 4.004 20 0 EIADMM C[C@H](CC(F)(F)F)NCc1ccc(-c2ccccc2C(=O)[O-])o1 ZINC000859794398 1054730049 /nfs/dbraw/zinc/73/00/49/1054730049.db2.gz ADXMTPCJCXFENS-SNVBAGLBSA-N -1 1 327.302 4.075 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2cccc(COCC3CC3)c2)cc1C ZINC000064938387 1054890368 /nfs/dbraw/zinc/89/03/68/1054890368.db2.gz OMBDEPGFXXLHBS-UHFFFAOYSA-N -1 1 345.464 4.031 20 0 EIADMM O=C(NCc1ccc([O-])c(Cl)c1)N1CCC[C@H]1c1cccs1 ZINC000876392908 1054893867 /nfs/dbraw/zinc/89/38/67/1054893867.db2.gz DMDYXNBMZLELEZ-ZDUSSCGKSA-N -1 1 336.844 4.154 20 0 EIADMM O=C(Nc1ccc(Cl)c(Cl)c1)Nc1cc(Cl)ncc1[O-] ZINC001202256998 1055100068 /nfs/dbraw/zinc/10/00/68/1055100068.db2.gz UZQCCZUHUAUZSO-UHFFFAOYSA-N -1 1 332.574 4.391 20 0 EIADMM Cc1ccc([C@H](C)[N@@H+](C)Cc2nnc(-c3ccccc3O)o2)c(C)c1 ZINC000877987507 1055168773 /nfs/dbraw/zinc/16/87/73/1055168773.db2.gz JYMPFDQWKYAACZ-HNNXBMFYSA-N -1 1 337.423 4.252 20 0 EIADMM Cc1cc(C(=O)Nc2cc(C)cc(Br)c2[O-])cs1 ZINC000671791181 1055274363 /nfs/dbraw/zinc/27/43/63/1055274363.db2.gz WSTFGTDXMIDLPL-UHFFFAOYSA-N -1 1 326.215 4.085 20 0 EIADMM Cc1ccc(N[C@H](C)c2cc(Br)cc(F)c2[O-])cn1 ZINC000186346480 1055377886 /nfs/dbraw/zinc/37/78/86/1055377886.db2.gz BXEYCOXDRFZYPK-SECBINFHSA-N -1 1 325.181 4.170 20 0 EIADMM CC(=O)n1ncc2ccc(Nc3cc(Cl)cc(Cl)c3[O-])cc21 ZINC001212420638 1055726054 /nfs/dbraw/zinc/72/60/54/1055726054.db2.gz CDKQDZYYZQXXNN-UHFFFAOYSA-N -1 1 336.178 4.452 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2cc(Cl)ccc2Cl)c(F)c1 ZINC000404896144 1056318509 /nfs/dbraw/zinc/31/85/09/1056318509.db2.gz BZGXJCZLAKJJQZ-UHFFFAOYSA-N -1 1 334.199 4.242 20 0 EIADMM CCCc1cc(=O)[n-]c(SCc2nc(-c3ccsc3)oc2C)n1 ZINC000060367268 1056422782 /nfs/dbraw/zinc/42/27/82/1056422782.db2.gz SGBMBDLBVOZZDJ-UHFFFAOYSA-N -1 1 347.465 4.040 20 0 EIADMM C[C@@]1(c2ccccc2)CCCN(C(=O)c2ccc([O-])c(F)c2)CC1 ZINC000672118996 1056586887 /nfs/dbraw/zinc/58/68/87/1056586887.db2.gz RPQVOIOVOJIGNV-HXUWFJFHSA-N -1 1 327.399 4.115 20 0 EIADMM O=C(Nc1ccc(Br)c([O-])c1)c1cnc2ccsc2c1 ZINC001116888277 1056626091 /nfs/dbraw/zinc/62/60/91/1056626091.db2.gz YMRDFUHHFAMWAV-UHFFFAOYSA-N -1 1 349.209 4.017 20 0 EIADMM CCCn1ccc2cc([N-]S(=O)(=O)c3cccc(C)c3)ccc21 ZINC000063476152 1056812622 /nfs/dbraw/zinc/81/26/22/1056812622.db2.gz OWBUGAFDVGMMJI-UHFFFAOYSA-N -1 1 328.437 4.161 20 0 EIADMM Cc1nnc(-c2ccc(NC(=O)c3ccc4ccccc4c3[O-])cc2)o1 ZINC000741946647 1058476880 /nfs/dbraw/zinc/47/68/80/1058476880.db2.gz PTTOXNANNKANRB-UHFFFAOYSA-N -1 1 345.358 4.156 20 0 EIADMM Cc1cc(Cl)cc([N-]S(=O)(=O)C2=Cc3ccccc3CC2)c1O ZINC000743261195 1058906375 /nfs/dbraw/zinc/90/63/75/1058906375.db2.gz PQNKPIFSBXPPFZ-UHFFFAOYSA-N -1 1 349.839 4.083 20 0 EIADMM CC(=O)c1ccc([O-])c(CCOC(=O)c2ccc3ccccc3c2)c1 ZINC000744474125 1059543506 /nfs/dbraw/zinc/54/35/06/1059543506.db2.gz KUSOJNQFWHRZKN-UHFFFAOYSA-N -1 1 334.371 4.148 20 0 EIADMM CC(=O)c1ccc([O-])c(CCOC(=O)c2cc3cccc(C)c3o2)c1 ZINC000744890287 1059658895 /nfs/dbraw/zinc/65/88/95/1059658895.db2.gz RNXJJBZHFLKJDW-UHFFFAOYSA-N -1 1 338.359 4.049 20 0 EIADMM CC(=O)c1ccc([O-])c(CCOC(=O)CC/C=C\c2ccccc2)c1 ZINC000745066551 1059712382 /nfs/dbraw/zinc/71/23/82/1059712382.db2.gz ZHDIHYSBFHNFBK-UITAMQMPSA-N -1 1 338.403 4.174 20 0 EIADMM CC(C)Cc1ccc(C(=O)Nc2ccc(-n3ccc(=O)[n-]3)cc2)cc1 ZINC001168913583 1060517117 /nfs/dbraw/zinc/51/71/17/1060517117.db2.gz DQTLKGUUQONVOL-UHFFFAOYSA-N -1 1 335.407 4.029 20 0 EIADMM O=C(Cc1ccc([O-])c(Cl)c1)N[C@H]1CCc2ccc(Cl)cc21 ZINC001169299071 1060761507 /nfs/dbraw/zinc/76/15/07/1060761507.db2.gz CUHSFLYIRDLNAN-HNNXBMFYSA-N -1 1 336.218 4.045 20 0 EIADMM Cc1cc2occ(CC(=O)[N-]OCC(F)(F)F)c2cc1C(C)C ZINC000766764916 1060874063 /nfs/dbraw/zinc/87/40/63/1060874063.db2.gz MCROIHLEXBWYBU-UHFFFAOYSA-N -1 1 329.318 4.017 20 0 EIADMM C[C@H]([N-]C(=O)C(F)(F)F)c1ccc(N[C@@H]2C[C@H]2c2ccccc2)cc1 ZINC001169816656 1060985457 /nfs/dbraw/zinc/98/54/57/1060985457.db2.gz WKOWNDHCTHQQDB-AFAVFJNCSA-N -1 1 348.368 4.394 20 0 EIADMM CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1ccc([O-])c(F)c1 ZINC000767299488 1061185871 /nfs/dbraw/zinc/18/58/71/1061185871.db2.gz DEFIYTDZPUHUCY-UHFFFAOYSA-N -1 1 341.304 4.212 20 0 EIADMM Cc1cccc(S(=O)(=O)[N-]c2ccc(-c3ccc(O)cc3)cc2)c1 ZINC000066258988 215027871 /nfs/dbraw/zinc/02/78/71/215027871.db2.gz JPKICDKOQYDTDG-UHFFFAOYSA-N -1 1 339.416 4.168 20 0 EIADMM Cc1csc(-c2cccc(C(=O)Nc3ccc(F)cc3[O-])c2)n1 ZINC000532267533 1032126156 /nfs/dbraw/zinc/12/61/56/1032126156.db2.gz VVSQRTRUSICINM-UHFFFAOYSA-N -1 1 328.368 4.216 20 0 EIADMM Cc1ccc(Nc2cc(Br)cc(Cl)c2[O-])cc1N ZINC001174938333 1051259174 /nfs/dbraw/zinc/25/91/74/1051259174.db2.gz NZSSTKCMOIGCCS-UHFFFAOYSA-N -1 1 327.609 4.442 20 0 EIADMM Cc1c(Br)cncc1Nc1c(F)cc(F)c([O-])c1F ZINC001176664075 1052156726 /nfs/dbraw/zinc/15/67/26/1052156726.db2.gz KHYHZDPXBONOKB-UHFFFAOYSA-N -1 1 333.107 4.019 20 0 EIADMM O=C([N-]c1cc(F)c(F)cc1F)c1snc(Cl)c1Cl ZINC000857447764 1054245798 /nfs/dbraw/zinc/24/57/98/1054245798.db2.gz ONAJWIYWCATREC-UHFFFAOYSA-N -1 1 327.114 4.120 20 0 EIADMM Cc1ccc(F)cc1-c1nnc([N-]C(=O)c2conc2C(C)C)s1 ZINC000529220760 1032232411 /nfs/dbraw/zinc/23/24/11/1032232411.db2.gz INYUXNYNWLFXIA-UHFFFAOYSA-N -1 1 346.387 4.016 20 0 EIADMM Cc1ccccc1[C@H]1C[C@@H](C)N(C(=O)c2c([O-])cccc2Cl)C1 ZINC000738543776 1032420285 /nfs/dbraw/zinc/42/02/85/1032420285.db2.gz KKFJZGYKMAUKGK-KGLIPLIRSA-N -1 1 329.827 4.372 20 0 EIADMM Cc1cccc(S(=O)(=O)[N-]c2cccc(C(F)(F)F)c2C)c1 ZINC000471138142 1019092823 /nfs/dbraw/zinc/09/28/23/1019092823.db2.gz ZLNQOWRCACQAPE-UHFFFAOYSA-N -1 1 329.343 4.123 20 0 EIADMM O=C([O-])[C@@H](NCc1csc2ccccc12)c1cc(F)ccc1F ZINC000683174667 1019099582 /nfs/dbraw/zinc/09/95/82/1019099582.db2.gz WORQPJPGTXFZJT-INIZCTEOSA-N -1 1 333.359 4.095 20 0 EIADMM CCCc1ccc(C(=O)CCC(=O)Nc2c([O-])cccc2F)cc1 ZINC000092550280 1019243879 /nfs/dbraw/zinc/24/38/79/1019243879.db2.gz YUMZOOCRSHYDDX-UHFFFAOYSA-N -1 1 329.371 4.085 20 0 EIADMM O=C(Nc1ccc(F)cc1[O-])c1cc(F)c(C(F)(F)F)c(F)c1 ZINC000683248692 1019734756 /nfs/dbraw/zinc/73/47/56/1019734756.db2.gz JBFXPQLWXQTWEF-UHFFFAOYSA-N -1 1 335.203 4.081 20 0 EIADMM O=c1cc(C(F)(F)F)nc(CNc2cc(Cl)cc(Cl)c2)[n-]1 ZINC000535627071 1020012419 /nfs/dbraw/zinc/01/24/19/1020012419.db2.gz PLABVFHSQBFOGB-UHFFFAOYSA-N -1 1 338.116 4.120 20 0 EIADMM O=C(NC(Cc1ccccc1)Cc1ccccc1)c1ccc([O-])cc1F ZINC001625830892 1020132561 /nfs/dbraw/zinc/13/25/61/1020132561.db2.gz OCVCORRCELHYHE-UHFFFAOYSA-N -1 1 349.405 4.115 20 0 EIADMM Cc1sc(-c2ccco2)nc1C(=O)Nc1ccc(Cl)cc1[O-] ZINC000533618695 1020749133 /nfs/dbraw/zinc/74/91/33/1020749133.db2.gz BVBPSDAUFUEPHH-UHFFFAOYSA-N -1 1 334.784 4.323 20 0 EIADMM Cc1cc(O)ccc1-c1nc2ccc(Oc3ccccc3)cc2c(=O)[n-]1 ZINC000683433585 1020805055 /nfs/dbraw/zinc/80/50/55/1020805055.db2.gz NMGNPEZSLBCHBZ-UHFFFAOYSA-N -1 1 344.370 4.396 20 0 EIADMM O=C(c1ccc([O-])c(F)c1)N1C[C@@H](c2ccccc2)c2ccccc21 ZINC000683516949 1020856080 /nfs/dbraw/zinc/85/60/80/1020856080.db2.gz LKZJIESJDGPINW-KRWDZBQOSA-N -1 1 333.362 4.324 20 0 EIADMM [O-]c1c(Cl)cc(Br)cc1Nc1cccc(F)c1O ZINC001210205005 1020923049 /nfs/dbraw/zinc/92/30/49/1020923049.db2.gz VMYSYKUOCCCXBU-UHFFFAOYSA-N -1 1 332.556 4.396 20 0 EIADMM CCOc1cc(-c2noc(C3(C(F)(F)F)CC3)n2)cc(Cl)c1[O-] ZINC000683589286 1020943159 /nfs/dbraw/zinc/94/31/59/1020943159.db2.gz JQCFAYYEMHPWDC-UHFFFAOYSA-N -1 1 348.708 4.088 20 0 EIADMM O=C(C[C@@H](c1ccc(O)cc1)C1CC1)Nc1ccc([O-])c(Cl)c1 ZINC000612760159 1021350457 /nfs/dbraw/zinc/35/04/57/1021350457.db2.gz SNCPQTMZNRNPRE-OAHLLOKOSA-N -1 1 331.799 4.274 20 0 EIADMM CCc1cc(=O)[n-]c(SCC(=O)c2cccc(Cl)c2Cl)n1 ZINC000548963589 1021502196 /nfs/dbraw/zinc/50/21/96/1021502196.db2.gz OFWMZUNJORHUDL-UHFFFAOYSA-N -1 1 343.235 4.026 20 0 EIADMM Cc1cccc2c(=O)[nH]c(C(Cl)=Cc3cc(F)c([O-])c(F)c3)nc12 ZINC000255169228 1021655994 /nfs/dbraw/zinc/65/59/94/1021655994.db2.gz JSWOIBGHFUTFKH-VZUCSPMQSA-N -1 1 348.736 4.365 20 0 EIADMM CCCc1ccc(S(=O)(=O)[N-]c2cccc(N3CCCC3)c2)cc1 ZINC000096744373 1021733617 /nfs/dbraw/zinc/73/36/17/1021733617.db2.gz IEFUSDSFYJWVJL-UHFFFAOYSA-N -1 1 344.480 4.040 20 0 EIADMM O=C(Nc1ccc(F)cc1[O-])c1ccc(OC2CCC2)cc1Cl ZINC000536221118 1021818701 /nfs/dbraw/zinc/81/87/01/1021818701.db2.gz QWRWTRUHQLRFEK-UHFFFAOYSA-N -1 1 335.762 4.368 20 0 EIADMM COC(=O)c1cc(Nc2cc(Cl)c([O-])c(Cl)c2)cnc1Cl ZINC001210927777 1021867939 /nfs/dbraw/zinc/86/79/39/1021867939.db2.gz YXQJWLIJYVUWDZ-UHFFFAOYSA-N -1 1 347.585 4.278 20 0 EIADMM O=C(/C=C\Sc1cc(F)ccc1F)Nc1cc([O-])c(F)cc1F ZINC001625893052 1022082925 /nfs/dbraw/zinc/08/29/25/1022082925.db2.gz DWINNKVXKBCGBJ-ARJAWSKDSA-N -1 1 343.301 4.193 20 0 EIADMM COC(=O)c1ccc(N2CCCCC2)c(-c2cc(F)c([O-])cc2F)c1 ZINC001211340034 1022521901 /nfs/dbraw/zinc/52/19/01/1022521901.db2.gz RRMXHBHVUVFVSF-UHFFFAOYSA-N -1 1 347.361 4.114 20 0 EIADMM O=C(Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)c1cccc2ccccc21 ZINC000339118174 1022595986 /nfs/dbraw/zinc/59/59/86/1022595986.db2.gz CJPTWMYOZYVHSI-UHFFFAOYSA-N -1 1 329.359 4.188 20 0 EIADMM Cc1cc(C)cc(C2(C(=O)Nc3ccc(-c4cc(=O)[nH][n-]4)cc3)CC2)c1 ZINC000339121044 1022603813 /nfs/dbraw/zinc/60/38/13/1022603813.db2.gz WTWGCPWPMLPOKW-UHFFFAOYSA-N -1 1 347.418 4.069 20 0 EIADMM CCSc1cccc(F)c1[N-]S(=O)(=O)c1ccc(F)cc1F ZINC000685916332 1022661269 /nfs/dbraw/zinc/66/12/69/1022661269.db2.gz NUAMNANUXWEMBV-UHFFFAOYSA-N -1 1 347.383 4.017 20 0 EIADMM O=C(c1ncc2ccccc2c1[O-])N1CCC[C@H](c2ccccc2)CC1 ZINC001143472403 1022685297 /nfs/dbraw/zinc/68/52/97/1022685297.db2.gz DVWBAKGZJLCHIE-KRWDZBQOSA-N -1 1 346.430 4.350 20 0 EIADMM O=C(Nc1cc(Cl)c([O-])c2ccccc12)c1ccn(C(F)F)n1 ZINC001167440972 1022768722 /nfs/dbraw/zinc/76/87/22/1022768722.db2.gz YYUHQWIUKHAXEU-UHFFFAOYSA-N -1 1 337.713 4.043 20 0 EIADMM CCC(CC)CN(CC)C(=O)c1ccc(Br)c([O-])c1 ZINC000228316600 1022770095 /nfs/dbraw/zinc/77/00/95/1022770095.db2.gz PVGKZITYVICWFX-UHFFFAOYSA-N -1 1 328.250 4.053 20 0 EIADMM CCOc1cc(C(=O)Nc2cc(Cl)ccc2O)cc(Cl)c1[O-] ZINC000186899343 1022800886 /nfs/dbraw/zinc/80/08/86/1022800886.db2.gz HTPCCNVCTCMQJN-UHFFFAOYSA-N -1 1 342.178 4.056 20 0 EIADMM CCc1nc(S[C@@H](C)C(=O)c2ccc(C)c(C)c2)[n-]c(=O)c1C ZINC000581022990 1022803929 /nfs/dbraw/zinc/80/39/29/1022803929.db2.gz QGPKLCPDWPPFGO-ZDUSSCGKSA-N -1 1 330.453 4.033 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1ccc(F)cc1C(F)(F)F ZINC000182862481 1022833617 /nfs/dbraw/zinc/83/36/17/1022833617.db2.gz KFZPBANRDADXBA-UHFFFAOYSA-N -1 1 333.668 4.456 20 0 EIADMM Cc1ccc(C)c(S(=O)(=O)[N-]c2ccc(-c3nccs3)cc2)c1 ZINC000096695248 1022897750 /nfs/dbraw/zinc/89/77/50/1022897750.db2.gz KVKXFJRKUBIZRP-UHFFFAOYSA-N -1 1 344.461 4.228 20 0 EIADMM CC(C)(C)OC(=O)Nc1ccc(-c2nc(C3CCCC3)no2)c([O-])c1 ZINC000184844263 1022954307 /nfs/dbraw/zinc/95/43/07/1022954307.db2.gz XHYPGLNDNRFGFJ-UHFFFAOYSA-N -1 1 345.399 4.447 20 0 EIADMM Cc1cc2[n-]c(CCCOc3cccc(C)c3C)nc(=O)c2s1 ZINC000656491850 1023043611 /nfs/dbraw/zinc/04/36/11/1023043611.db2.gz RLFMYVWLZHNTKK-UHFFFAOYSA-N -1 1 328.437 4.334 20 0 EIADMM CC(C)c1ccc(C(=O)Nc2ccc(-c3nncs3)cc2)c([O-])c1 ZINC000647648944 1023115343 /nfs/dbraw/zinc/11/53/43/1023115343.db2.gz RFXMGRJACIQPCQ-UHFFFAOYSA-N -1 1 339.420 4.286 20 0 EIADMM CCc1cccc2cc(CN[C@@H](CC(=O)[O-])c3ccsc3)oc21 ZINC000656564703 1023226332 /nfs/dbraw/zinc/22/63/32/1023226332.db2.gz VTLQMWHQQZNNPT-INIZCTEOSA-N -1 1 329.421 4.362 20 0 EIADMM CC(C)Oc1ccc(CC[C@H](C)NC(=O)c2ccc([O-])cc2F)cc1 ZINC000181157353 1023230940 /nfs/dbraw/zinc/23/09/40/1023230940.db2.gz YMJHVUOGZWSQPN-AWEZNQCLSA-N -1 1 345.414 4.070 20 0 EIADMM Cc1ccc(-c2csc(NC(=O)c3ccc([O-])cc3F)n2)cc1 ZINC000181076794 1023235584 /nfs/dbraw/zinc/23/55/84/1023235584.db2.gz SDOKTLOYKUBYHK-UHFFFAOYSA-N -1 1 328.368 4.216 20 0 EIADMM O=C(Nc1ccccc1CCC(F)(F)F)c1ccc([O-])cc1F ZINC000182033344 1023284918 /nfs/dbraw/zinc/28/49/18/1023284918.db2.gz LMDCHIKJYSOTHK-UHFFFAOYSA-N -1 1 327.277 4.279 20 0 EIADMM Cc1cc(C(=O)Nc2ccc([O-])c(Cl)c2)nn1-c1ccc(C)cc1 ZINC000182874406 1023334364 /nfs/dbraw/zinc/33/43/64/1023334364.db2.gz CGWSZZKPNCZOKZ-UHFFFAOYSA-N -1 1 341.798 4.100 20 0 EIADMM O=C([O-])C[C@H](NCc1cnc(C2CCCC2)s1)c1ccsc1 ZINC000417537241 1023349554 /nfs/dbraw/zinc/34/95/54/1023349554.db2.gz SBWJZMNQTCKATD-AWEZNQCLSA-N -1 1 336.482 4.168 20 0 EIADMM CC(C)c1ccc(C(=O)N2C[C@@H]3CCC(=O)c4cccc2c43)c([O-])c1 ZINC000274460679 1023349748 /nfs/dbraw/zinc/34/97/48/1023349748.db2.gz WNFUJCNVZIZDPH-AWEZNQCLSA-N -1 1 335.403 4.236 20 0 EIADMM CC(C)(C)c1cnc(CN[C@H](CCC(=O)[O-])c2ccccc2)s1 ZINC000417601411 1023373505 /nfs/dbraw/zinc/37/35/05/1023373505.db2.gz LOTABJRGHFXPPA-CQSZACIVSA-N -1 1 332.469 4.136 20 0 EIADMM O=C([O-])[C@H]1C[C@H](NCc2cc(Cl)sc2Cl)c2ccccc21 ZINC000417633918 1023383092 /nfs/dbraw/zinc/38/30/92/1023383092.db2.gz VAWWUSXCSOHMGX-RYUDHWBXSA-N -1 1 342.247 4.458 20 0 EIADMM Cc1noc(-c2ccccc2)c1[N-]C(=O)c1oc(CC(C)C)nc1C ZINC000189194962 1023411110 /nfs/dbraw/zinc/41/11/10/1023411110.db2.gz FZESKERUTVGYON-UHFFFAOYSA-N -1 1 339.395 4.397 20 0 EIADMM COc1ccc(Cl)cc1[N-]S(=O)(=O)C1=Cc2ccccc2CC1 ZINC000024067435 1023544938 /nfs/dbraw/zinc/54/49/38/1023544938.db2.gz UCYGVNGZVDFAAH-UHFFFAOYSA-N -1 1 349.839 4.078 20 0 EIADMM CCOc1cc(C(=O)Nc2ccc(Cl)cc2F)cc(Cl)c1[O-] ZINC000192599781 1023632513 /nfs/dbraw/zinc/63/25/13/1023632513.db2.gz SFHAXVKBYZCMAD-UHFFFAOYSA-N -1 1 344.169 4.489 20 0 EIADMM CC[C@@H](C)Oc1cccc([N-]S(=O)(=O)c2ccc(C)c(C)c2)c1 ZINC000511736979 1023843778 /nfs/dbraw/zinc/84/37/78/1023843778.db2.gz YEEPNOYJNBAJMV-OAHLLOKOSA-N -1 1 333.453 4.282 20 0 EIADMM CC[C@H](C)Oc1cccc([N-]S(=O)(=O)c2ccc(C)c(F)c2)c1 ZINC000511735043 1023844039 /nfs/dbraw/zinc/84/40/39/1023844039.db2.gz AXZHRTSLCHZVKO-ZDUSSCGKSA-N -1 1 337.416 4.112 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2cccc(-c3nccs3)c2)cc1C ZINC000047417303 1023891712 /nfs/dbraw/zinc/89/17/12/1023891712.db2.gz VXJOIDALMOHWQK-UHFFFAOYSA-N -1 1 344.461 4.228 20 0 EIADMM O=C(N[C@@H](c1cccs1)c1ccc(F)cc1)c1c([O-])cccc1F ZINC000548445046 1024584639 /nfs/dbraw/zinc/58/46/39/1024584639.db2.gz KQOPNIPHUFGSFF-QGZVFWFLSA-N -1 1 345.370 4.251 20 0 EIADMM CSc1cccc([N-]S(=O)(=O)c2cccc(Cl)c2C)c1 ZINC000048652515 1024669128 /nfs/dbraw/zinc/66/91/28/1024669128.db2.gz MJIIWKQKSRLPJI-UHFFFAOYSA-N -1 1 327.858 4.171 20 0 EIADMM CCC[C@@H](C)[N-]S(=O)(=O)c1c(Cl)cc(Cl)cc1Cl ZINC000048664472 1024688944 /nfs/dbraw/zinc/68/89/44/1024688944.db2.gz NYSJDPCMLLABMI-SSDOTTSWSA-N -1 1 330.664 4.114 20 0 EIADMM CCOc1cc(-c2nc([C@H]3CCCCS3)no2)cc(Cl)c1[O-] ZINC000276953848 1024824928 /nfs/dbraw/zinc/82/49/28/1024824928.db2.gz QXPRYURIQIDBBE-GFCCVEGCSA-N -1 1 340.832 4.453 20 0 EIADMM O=C([O-])CC[C@@H]1CCCN(Cc2cc(-c3ccccc3Cl)on2)C1 ZINC000652496182 1024854785 /nfs/dbraw/zinc/85/47/85/1024854785.db2.gz NEDQFZXHGVZIJZ-ZDUSSCGKSA-N -1 1 348.830 4.072 20 0 EIADMM CCN(Cc1cnc(-c2ccc(C(C)C)cc2)s1)[C@H](C)C(=O)[O-] ZINC000662214579 1024965512 /nfs/dbraw/zinc/96/55/12/1024965512.db2.gz GCORFVGMBQCCJN-CYBMUJFWSA-N -1 1 332.469 4.229 20 0 EIADMM O=C([O-])CCC1CCN(Cc2csc(-c3ccccc3F)n2)CC1 ZINC000662218882 1024967045 /nfs/dbraw/zinc/96/70/45/1024967045.db2.gz WBASFNGTGIRVJP-UHFFFAOYSA-N -1 1 348.443 4.026 20 0 EIADMM O=C(Nc1ccc(F)cc1[O-])c1cc(-c2ccccn2)ccc1Cl ZINC000535877649 1025184397 /nfs/dbraw/zinc/18/43/97/1025184397.db2.gz VMKALZSDUGABJS-UHFFFAOYSA-N -1 1 342.757 4.499 20 0 EIADMM CCC(C)(C)c1ccc(S(=O)(=O)[N-]c2ccc3n[nH]cc3c2)cc1 ZINC000467090587 1025436526 /nfs/dbraw/zinc/43/65/26/1025436526.db2.gz NXDCYQDIGYRUOY-UHFFFAOYSA-N -1 1 343.452 4.051 20 0 EIADMM CCc1nc(SCc2cccc(OC(F)(F)F)c2)[n-]c(=O)c1C ZINC000657264046 1025461124 /nfs/dbraw/zinc/46/11/24/1025461124.db2.gz BAMAVQOIJIULQP-UHFFFAOYSA-N -1 1 344.358 4.244 20 0 EIADMM CCc1nc(SCc2cccc(F)c2OC(F)F)[n-]c(=O)c1C ZINC000657264636 1025468038 /nfs/dbraw/zinc/46/80/38/1025468038.db2.gz WWUPTUINVPZODL-UHFFFAOYSA-N -1 1 344.358 4.086 20 0 EIADMM CC(C)Oc1ccc(CN[C@@H](CC(=O)[O-])c2ccc(F)cc2F)cc1 ZINC000277441711 1026031032 /nfs/dbraw/zinc/03/10/32/1026031032.db2.gz UPWYRHMERNEWMD-SFHVURJKSA-N -1 1 349.377 4.058 20 0 EIADMM C[C@H](NC(=O)c1c(F)ccc([O-])c1F)c1cccc(C(F)(F)F)c1 ZINC000684828500 1026469832 /nfs/dbraw/zinc/46/98/32/1026469832.db2.gz KYOPCRRIWMLEFC-QMMMGPOBSA-N -1 1 345.267 4.180 20 0 EIADMM Cc1c(F)cccc1-c1ccc(CNCc2ccc(C(=O)[O-])cc2)o1 ZINC000426698808 1026483912 /nfs/dbraw/zinc/48/39/12/1026483912.db2.gz BUVYINPKQIPOQK-UHFFFAOYSA-N -1 1 339.366 4.382 20 0 EIADMM O=C([O-])C[C@H](NCc1ccc(Oc2ccccc2)o1)c1ccsc1 ZINC000426690405 1026492114 /nfs/dbraw/zinc/49/21/14/1026492114.db2.gz AFRDLFDBHZOCSS-INIZCTEOSA-N -1 1 343.404 4.439 20 0 EIADMM CCc1ccc(-c2ccc(CNCc3ccccc3CC(=O)[O-])o2)cc1 ZINC000426691892 1026494731 /nfs/dbraw/zinc/49/47/31/1026494731.db2.gz MJRNZLIAEDMAIQ-UHFFFAOYSA-N -1 1 349.430 4.426 20 0 EIADMM O=C([O-])[C@@H](NCc1ccc(Cl)s1)c1ccc(Cl)c(F)c1 ZINC000426755901 1026541214 /nfs/dbraw/zinc/54/12/14/1026541214.db2.gz GRDKLLARCAUONV-LBPRGKRZSA-N -1 1 334.199 4.110 20 0 EIADMM O=C([O-])[C@@H](NCc1cccc2cc[nH]c21)c1c(Cl)cccc1Cl ZINC000426762109 1026545222 /nfs/dbraw/zinc/54/52/22/1026545222.db2.gz HMMLFNRYMQCDIP-INIZCTEOSA-N -1 1 349.217 4.390 20 0 EIADMM CCCOc1cccc(CN[C@@H](CC(=O)[O-])c2ccc(F)cc2F)c1 ZINC000426828640 1026585725 /nfs/dbraw/zinc/58/57/25/1026585725.db2.gz LTSPPLNECPZUIG-SFHVURJKSA-N -1 1 349.377 4.059 20 0 EIADMM O=C(Nc1cccc(-c2cc[nH]n2)c1)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684870593 1026633212 /nfs/dbraw/zinc/63/32/12/1026633212.db2.gz KMDLXJPVQLPYBH-UHFFFAOYSA-N -1 1 347.296 4.053 20 0 EIADMM O=C(c1ccc(C(F)(F)F)c([O-])c1)N1CC[C@@H](c2ccccc2)C1 ZINC000684871437 1026637212 /nfs/dbraw/zinc/63/72/12/1026637212.db2.gz AHLHSXKTYWSKFZ-CQSZACIVSA-N -1 1 335.325 4.041 20 0 EIADMM C[C@H](c1cccs1)N(C)C(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684872926 1026640501 /nfs/dbraw/zinc/64/05/01/1026640501.db2.gz LJQHWCMSDLTIPG-SECBINFHSA-N -1 1 329.343 4.306 20 0 EIADMM C[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684875493 1026651109 /nfs/dbraw/zinc/65/11/09/1026651109.db2.gz GXYDVGDLIBWEFD-GYSYKLTISA-N -1 1 327.346 4.204 20 0 EIADMM CC[C@H](C)c1ccc(S(=O)(=O)[N-]c2ccc(OC)c(F)c2)cc1 ZINC000511131530 1026683406 /nfs/dbraw/zinc/68/34/06/1026683406.db2.gz ONYLEJVXCFMQNV-LBPRGKRZSA-N -1 1 337.416 4.149 20 0 EIADMM Cc1sc2nc(-c3cccc(C(F)(F)F)n3)[n-]c(=O)c2c1C ZINC000342631456 1026766565 /nfs/dbraw/zinc/76/65/65/1026766565.db2.gz FOGYLWMUEJLJFW-UHFFFAOYSA-N -1 1 325.315 4.095 20 0 EIADMM CCc1ccc(S(=O)(=O)[N-]c2cc(C)c(F)cc2Cl)s1 ZINC000507572104 1026836451 /nfs/dbraw/zinc/83/64/51/1026836451.db2.gz XKOAJULHKDOLSZ-UHFFFAOYSA-N -1 1 333.837 4.212 20 0 EIADMM O=C(NCc1ccc(-c2cccnc2)cc1)c1cc(Cl)ccc1[O-] ZINC000440666977 1027003820 /nfs/dbraw/zinc/00/38/20/1027003820.db2.gz JAFHBJCOWORMIO-UHFFFAOYSA-N -1 1 338.794 4.038 20 0 EIADMM CN(CCC1CCCCC1)Cc1coc(-c2ccc(C(=O)[O-])cc2)n1 ZINC000583029916 1027861815 /nfs/dbraw/zinc/86/18/15/1027861815.db2.gz HQPSJEWGRFHWFY-UHFFFAOYSA-N -1 1 342.439 4.442 20 0 EIADMM CCOc1cc(-c2noc([C@@H]3CCCCS3)n2)cc(Cl)c1[O-] ZINC000278032857 1027876482 /nfs/dbraw/zinc/87/64/82/1027876482.db2.gz XAQRXGFNTBATGN-LBPRGKRZSA-N -1 1 340.832 4.453 20 0 EIADMM CC(C)c1ccsc1C(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC000343014417 1027883724 /nfs/dbraw/zinc/88/37/24/1027883724.db2.gz OEPDSRUKTMOUCT-UHFFFAOYSA-N -1 1 327.409 4.220 20 0 EIADMM O=C([N-]c1nc(-c2ccccc2Cl)ns1)c1ccoc1Cl ZINC000192309730 1027930115 /nfs/dbraw/zinc/93/01/15/1027930115.db2.gz WRHQIFTUVCZYKH-UHFFFAOYSA-N -1 1 340.191 4.357 20 0 EIADMM Cc1nc2ccc([N-]S(=O)(=O)c3cccc(C(C)C)c3)cc2o1 ZINC000583117230 1028032808 /nfs/dbraw/zinc/03/28/08/1028032808.db2.gz FNMGQGGGUVCECC-UHFFFAOYSA-N -1 1 330.409 4.060 20 0 EIADMM O=C([O-])[C@H](NCc1cccc(-c2ccccc2)c1)c1ccccc1F ZINC000426780452 1028075860 /nfs/dbraw/zinc/07/58/60/1028075860.db2.gz RWJSVGQUPJWYQM-HXUWFJFHSA-N -1 1 335.378 4.408 20 0 EIADMM CCCCc1nnc([N-]C(=O)c2ncoc2-c2ccc(C)cc2)s1 ZINC000152040471 1028117664 /nfs/dbraw/zinc/11/76/64/1028117664.db2.gz JJMLQTILVZHZDO-UHFFFAOYSA-N -1 1 342.424 4.096 20 0 EIADMM COc1cc(Br)ccc1Nc1cc(F)c([O-])c(F)c1 ZINC001213379427 1028232797 /nfs/dbraw/zinc/23/27/97/1028232797.db2.gz YEFWICASKRIAMH-UHFFFAOYSA-N -1 1 330.128 4.185 20 0 EIADMM CCOc1cc(C(=O)N[C@@H]2CC[C@H]3CCC[C@H]3C2)cc(Cl)c1[O-] ZINC000546566155 1028264511 /nfs/dbraw/zinc/26/45/11/1028264511.db2.gz XLECGKNSUGSQTR-MBNYWOFBSA-N -1 1 337.847 4.143 20 0 EIADMM CCCCO[C@H](C)c1nc(-c2cc(Cl)c([O-])c(OCC)c2)no1 ZINC000445427589 1028525138 /nfs/dbraw/zinc/52/51/38/1028525138.db2.gz PPYFEZGOPROCLO-SNVBAGLBSA-N -1 1 340.807 4.372 20 0 EIADMM CCCCn1ncc(-c2nc(-c3ccc([O-])cc3Cl)no2)c1C ZINC000445448752 1028538221 /nfs/dbraw/zinc/53/82/21/1028538221.db2.gz SSPVTMHVZIAQON-UHFFFAOYSA-N -1 1 332.791 4.068 20 0 EIADMM Cc1ccc2oc(-c3nc(-c4ccc([O-])cc4Cl)no3)cc2n1 ZINC000445448777 1028539201 /nfs/dbraw/zinc/53/92/01/1028539201.db2.gz MHDTUJNQECTUFW-UHFFFAOYSA-N -1 1 327.727 4.212 20 0 EIADMM COc1cccc(/C=C/c2nc(-c3ccc([O-])cc3Cl)no2)c1 ZINC000445450024 1028541348 /nfs/dbraw/zinc/54/13/48/1028541348.db2.gz QHLGUIAOAHFGJC-VMPITWQZSA-N -1 1 328.755 4.275 20 0 EIADMM COc1cc(C)c(-c2nc(-c3ccc([O-])cc3Cl)no2)cc1OC ZINC000445450882 1028541922 /nfs/dbraw/zinc/54/19/22/1028541922.db2.gz XXCCRABUBBBZJY-UHFFFAOYSA-N -1 1 346.770 4.088 20 0 EIADMM [O-]c1ccc(-c2noc(CCCOc3ccc(F)cc3)n2)c(Cl)c1 ZINC000445450921 1028545432 /nfs/dbraw/zinc/54/54/32/1028545432.db2.gz YIMGAVVRUWKICQ-UHFFFAOYSA-N -1 1 348.761 4.246 20 0 EIADMM CCOc1ccc(Cc2nc(-c3ccc([O-])cc3Cl)no2)cc1 ZINC000445452607 1028547431 /nfs/dbraw/zinc/54/74/31/1028547431.db2.gz DWGNLAUESJQATK-UHFFFAOYSA-N -1 1 330.771 4.085 20 0 EIADMM [O-]c1ccc(-c2noc(C3(c4ccc(F)cc4)CC3)n2)c(Cl)c1 ZINC000445447809 1028576676 /nfs/dbraw/zinc/57/66/76/1028576676.db2.gz QHEVPQVUYDXKDP-UHFFFAOYSA-N -1 1 330.746 4.315 20 0 EIADMM COc1ccc(C)cc1Cc1nc(-c2ccc([O-])cc2Cl)no1 ZINC000445445279 1028576756 /nfs/dbraw/zinc/57/67/56/1028576756.db2.gz IVKOWBPXTSCEBR-UHFFFAOYSA-N -1 1 330.771 4.003 20 0 EIADMM Cc1noc(C)c1[C@@H](C)Cc1nc(-c2ccc([O-])cc2Cl)no1 ZINC000445445568 1028577774 /nfs/dbraw/zinc/57/77/74/1028577774.db2.gz JMDOHMPTIQQTEQ-QMMMGPOBSA-N -1 1 333.775 4.047 20 0 EIADMM COc1ccc(/C=C(\C)c2nc(-c3ccc([O-])cc3F)no2)cc1F ZINC000445456719 1028609194 /nfs/dbraw/zinc/60/91/94/1028609194.db2.gz KDLYDIFOOFMBTR-JXMROGBWSA-N -1 1 344.317 4.290 20 0 EIADMM CC(C)c1cc(-c2nc(-c3ccc([O-])cc3F)no2)nn1C(C)(C)C ZINC000445456392 1028610148 /nfs/dbraw/zinc/61/01/48/1028610148.db2.gz OCXSYEDHWBZUDD-UHFFFAOYSA-N -1 1 344.390 4.323 20 0 EIADMM [O-]c1ccc(-c2noc(Cc3c[nH]c4ccc(Cl)cc34)n2)c(F)c1 ZINC000445456221 1028613081 /nfs/dbraw/zinc/61/30/81/1028613081.db2.gz SURKEQBBNMGPHA-UHFFFAOYSA-N -1 1 343.745 4.307 20 0 EIADMM [O-]c1ccc(-c2noc([C@@H]3C[C@H]3c3c(F)cccc3F)n2)c(F)c1 ZINC000445457015 1028613486 /nfs/dbraw/zinc/61/34/86/1028613486.db2.gz QHNWLHGTUWOKOE-GHMZBOCLSA-N -1 1 332.281 4.131 20 0 EIADMM Cc1cc(OCc2nc(-c3ccc([O-])cc3F)no2)ccc1Cl ZINC000445458516 1028613638 /nfs/dbraw/zinc/61/36/38/1028613638.db2.gz YOZJVIGAOQKUIL-UHFFFAOYSA-N -1 1 334.734 4.122 20 0 EIADMM O=C(CCCCc1nc(-c2ccc([O-])cc2F)no1)c1ccccc1 ZINC000445458985 1028615700 /nfs/dbraw/zinc/61/57/00/1028615700.db2.gz WNQAJMUAJFFZNL-UHFFFAOYSA-N -1 1 340.354 4.177 20 0 EIADMM [O-]c1ccc(-c2noc(CCCc3cc(F)ccc3F)n2)cc1F ZINC000445477348 1028625083 /nfs/dbraw/zinc/62/50/83/1028625083.db2.gz NHMYYTMNVVAKHF-UHFFFAOYSA-N -1 1 334.297 4.035 20 0 EIADMM [O-]c1ccc(-c2noc(COc3ccc4ccccc4c3)n2)cc1F ZINC000445477183 1028625245 /nfs/dbraw/zinc/62/52/45/1028625245.db2.gz MHILIMXJLNQIQI-UHFFFAOYSA-N -1 1 336.322 4.314 20 0 EIADMM [O-]c1ccc(-c2noc([C@H]3C[C@]34CCCc3ccccc34)n2)cc1F ZINC000445482654 1028629229 /nfs/dbraw/zinc/62/92/29/1028629229.db2.gz SXLSZTIEEKKONR-QRWLVFNGSA-N -1 1 336.366 4.343 20 0 EIADMM Cc1ccc(SCc2nc(-c3ccc([O-])c(F)c3)no2)c(C)c1 ZINC000445485206 1028637294 /nfs/dbraw/zinc/63/72/94/1028637294.db2.gz YYUHCEQTDUKKKP-UHFFFAOYSA-N -1 1 330.384 4.490 20 0 EIADMM [O-]c1ccc(-c2noc(-c3sccc3Br)n2)cc1F ZINC000445476846 1028644771 /nfs/dbraw/zinc/64/47/71/1028644771.db2.gz IWKMFEJJDBCRJP-UHFFFAOYSA-N -1 1 341.161 4.072 20 0 EIADMM Cc1nc2cc(F)ccc2cc1-c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445475407 1028645435 /nfs/dbraw/zinc/64/54/35/1028645435.db2.gz UIYDRHHJJZTPIA-UHFFFAOYSA-N -1 1 339.301 4.244 20 0 EIADMM Cc1ccc(C)c(C(=O)CCc2nc(-c3ccc([O-])c(F)c3)no2)c1 ZINC000445476696 1028647445 /nfs/dbraw/zinc/64/74/45/1028647445.db2.gz HAPGLQIHJDAURM-UHFFFAOYSA-N -1 1 340.354 4.014 20 0 EIADMM Cc1ccc(SCCc2nc(-c3ccc([O-])c(F)c3)no2)cc1 ZINC000445476525 1028648094 /nfs/dbraw/zinc/64/80/94/1028648094.db2.gz DPAWNLHDXVTSEA-UHFFFAOYSA-N -1 1 330.384 4.225 20 0 EIADMM [O-]c1ccc(-c2noc(-c3ccc4nc(C(F)F)[nH]c4c3)n2)cc1F ZINC000583420355 1028702469 /nfs/dbraw/zinc/70/24/69/1028702469.db2.gz DGGOYCZXIRPZTO-UHFFFAOYSA-N -1 1 346.268 4.062 20 0 EIADMM [O-]c1ccc(Oc2ccccc2)cc1-c1nc(-c2cncs2)no1 ZINC000445578738 1028764239 /nfs/dbraw/zinc/76/42/39/1028764239.db2.gz IDSTUUHGRSNJQG-UHFFFAOYSA-N -1 1 337.360 4.358 20 0 EIADMM O=C(Nc1ccc2[nH]c(C3CCC3)nc2c1)c1c(F)ccc([O-])c1F ZINC000343281282 1028858934 /nfs/dbraw/zinc/85/89/34/1028858934.db2.gz ZVEOREHSIZXDQT-UHFFFAOYSA-N -1 1 343.333 4.067 20 0 EIADMM CC(=O)c1cc(F)c([N-]C(=O)c2cc(Cl)ccc2F)c(F)c1F ZINC000536140381 1029252342 /nfs/dbraw/zinc/25/23/42/1029252342.db2.gz NOLGVHPVAZNKDH-UHFFFAOYSA-N -1 1 345.679 4.351 20 0 EIADMM C[C@@H](Oc1cccc2ccccc21)C(=O)Nc1ccc(F)cc1[O-] ZINC000444332186 1029452442 /nfs/dbraw/zinc/45/24/42/1029452442.db2.gz RYJVZKMOJLVEMA-GFCCVEGCSA-N -1 1 325.339 4.091 20 0 EIADMM CCCc1cc(=O)[n-]c(SCc2ncc(-c3ccccc3F)o2)n1 ZINC000525110392 1029468312 /nfs/dbraw/zinc/46/83/12/1029468312.db2.gz JCMMZVSUGPCDMI-UHFFFAOYSA-N -1 1 345.399 4.221 20 0 EIADMM Cc1cccc2c1CC[C@H]2Nc1ccc(-c2nc(C)c(C)c(=O)[n-]2)cn1 ZINC000525192659 1029515924 /nfs/dbraw/zinc/51/59/24/1029515924.db2.gz LTIBJLSHYDCAOW-GOSISDBHSA-N -1 1 346.434 4.269 20 0 EIADMM Cc1ccccc1[C@@H]1CN(C(=O)c2ccc3ccccc3c2[O-])CCO1 ZINC000525253157 1029534442 /nfs/dbraw/zinc/53/44/42/1029534442.db2.gz RCYUEQYMTXJARV-FQEVSTJZSA-N -1 1 347.414 4.068 20 0 EIADMM CC(C)CN(CC(=O)[O-])Cc1cnc(-c2ccc(C(C)C)cc2)s1 ZINC000565107075 1029649348 /nfs/dbraw/zinc/64/93/48/1029649348.db2.gz NUPMKJSCFUCHJC-UHFFFAOYSA-N -1 1 346.496 4.476 20 0 EIADMM Cc1cc(C)c(C)c(Oc2nc3c(cnn3-c3ccccc3)c(=O)[n-]2)c1 ZINC000301374937 1029719112 /nfs/dbraw/zinc/71/91/12/1029719112.db2.gz XBJHBHPOLYDKJN-UHFFFAOYSA-N -1 1 346.390 4.239 20 0 EIADMM Cc1nc(-c2ccc(N[C@@H]3CC[C@H](C)C[C@@H]3C)nc2)[n-]c(=O)c1C ZINC000301412074 1029728251 /nfs/dbraw/zinc/72/82/51/1029728251.db2.gz YSOBLBIEDZJTKU-MQIPJXDCSA-N -1 1 326.444 4.098 20 0 EIADMM Cc1nc(-c2ccc(N[C@H]3C[C@H]3C3CCCCC3)nc2)[n-]c(=O)c1C ZINC000301429892 1029731840 /nfs/dbraw/zinc/73/18/40/1029731840.db2.gz QDAJWGYTGUBIRW-IRXDYDNUSA-N -1 1 338.455 4.242 20 0 EIADMM Cc1nc(-c2ccc(N[C@H](c3ccccc3)C3CC3)nc2)[n-]c(=O)c1C ZINC000301496949 1029743896 /nfs/dbraw/zinc/74/38/96/1029743896.db2.gz BNKINXXGFDCTJK-LJQANCHMSA-N -1 1 346.434 4.424 20 0 EIADMM CCCc1nnc([N-]C(=O)c2cc(-c3cccc(Cl)c3)on2)s1 ZINC000030039244 1029801907 /nfs/dbraw/zinc/80/19/07/1029801907.db2.gz VFECSRAVFCQYNN-UHFFFAOYSA-N -1 1 348.815 4.051 20 0 EIADMM CCSc1cccc(Br)c1[N-]C(=O)c1coc(C)n1 ZINC000643839491 1029845827 /nfs/dbraw/zinc/84/58/27/1029845827.db2.gz UVHKLQCUJINZOQ-UHFFFAOYSA-N -1 1 341.230 4.110 20 0 EIADMM COc1cc(C(=O)N2C[C@H](C(C)C)c3ccccc32)cc(Cl)c1[O-] ZINC000447319358 1030005800 /nfs/dbraw/zinc/00/58/00/1030005800.db2.gz XOTLSGUQOZVZDQ-CQSZACIVSA-N -1 1 345.826 4.454 20 0 EIADMM CC[C@@H](Nc1ccc(-c2nc(C)c(C)c(=O)[n-]2)cn1)C1CCCC1 ZINC000450869667 1030058978 /nfs/dbraw/zinc/05/89/78/1030058978.db2.gz BZZBLIKXWFKNAP-MRXNPFEDSA-N -1 1 326.444 4.242 20 0 EIADMM O=C(Nc1cccc(-c2cc[nH]n2)c1)c1ccc2ccccc2c1[O-] ZINC000392283564 1030094885 /nfs/dbraw/zinc/09/48/85/1030094885.db2.gz VNCXNLAFXYSWKK-UHFFFAOYSA-N -1 1 329.359 4.188 20 0 EIADMM CSCc1ccccc1[N-]S(=O)(=O)c1ccc(C2CC2)cc1 ZINC000451033518 1030185682 /nfs/dbraw/zinc/18/56/82/1030185682.db2.gz BEFSZFDBDNFEIP-UHFFFAOYSA-N -1 1 333.478 4.228 20 0 EIADMM CCOc1cc(C(=O)N([C@H](C)c2ccco2)C2CC2)cc(Cl)c1[O-] ZINC000186683676 1030300173 /nfs/dbraw/zinc/30/01/73/1030300173.db2.gz JLCDRCJCZMKAHJ-LLVKDONJSA-N -1 1 349.814 4.403 20 0 EIADMM CCSCc1ccccc1C(=O)N=c1cc(-c2cccs2)[n-][nH]1 ZINC000448027746 1030525434 /nfs/dbraw/zinc/52/54/34/1030525434.db2.gz AEZBRVFROFPVFR-UHFFFAOYSA-N -1 1 343.477 4.066 20 0 EIADMM Cc1cc(C(F)(F)F)ncc1NC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000685672801 1030692305 /nfs/dbraw/zinc/69/23/05/1030692305.db2.gz SPNJEEQPMYVCMW-UHFFFAOYSA-N -1 1 345.708 4.412 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2cccc(OC(F)F)c2)cc1Cl ZINC000614813129 1030765134 /nfs/dbraw/zinc/76/51/34/1030765134.db2.gz JZXUUINDZNNKCX-UHFFFAOYSA-N -1 1 347.770 4.051 20 0 EIADMM Cc1ncccc1CN[C@@H](CC(=O)[O-])c1cc(Cl)cc(Cl)c1 ZINC000426749776 1030811572 /nfs/dbraw/zinc/81/15/72/1030811572.db2.gz INKLOGORZJNJKP-HNNXBMFYSA-N -1 1 339.222 4.002 20 0 EIADMM CCC[C@@H](CC(C)C)C(=O)N1CCC(C(=O)c2ccc([O-])cc2)CC1 ZINC000648490685 1030884737 /nfs/dbraw/zinc/88/47/37/1030884737.db2.gz XNCFLJZVJSXNAP-SFHVURJKSA-N -1 1 345.483 4.276 20 0 EIADMM Cc1ccc(-c2cc(C(=O)[N-]c3cc(F)c(F)cc3F)on2)cc1 ZINC000104479763 1031073315 /nfs/dbraw/zinc/07/33/15/1031073315.db2.gz ROXTVHXCVUIXSB-UHFFFAOYSA-N -1 1 332.281 4.320 20 0 EIADMM CC(C)CC[N@@H+](Cc1ccc(C(=O)[O-])cc1Br)C1CC1 ZINC000226725836 1031104439 /nfs/dbraw/zinc/10/44/39/1031104439.db2.gz MAAMULDUBKQONH-UHFFFAOYSA-N -1 1 340.261 4.158 20 0 EIADMM CC(C)CCN(Cc1ccc(C(=O)[O-])cc1Br)C1CC1 ZINC000226725836 1031104455 /nfs/dbraw/zinc/10/44/55/1031104455.db2.gz MAAMULDUBKQONH-UHFFFAOYSA-N -1 1 340.261 4.158 20 0 EIADMM CCOc1cc(C(=O)Nc2nccc3sccc32)cc(Cl)c1[O-] ZINC000129026008 1031773605 /nfs/dbraw/zinc/77/36/05/1031773605.db2.gz QBWZBSASUZHJBF-UHFFFAOYSA-N -1 1 348.811 4.306 20 0 EIADMM CCC(CC)N(CC(C)C)C(=O)c1ccc(Br)cc1[O-] ZINC000093325919 1031921062 /nfs/dbraw/zinc/92/10/62/1031921062.db2.gz SQIGRUAQFGMHJJ-UHFFFAOYSA-N -1 1 342.277 4.442 20 0 EIADMM Cc1nc(-c2cccs2)sc1C(=O)Nc1ccc(F)cc1[O-] ZINC000532012717 1031975300 /nfs/dbraw/zinc/97/53/00/1031975300.db2.gz VQBNGDJSWIPDAT-UHFFFAOYSA-N -1 1 334.397 4.277 20 0 EIADMM CCc1nc(SCc2ncc(Cl)cc2Cl)[n-]c(=O)c1C ZINC000575762724 1033513169 /nfs/dbraw/zinc/51/31/69/1033513169.db2.gz DPNCFKMWHNORMJ-UHFFFAOYSA-N -1 1 330.240 4.047 20 0 EIADMM COc1cc(C(=O)Nc2ccccc2N(C)C(C)C)cc(Cl)c1[O-] ZINC000614405924 1034553194 /nfs/dbraw/zinc/55/31/94/1034553194.db2.gz YOMKPQVPFUDSKP-UHFFFAOYSA-N -1 1 348.830 4.151 20 0 EIADMM O=C([O-])[C@H]1CCCN(Cc2c(Cl)cccc2Oc2ccccc2)C1 ZINC000263450075 1034902499 /nfs/dbraw/zinc/90/24/99/1034902499.db2.gz ZFGYUQFNOLOMMD-AWEZNQCLSA-N -1 1 345.826 4.429 20 0 EIADMM CC(C)c1ccc(-c2nc(CN3CCC(C(=O)[O-])CC3)cs2)cc1 ZINC000262606366 1034950253 /nfs/dbraw/zinc/95/02/53/1034950253.db2.gz AUJHMSMDXHGXRH-UHFFFAOYSA-N -1 1 344.480 4.230 20 0 EIADMM CCC(CC)c1nnc([N-]C(=O)c2coc(-c3ccccc3)n2)s1 ZINC000151166279 1035105176 /nfs/dbraw/zinc/10/51/76/1035105176.db2.gz KIKSAQBVJUHRGJ-UHFFFAOYSA-N -1 1 342.424 4.349 20 0 EIADMM CCc1onc(C)c1[N-]C(=O)c1c(CC)onc1-c1ccccc1 ZINC000280407904 1035256769 /nfs/dbraw/zinc/25/67/69/1035256769.db2.gz RVNFIGNKJHGTMU-UHFFFAOYSA-N -1 1 325.368 4.015 20 0 EIADMM [O-]c1ccc(-c2noc(-c3ccnn3C3CCCC3)n2)c(Cl)c1 ZINC000575205949 1035721373 /nfs/dbraw/zinc/72/13/73/1035721373.db2.gz JCUNWAAEVPHKHB-UHFFFAOYSA-N -1 1 330.775 4.074 20 0 EIADMM COc1ccc([C@@H](NCc2ccc(/C=C\C(=O)[O-])o2)C2CCC2)cc1 ZINC000905747480 1035873978 /nfs/dbraw/zinc/87/39/78/1035873978.db2.gz AYAMCXYQKALISW-DUQGCJEPSA-N -1 1 341.407 4.017 20 0 EIADMM CC(C)N(Cc1nc(=O)c2sccc2[n-]1)[C@H](C)c1ccsc1 ZINC000420997752 1035936176 /nfs/dbraw/zinc/93/61/76/1035936176.db2.gz AODPHXAFFKKKMY-LLVKDONJSA-N -1 1 333.482 4.430 20 0 EIADMM CCc1ccc(S(=O)(=O)[N-]c2ccc(C(=O)C3CCC3)cc2)cc1 ZINC000486087730 1036476261 /nfs/dbraw/zinc/47/62/61/1036476261.db2.gz NLVFFANGGXNWQH-UHFFFAOYSA-N -1 1 343.448 4.033 20 0 EIADMM Cc1ccsc1CN(C)Cc1nc2ccccc2c(C)c1C(=O)[O-] ZINC000572370172 1036496043 /nfs/dbraw/zinc/49/60/43/1036496043.db2.gz HULHFOWPEFIHLB-UHFFFAOYSA-N -1 1 340.448 4.243 20 0 EIADMM CC1(C)C(=O)Nc2ccc(C(=O)/C=C/c3ccc([O-])c(Cl)c3)cc21 ZINC000164956607 1036565644 /nfs/dbraw/zinc/56/56/44/1036565644.db2.gz NZJITXRAFKICFK-XVNBXDOJSA-N -1 1 341.794 4.171 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1CCC[C@@H](CC(F)(F)F)C1 ZINC000421945128 1036863558 /nfs/dbraw/zinc/86/35/58/1036863558.db2.gz QTGHIKNLPSMGIN-LBPRGKRZSA-N -1 1 337.341 4.350 20 0 EIADMM CCCCCCO[C@H](C)C(=O)Nc1cccc([O-])c1Br ZINC000908708461 1036919128 /nfs/dbraw/zinc/91/91/28/1036919128.db2.gz XQIBVOLFHRRNRC-LLVKDONJSA-N -1 1 344.249 4.079 20 0 EIADMM O=C(Nc1cccc([O-])c1Br)C(C1CCC1)C1CCC1 ZINC000908707750 1036921638 /nfs/dbraw/zinc/92/16/38/1036921638.db2.gz JNQXQUYOHRRAHI-UHFFFAOYSA-N -1 1 338.245 4.310 20 0 EIADMM CCCCS[C@@H](C)C(=O)Nc1cccc([O-])c1Br ZINC000908714537 1036923351 /nfs/dbraw/zinc/92/33/51/1036923351.db2.gz DMFQNQVQQXJKIP-VIFPVBQESA-N -1 1 332.263 4.015 20 0 EIADMM O=C([O-])CC[C@@H]1CCCN(Cc2ncc(-c3cccc(Cl)c3)o2)C1 ZINC000261854600 1037051771 /nfs/dbraw/zinc/05/17/71/1037051771.db2.gz JUOUSFQQMYCQIP-ZDUSSCGKSA-N -1 1 348.830 4.072 20 0 EIADMM O=S(=O)([N-]c1cccc(-n2cccc2)c1)c1ccc(C(F)F)cc1 ZINC000569762860 1037054037 /nfs/dbraw/zinc/05/40/37/1037054037.db2.gz VPJVSWOGVSBEMO-UHFFFAOYSA-N -1 1 348.374 4.216 20 0 EIADMM O=C(Nc1cc([O-])c(F)cc1F)[C@H](OC1CCCC1)c1ccccc1 ZINC000909975490 1037215418 /nfs/dbraw/zinc/21/54/18/1037215418.db2.gz ABIYSADPDXANMU-GOSISDBHSA-N -1 1 347.361 4.309 20 0 EIADMM CC[C@H](CC(=O)Nc1cc([O-])c(F)cc1F)c1ccc(OC)cc1 ZINC000909984707 1037226318 /nfs/dbraw/zinc/22/63/18/1037226318.db2.gz RVAAQSMDZWOUQY-LLVKDONJSA-N -1 1 335.350 4.201 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1CCS[C@@H](c2ccccc2)C1 ZINC000605106897 1037673465 /nfs/dbraw/zinc/67/34/65/1037673465.db2.gz ANLSJODXSBGLSO-LJQANCHMSA-N -1 1 349.455 4.476 20 0 EIADMM CC(C)(C)CC[C@@H](NCc1ccc(-c2ccc(F)cc2)o1)C(=O)[O-] ZINC000414655954 1037693467 /nfs/dbraw/zinc/69/34/67/1037693467.db2.gz KDTKFXHNTQKAII-MRXNPFEDSA-N -1 1 333.403 4.455 20 0 EIADMM Cc1cc(Br)c([O-])c(NC(=O)[C@@H]2CCCC(F)(F)C2)c1 ZINC000503543221 1037802331 /nfs/dbraw/zinc/80/23/31/1037802331.db2.gz JGDFARFSPVGVQH-SECBINFHSA-N -1 1 348.187 4.227 20 0 EIADMM CCCCCC[C@@H](CC)CN(C)C(=O)c1cnc(C2CC2)[n-]c1=O ZINC000912721406 1038237016 /nfs/dbraw/zinc/23/70/16/1038237016.db2.gz KTEWXBWMJJDTQG-CQSZACIVSA-N -1 1 333.476 4.128 20 0 EIADMM Cc1cccc2c1OC/C(=C\c1ccc([O-])c(Br)c1)C2=O ZINC000063411598 1038310185 /nfs/dbraw/zinc/31/01/85/1038310185.db2.gz YJRWZTSSKJZBND-KPKJPENVSA-N -1 1 345.192 4.122 20 0 EIADMM COc1ccc(S(=O)(=O)[N-]c2ccccc2C(F)F)c(C)c1C ZINC000424065304 1038455011 /nfs/dbraw/zinc/45/50/11/1038455011.db2.gz LQVAJTNDQKEBKA-UHFFFAOYSA-N -1 1 341.379 4.050 20 0 EIADMM Cc1ccc2c(c1)[C@@H](Nc1ccc(-c3nc(C)c(C)c(=O)[n-]3)cn1)CC2 ZINC000608085463 1038501843 /nfs/dbraw/zinc/50/18/43/1038501843.db2.gz SCAFJRHRLLEAOE-SFHVURJKSA-N -1 1 346.434 4.269 20 0 EIADMM O=C(CSc1ccc2ccccc2c1)Nc1c([O-])cccc1F ZINC000608366965 1038804668 /nfs/dbraw/zinc/80/46/68/1038804668.db2.gz DLEGMHBTUPMRJQ-UHFFFAOYSA-N -1 1 327.380 4.415 20 0 EIADMM C[C@@H](Cc1cccc(C(F)(F)F)c1)C(=O)Nc1c([O-])cccc1F ZINC000608365890 1038804677 /nfs/dbraw/zinc/80/46/77/1038804677.db2.gz COPPTGUSTVHFOT-JTQLQIEISA-N -1 1 341.304 4.367 20 0 EIADMM CCOc1cc(-c2noc([C@@H]3CCC[C@@H](F)C3)n2)cc(Cl)c1[O-] ZINC000424355504 1038820648 /nfs/dbraw/zinc/82/06/48/1038820648.db2.gz JQYSAVSFZBROIA-MWLCHTKSSA-N -1 1 340.782 4.490 20 0 EIADMM O=C(CCc1nc(-c2ccc([O-])cc2Cl)no1)c1cccc(F)c1 ZINC000445448143 1038833880 /nfs/dbraw/zinc/83/38/80/1038833880.db2.gz QSVNSPZRCRWYLH-UHFFFAOYSA-N -1 1 346.745 4.050 20 0 EIADMM CCc1ccc(S(=O)(=O)[N-]c2c(C)cc(C)cc2Cl)s1 ZINC000253452899 1038843711 /nfs/dbraw/zinc/84/37/11/1038843711.db2.gz ZJYPVVNYVWPUBR-UHFFFAOYSA-N -1 1 329.874 4.382 20 0 EIADMM CC(C)([N-]C(=O)C(F)(F)c1ccccc1F)c1ccc(F)cc1F ZINC001625996668 1039193869 /nfs/dbraw/zinc/19/38/69/1039193869.db2.gz QZSGMYMFJRRJBM-UHFFFAOYSA-N -1 1 343.295 4.247 20 0 EIADMM CCSc1cccc([N-]S(=O)(=O)c2ccc3c(c2)CCC3)c1 ZINC000505313151 1039212283 /nfs/dbraw/zinc/21/22/83/1039212283.db2.gz TUEXDFVLIJULNK-UHFFFAOYSA-N -1 1 333.478 4.088 20 0 EIADMM CCOC(=O)C(C)(C)CC(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000600135787 1039314441 /nfs/dbraw/zinc/31/44/41/1039314441.db2.gz LPUGWVNXLUYSJJ-UHFFFAOYSA-N -1 1 349.814 4.117 20 0 EIADMM Cc1cc(C)cc(CN(C)C(=O)c2ccc(Br)c([O-])c2)c1 ZINC000434345895 1039369664 /nfs/dbraw/zinc/36/96/64/1039369664.db2.gz FMOMYGUIZXGYHS-UHFFFAOYSA-N -1 1 348.240 4.044 20 0 EIADMM CC(C)c1ccc(OCCC(=O)Nc2ccc([O-])c(F)c2F)cc1 ZINC000456780358 1039599922 /nfs/dbraw/zinc/59/99/22/1039599922.db2.gz BPZOLGSXNIQRTA-UHFFFAOYSA-N -1 1 335.350 4.201 20 0 EIADMM Cc1ccc2c(c1)N(C(=O)c1ccc3ccccc3c1[O-])C[C@@H](C)O2 ZINC000537672847 1039879544 /nfs/dbraw/zinc/87/95/44/1039879544.db2.gz HBZUSHSHDOBIJC-CQSZACIVSA-N -1 1 333.387 4.282 20 0 EIADMM C[C@H](N=c1ccc(N2CCC[C@H]2c2ccco2)n[n-]1)c1ccccc1 ZINC000425230659 1039889579 /nfs/dbraw/zinc/88/95/79/1039889579.db2.gz RMPUFPCTKBYRHK-RDJZCZTQSA-N -1 1 334.423 4.006 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N1CC[C@H](C(F)(F)F)C2(CCC2)C1 ZINC000283165443 1040222570 /nfs/dbraw/zinc/22/25/70/1040222570.db2.gz PDTXXBMXMSGIDV-ZDUSSCGKSA-N -1 1 347.764 4.240 20 0 EIADMM C[C@H](C(=O)Nc1ccc(F)cc1[O-])c1cccc(Br)c1 ZINC000462239973 1040416519 /nfs/dbraw/zinc/41/65/19/1040416519.db2.gz UVHPERKVNRMDEC-VIFPVBQESA-N -1 1 338.176 4.036 20 0 EIADMM Cc1cc(C(=O)Nc2cc(C)cc(Br)c2[O-])sc1C ZINC000482659958 1040418628 /nfs/dbraw/zinc/41/86/28/1040418628.db2.gz PUMRZSOMIFHRLM-UHFFFAOYSA-N -1 1 340.242 4.394 20 0 EIADMM Cc1scc(C(=O)Nc2cc(C)cc(Br)c2[O-])c1C ZINC000482666989 1040421373 /nfs/dbraw/zinc/42/13/73/1040421373.db2.gz AGUDJXIBBOQAPM-UHFFFAOYSA-N -1 1 340.242 4.394 20 0 EIADMM Cc1cc(Br)c([O-])c(NC(=O)c2cccn2C(C)C)c1 ZINC000482692092 1040430939 /nfs/dbraw/zinc/43/09/39/1040430939.db2.gz KNTRRYFQZAXOCK-UHFFFAOYSA-N -1 1 337.217 4.098 20 0 EIADMM Cc1cc2cc([N-]S(=O)(=O)c3ccc(Cl)cc3C)ccc2[nH]1 ZINC000515694485 1040975972 /nfs/dbraw/zinc/97/59/72/1040975972.db2.gz ZLAKPILUYZQIAG-UHFFFAOYSA-N -1 1 334.828 4.239 20 0 EIADMM Cc1cccc(C(C)C)c1[N-]S(=O)(=O)c1ccc2ncccc2c1 ZINC000538004913 1040982135 /nfs/dbraw/zinc/98/21/35/1040982135.db2.gz RNSKSJPRYAEFPG-UHFFFAOYSA-N -1 1 340.448 4.467 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2cccc(C(F)F)c2)cc(C)c1F ZINC000460832031 1040990746 /nfs/dbraw/zinc/99/07/46/1040990746.db2.gz MSOWEGGYIJDYHP-UHFFFAOYSA-N -1 1 329.343 4.181 20 0 EIADMM CC(C)N(CCc1nccs1)C(=O)c1ccc2ccccc2c1[O-] ZINC000163297907 1041058957 /nfs/dbraw/zinc/05/89/57/1041058957.db2.gz SLRSLAYYOJULQB-UHFFFAOYSA-N -1 1 340.448 4.095 20 0 EIADMM C=Cc1ccc(S(=O)(=O)[N-]c2cc(C(F)(F)F)ccc2C)cc1 ZINC000436478552 1041263195 /nfs/dbraw/zinc/26/31/95/1041263195.db2.gz QUYQIAXFHCPLQX-UHFFFAOYSA-N -1 1 341.354 4.458 20 0 EIADMM Cc1cc(C)c(/C=C\CN[C@@H](C)c2nc(C(=O)[O-])cs2)c(C)c1 ZINC000904024369 1041268475 /nfs/dbraw/zinc/26/84/75/1041268475.db2.gz RAMJKNADYQOJOT-GXMNPTEKSA-N -1 1 330.453 4.131 20 0 EIADMM CCOc1ccc(-c2noc(-c3ccc(OC)cc3[O-])n2)cc1Cl ZINC000436522918 1041306185 /nfs/dbraw/zinc/30/61/85/1041306185.db2.gz OLAXDFKUGXSDPR-UHFFFAOYSA-N -1 1 346.770 4.170 20 0 EIADMM CCC[C@@H]1CCCN(C(=O)c2cc(Cl)c([O-])c(OCC)c2)C1 ZINC000436523433 1041308298 /nfs/dbraw/zinc/30/82/98/1041308298.db2.gz SMCLAUMBZJTWKW-GFCCVEGCSA-N -1 1 325.836 4.097 20 0 EIADMM CC[C@](C)(NC(=O)c1ccc2ccccc2c1[O-])c1nccs1 ZINC000436531492 1041314478 /nfs/dbraw/zinc/31/44/78/1041314478.db2.gz SUFOHZAKTYILPI-SFHVURJKSA-N -1 1 326.421 4.057 20 0 EIADMM C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1ccc2ccccc2c1[O-] ZINC000436548278 1041326358 /nfs/dbraw/zinc/32/63/58/1041326358.db2.gz QFFKADNVULYHJK-IAQYHMDHSA-N -1 1 337.341 4.348 20 0 EIADMM COc1ccccc1[C@H]1CCCN1C(=O)c1ccc(Cl)cc1[O-] ZINC000436566103 1041345927 /nfs/dbraw/zinc/34/59/27/1041345927.db2.gz PFVRGMTUWUZNJR-OAHLLOKOSA-N -1 1 331.799 4.032 20 0 EIADMM COc1ccc(C(=O)Nc2cccc(COC(C)(C)C)c2C)c([O-])c1 ZINC000436572896 1041348505 /nfs/dbraw/zinc/34/85/05/1041348505.db2.gz FSTREMKHRUFUFQ-UHFFFAOYSA-N -1 1 343.423 4.277 20 0 EIADMM O=C(NC[C@H]1CCO[C@H]1c1ccccc1)c1cc2ccccc2cc1[O-] ZINC000436592323 1041351145 /nfs/dbraw/zinc/35/11/45/1041351145.db2.gz UEMXNMNWNOHMPH-NQIIRXRSSA-N -1 1 347.414 4.053 20 0 EIADMM C[C@@H]1CN(C(=O)c2cc3ccccc3cc2[O-])c2ccc(F)cc2O1 ZINC000436591463 1041351566 /nfs/dbraw/zinc/35/15/66/1041351566.db2.gz QGISTVIGKPKFQH-GFCCVEGCSA-N -1 1 337.350 4.112 20 0 EIADMM O=C(NC[C@@H]1CCO[C@@H]1c1ccccc1)c1cc2ccccc2cc1[O-] ZINC000436592322 1041351827 /nfs/dbraw/zinc/35/18/27/1041351827.db2.gz UEMXNMNWNOHMPH-GHTZIAJQSA-N -1 1 347.414 4.053 20 0 EIADMM CC(C)c1ccc(C(=O)N2C[C@H](C)Oc3cc(F)ccc32)c([O-])c1 ZINC000436592753 1041352814 /nfs/dbraw/zinc/35/28/14/1041352814.db2.gz YKRPWIZFXHQPAG-LBPRGKRZSA-N -1 1 329.371 4.082 20 0 EIADMM CCOc1cc(-c2nc(-c3cc(CC)ccn3)no2)cc(Cl)c1[O-] ZINC000436595375 1041354528 /nfs/dbraw/zinc/35/45/28/1041354528.db2.gz IKOBFXBEYMQNCU-UHFFFAOYSA-N -1 1 345.786 4.119 20 0 EIADMM CC[C@H](C)n1ncc(NC(=O)c2ccc(C(F)(F)F)cc2[O-])c1C ZINC000436595313 1041355358 /nfs/dbraw/zinc/35/53/58/1041355358.db2.gz LSHFMCXGSDAPCD-VIFPVBQESA-N -1 1 341.333 4.139 20 0 EIADMM C[C@]1(c2ccccc2)CCN(C(=O)c2cc3ccccc3cc2[O-])C1 ZINC000436587760 1041363626 /nfs/dbraw/zinc/36/36/26/1041363626.db2.gz ZRKZJSAHLLMZGS-QFIPXVFZSA-N -1 1 331.415 4.349 20 0 EIADMM COCc1nc2cc(NC(=O)c3ccc4ccccc4c3[O-])ccc2o1 ZINC000436590268 1041365209 /nfs/dbraw/zinc/36/52/09/1041365209.db2.gz ROIWLQCVPKJNRU-UHFFFAOYSA-N -1 1 348.358 4.085 20 0 EIADMM COc1c(C)cc(CN(C)C(=O)c2cc3ccccc3cc2[O-])cc1C ZINC000436637522 1041385604 /nfs/dbraw/zinc/38/56/04/1041385604.db2.gz YWBMAWRGWGHLNU-UHFFFAOYSA-N -1 1 349.430 4.443 20 0 EIADMM Cc1nc(SCc2csc(Cc3ccccc3)n2)[n-]c(=O)c1C ZINC000538516865 1041386610 /nfs/dbraw/zinc/38/66/10/1041386610.db2.gz UKRPSEQYOCIRCC-UHFFFAOYSA-N -1 1 343.477 4.139 20 0 EIADMM CSc1ccc(S(=O)(=O)[N-]c2cccc3ccc(O)cc32)cc1 ZINC000484666793 1041387246 /nfs/dbraw/zinc/38/72/46/1041387246.db2.gz BGYBYBIBTBYPTI-UHFFFAOYSA-N -1 1 345.445 4.068 20 0 EIADMM O=C(C(=O)N1CCC[C@@H]1c1cccc2ccccc21)c1ccc([O-])cc1 ZINC000436680235 1041419333 /nfs/dbraw/zinc/41/93/33/1041419333.db2.gz JKTARGWBTGANNB-HXUWFJFHSA-N -1 1 345.398 4.092 20 0 EIADMM O=C(Nc1ccc2nc(C(F)F)sc2c1)c1cc(F)ccc1[O-] ZINC000436699692 1041432097 /nfs/dbraw/zinc/43/20/97/1041432097.db2.gz RMNXEZOFMNESTL-UHFFFAOYSA-N -1 1 338.310 4.331 20 0 EIADMM C[C@H](CC(=O)Nc1ccc(F)cc1[O-])C(=O)c1ccc(Cl)cc1 ZINC000538606319 1041439324 /nfs/dbraw/zinc/43/93/24/1041439324.db2.gz ZMUJEOJUQXIPDA-SNVBAGLBSA-N -1 1 335.762 4.032 20 0 EIADMM C[C@@H](Cc1ccc(Cl)cc1)N(C)C(=O)c1ccc(Cl)cc1[O-] ZINC000436719135 1041440859 /nfs/dbraw/zinc/44/08/59/1041440859.db2.gz NMMKSMTUPMZQNG-NSHDSACASA-N -1 1 338.234 4.402 20 0 EIADMM Cc1ccccc1[C@H]1C[C@@H](C)N(C(=O)c2ccc(Cl)cc2[O-])C1 ZINC000436716450 1041441075 /nfs/dbraw/zinc/44/10/75/1041441075.db2.gz BDIUQBQOLYZMSU-KGLIPLIRSA-N -1 1 329.827 4.372 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1CCC=C(c2ccccc2)C1 ZINC000436722649 1041444528 /nfs/dbraw/zinc/44/45/28/1041444528.db2.gz LGFXPOGFWPFMJR-UHFFFAOYSA-N -1 1 329.399 4.475 20 0 EIADMM CC1(C)CN(C(=O)c2ccc(C(F)(F)F)cc2[O-])[C@@H]2CCC[C@@H]21 ZINC000436738638 1041449247 /nfs/dbraw/zinc/44/92/47/1041449247.db2.gz UAWPPYFYTKOQRE-QWHCGFSZSA-N -1 1 327.346 4.062 20 0 EIADMM O=C(NCc1cc(-c2ccccc2)on1)c1ccc2ccccc2c1[O-] ZINC000436732509 1041454592 /nfs/dbraw/zinc/45/45/92/1041454592.db2.gz UNMSBUOBTCMOED-UHFFFAOYSA-N -1 1 344.370 4.130 20 0 EIADMM O=C(N[C@@H](c1ccccc1)[C@@H]1CCOC1)c1cc2ccccc2cc1[O-] ZINC000436750663 1041463119 /nfs/dbraw/zinc/46/31/19/1041463119.db2.gz OPCQVNUKUNYUEQ-NQIIRXRSSA-N -1 1 347.414 4.053 20 0 EIADMM Cc1cc(C(=O)Nc2ccc(Cl)cc2[O-])nn1C1CCCCC1 ZINC000436779775 1041472541 /nfs/dbraw/zinc/47/25/41/1041472541.db2.gz YHBSHGIRAAPXLY-UHFFFAOYSA-N -1 1 333.819 4.308 20 0 EIADMM O=C(c1ccc(C(F)(F)F)cc1[O-])N1CCC[C@H]1c1ccccc1 ZINC000436764339 1041473621 /nfs/dbraw/zinc/47/36/21/1041473621.db2.gz QRYDEIQYAAFWRO-HNNXBMFYSA-N -1 1 335.325 4.388 20 0 EIADMM O=C(NC1(c2ccc(Cl)c(Cl)c2)CC1)c1ccc([O-])cc1F ZINC000436780285 1041473793 /nfs/dbraw/zinc/47/37/93/1041473793.db2.gz CCQCWDWBKWTRJT-UHFFFAOYSA-N -1 1 340.181 4.257 20 0 EIADMM NC(=O)c1cc(-c2csc(-c3cc4ccccc4o3)n2)ccc1[O-] ZINC000436784859 1041480534 /nfs/dbraw/zinc/48/05/34/1041480534.db2.gz ZBBHWOIPNXZHAH-UHFFFAOYSA-N -1 1 336.372 4.028 20 0 EIADMM C[C@H](CCCC(F)(F)F)NC(=O)c1cc2ccccc2cc1[O-] ZINC000436809194 1041490914 /nfs/dbraw/zinc/49/09/14/1041490914.db2.gz RTJMZOWDEAYHKF-LLVKDONJSA-N -1 1 325.330 4.396 20 0 EIADMM O=C(NCCn1c2ccccc2c2ccccc21)c1ccc([O-])cc1F ZINC000436838276 1041501339 /nfs/dbraw/zinc/50/13/39/1041501339.db2.gz MBHZCFFTQGACAT-UHFFFAOYSA-N -1 1 348.377 4.069 20 0 EIADMM Cc1cc(CNC(=O)c2ccc([O-])cc2F)ccc1-c1ccccc1 ZINC000436839694 1041509672 /nfs/dbraw/zinc/50/96/72/1041509672.db2.gz UVGCDTKMABPRDG-UHFFFAOYSA-N -1 1 335.378 4.437 20 0 EIADMM O=C(NCCC(c1ccccc1)c1ccccc1)c1ccc([O-])cc1F ZINC000436859329 1041521139 /nfs/dbraw/zinc/52/11/39/1041521139.db2.gz AUIZKNAHORWOSQ-UHFFFAOYSA-N -1 1 349.405 4.483 20 0 EIADMM [O-]c1ccc(-c2noc([C@@H]3[C@@H](c4ccccc4)C3(F)F)n2)c(F)c1 ZINC000436870205 1041527734 /nfs/dbraw/zinc/52/77/34/1041527734.db2.gz CWJFLIZPNXLTNN-KGLIPLIRSA-N -1 1 332.281 4.098 20 0 EIADMM [O-]c1ccc(-c2noc(C[C@@H]3C[C@H]3c3ccccc3)n2)c(Cl)c1 ZINC000436869010 1041528175 /nfs/dbraw/zinc/52/81/75/1041528175.db2.gz BXNIETRUECXWTL-WFASDCNBSA-N -1 1 326.783 4.442 20 0 EIADMM CC(C)Cn1ccc2cc(NC(=O)c3ccc([O-])cc3F)ccc21 ZINC000436872560 1041531259 /nfs/dbraw/zinc/53/12/59/1041531259.db2.gz UKJMYQTVSRODHR-UHFFFAOYSA-N -1 1 326.371 4.394 20 0 EIADMM CC(C)COc1ncccc1-c1nc(-c2ccc([O-])cc2Cl)no1 ZINC000436875532 1041533015 /nfs/dbraw/zinc/53/30/15/1041533015.db2.gz XZFQEKZDRUTLKM-UHFFFAOYSA-N -1 1 345.786 4.192 20 0 EIADMM COc1cccc(CCc2nc(-c3ccc([O-])cc3Cl)no2)c1F ZINC000436874630 1041533393 /nfs/dbraw/zinc/53/33/93/1041533393.db2.gz ULKLBAVJJDSFFP-UHFFFAOYSA-N -1 1 348.761 4.029 20 0 EIADMM [O-]c1c(-c2nc(COc3ccc(F)cc3)no2)ccc2ccccc21 ZINC000436895125 1041536468 /nfs/dbraw/zinc/53/64/68/1041536468.db2.gz VPZLBESJJKQKFD-UHFFFAOYSA-N -1 1 336.322 4.314 20 0 EIADMM CC(C)(CNC(=O)c1ccc([O-])cc1F)c1ccc(F)cc1Cl ZINC000436880926 1041538624 /nfs/dbraw/zinc/53/86/24/1041538624.db2.gz QHINSSLBZWUQHK-UHFFFAOYSA-N -1 1 339.769 4.031 20 0 EIADMM O=C(N[C@@H]1CCCC[C@H]1Cc1ccccc1)c1ccc([O-])cc1F ZINC000436880627 1041539101 /nfs/dbraw/zinc/53/91/01/1041539101.db2.gz KHBWVKZCAODJNB-HNAYVOBHSA-N -1 1 327.399 4.063 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cscc3Br)n2)c(F)c1 ZINC000436880736 1041539395 /nfs/dbraw/zinc/53/93/95/1041539395.db2.gz SBFOGCODAJLDAR-UHFFFAOYSA-N -1 1 341.161 4.072 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1CCc2c(Cl)cccc2C1 ZINC000436889208 1041543886 /nfs/dbraw/zinc/54/38/86/1041543886.db2.gz VIHUFSFPAVMIII-UHFFFAOYSA-N -1 1 337.806 4.397 20 0 EIADMM O=S(=O)([N-]CCC1=CCCCC1)c1cc(Cl)sc1Cl ZINC000032550806 1041545281 /nfs/dbraw/zinc/54/52/81/1041545281.db2.gz KSMUNOAXRTZAIW-UHFFFAOYSA-N -1 1 340.297 4.224 20 0 EIADMM CN(CCc1cccc2ccccc21)C(=O)c1c(F)ccc([O-])c1F ZINC000538831994 1041553830 /nfs/dbraw/zinc/55/38/30/1041553830.db2.gz KHUOAXGYTHAVEV-UHFFFAOYSA-N -1 1 341.357 4.138 20 0 EIADMM [O-]c1c(-c2nc(-c3n[nH]c4ccccc43)no2)ccc2ccccc21 ZINC000436931125 1041554357 /nfs/dbraw/zinc/55/43/57/1041554357.db2.gz ZLWAXDMQRFHAJT-UHFFFAOYSA-N -1 1 328.331 4.139 20 0 EIADMM C[C@@H]1C[C@@H](c2ccccc2)[C@@H](C)N1C(=O)c1cc(Cl)ccc1[O-] ZINC000436939557 1041567311 /nfs/dbraw/zinc/56/73/11/1041567311.db2.gz OTBNVFXIASVBLV-XJKCOSOUSA-N -1 1 329.827 4.452 20 0 EIADMM O=C(c1cc(F)ccc1[O-])N1CC=C(c2cccc3ccccc32)C1 ZINC000436959037 1041576566 /nfs/dbraw/zinc/57/65/66/1041576566.db2.gz LHKYYPJDYLEZHF-UHFFFAOYSA-N -1 1 333.362 4.224 20 0 EIADMM C[C@H](NC(=O)c1c([O-])cccc1F)c1ccc(-c2ccncc2)cc1 ZINC000436978835 1041580932 /nfs/dbraw/zinc/58/09/32/1041580932.db2.gz JBDOZVGFDGGKGN-ZDUSSCGKSA-N -1 1 336.366 4.084 20 0 EIADMM C[C@@H](NC(=O)c1c([O-])cccc1F)c1ccc(-c2ccncc2)cc1 ZINC000436978832 1041580944 /nfs/dbraw/zinc/58/09/44/1041580944.db2.gz JBDOZVGFDGGKGN-CYBMUJFWSA-N -1 1 336.366 4.084 20 0 EIADMM O=C(c1cc(Cl)ccc1[O-])N1CC[C@H](c2cccc(Cl)c2)C1 ZINC000436979671 1041581193 /nfs/dbraw/zinc/58/11/93/1041581193.db2.gz KZTAAFPZSHHTPB-LBPRGKRZSA-N -1 1 336.218 4.329 20 0 EIADMM CSc1ccc(S(=O)(=O)[N-]c2ccc(F)cc2C)cc1Cl ZINC000463522371 1041614795 /nfs/dbraw/zinc/61/47/95/1041614795.db2.gz IBMFDRFQNKKXAQ-UHFFFAOYSA-N -1 1 345.848 4.310 20 0 EIADMM O=C(CCCSc1nc(C(F)F)cc(=O)[n-]1)c1ccc(F)cc1 ZINC000517203920 1041901361 /nfs/dbraw/zinc/90/13/61/1041901361.db2.gz HKJKFXVEPLAEGU-UHFFFAOYSA-N -1 1 342.342 4.014 20 0 EIADMM CCn1c2ccccc2nc1[C@H]1CCCN1Cc1ccccc1C(=O)[O-] ZINC000517241333 1041920104 /nfs/dbraw/zinc/92/01/04/1041920104.db2.gz UJFQSJGKDPCBHO-LJQANCHMSA-N -1 1 349.434 4.092 20 0 EIADMM CC(C)(C)Cc1nc2cc([N-]S(=O)(=O)c3ccccc3)ccc2o1 ZINC000517520031 1042058499 /nfs/dbraw/zinc/05/84/99/1042058499.db2.gz PLNKZAHQDAVINW-UHFFFAOYSA-N -1 1 344.436 4.217 20 0 EIADMM Cc1cc2sc(NC(=O)c3c(F)ccc([O-])c3F)nc2c(C)c1 ZINC000438785441 1042348320 /nfs/dbraw/zinc/34/83/20/1042348320.db2.gz NTGLNZCQYWYKSQ-UHFFFAOYSA-N -1 1 334.347 4.149 20 0 EIADMM CC(C)C(=O)c1ccc(S(=O)(=O)[N-]c2ccccc2C(C)C)cc1 ZINC000438800418 1042350284 /nfs/dbraw/zinc/35/02/84/1042350284.db2.gz GAOQKTLOPXAPIV-UHFFFAOYSA-N -1 1 345.464 4.450 20 0 EIADMM CSc1cccc([N-]S(=O)(=O)c2ccc(C(=O)C(C)C)cc2)c1 ZINC000438791936 1042351512 /nfs/dbraw/zinc/35/15/12/1042351512.db2.gz CWHITHPALKYKPT-UHFFFAOYSA-N -1 1 349.477 4.048 20 0 EIADMM COc1ccc(S(=O)(=O)[N-]c2ccc(F)c(C)c2)c2ccccc12 ZINC000303231545 1042372540 /nfs/dbraw/zinc/37/25/40/1042372540.db2.gz YNWMWQFRLBPXHC-UHFFFAOYSA-N -1 1 345.395 4.097 20 0 EIADMM COc1ccc(N(Cc2ccccc2)C(=O)c2ccccc2[O-])cc1 ZINC000647942678 1042374749 /nfs/dbraw/zinc/37/47/49/1042374749.db2.gz ZRNRYBPNRBHGHQ-UHFFFAOYSA-N -1 1 333.387 4.248 20 0 EIADMM CC(C)c1ccc(C(=O)Nc2nc(C(F)(F)F)cs2)c([O-])c1 ZINC000439066737 1042490704 /nfs/dbraw/zinc/49/07/04/1042490704.db2.gz FMKSHGQFZBMVOR-UHFFFAOYSA-N -1 1 330.331 4.243 20 0 EIADMM O=S(=O)([N-]c1cc(F)cc(Cl)c1)c1cccc(C(F)F)c1 ZINC000780398356 1042552647 /nfs/dbraw/zinc/55/26/47/1042552647.db2.gz MFMGVWFPSTXEFR-UHFFFAOYSA-N -1 1 335.734 4.218 20 0 EIADMM C[C@@]([N-]C(=O)C(F)(F)c1ccccc1)(c1ccccc1)C(F)(F)F ZINC001127259438 1042716856 /nfs/dbraw/zinc/71/68/56/1042716856.db2.gz KEFZWXDGQGRBHI-OAHLLOKOSA-N -1 1 343.295 4.372 20 0 EIADMM COc1ccc(-c2nc(NC(=O)c3ccccc3[O-])sc2C)cc1 ZINC000006185671 1042887064 /nfs/dbraw/zinc/88/70/64/1042887064.db2.gz GELQFXJTNHLTEB-UHFFFAOYSA-N -1 1 340.404 4.085 20 0 EIADMM O=C([N-]c1cc(Cl)cc(F)c1F)c1c(F)c(F)cc(F)c1F ZINC000441563335 1042888257 /nfs/dbraw/zinc/88/82/57/1042888257.db2.gz FYBGFMCQRDNTRY-UHFFFAOYSA-N -1 1 339.622 4.427 20 0 EIADMM CCc1cc2c(CNc3ccc(Cl)cc3)cc(=O)oc2cc1[O-] ZINC000007384058 1042993550 /nfs/dbraw/zinc/99/35/50/1042993550.db2.gz IGANVTKRNOOGJV-UHFFFAOYSA-N -1 1 329.783 4.327 20 0 EIADMM Cc1cc(Br)c([O-])c(NC(=O)CCc2ccsc2)c1 ZINC000182926704 1043035288 /nfs/dbraw/zinc/03/52/88/1043035288.db2.gz BTHCQHXABHRUFD-UHFFFAOYSA-N -1 1 340.242 4.096 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc3oc(C(C)C)nc3c2)c(C)c1 ZINC000032097622 1043021812 /nfs/dbraw/zinc/02/18/12/1043021812.db2.gz LKSNQRDQFZLYIE-UHFFFAOYSA-N -1 1 344.436 4.369 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@H]1C[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000184001973 1043071795 /nfs/dbraw/zinc/07/17/95/1043071795.db2.gz LTVKRLCOQGTFQA-ZJUUUORDSA-N -1 1 341.716 4.205 20 0 EIADMM O=C([N-]c1csc(-c2ccccc2)n1)c1cc(-c2ccccn2)no1 ZINC000672332265 1043121047 /nfs/dbraw/zinc/12/10/47/1043121047.db2.gz AJPRTXLHGDWPHP-UHFFFAOYSA-N -1 1 348.387 4.112 20 0 EIADMM Cc1cc2cc(CNC(=O)c3ccc(C(F)(F)F)c([O-])c3)ccc2[nH]1 ZINC000672353763 1043147205 /nfs/dbraw/zinc/14/72/05/1043147205.db2.gz UGOIVHJVPCQOLN-UHFFFAOYSA-N -1 1 348.324 4.131 20 0 EIADMM C[C@H](CC(=O)c1ccccc1F)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000509180858 1043216409 /nfs/dbraw/zinc/21/64/09/1043216409.db2.gz FXFPODYXACLXBY-SNVBAGLBSA-N -1 1 335.762 4.032 20 0 EIADMM Cc1ccc(C)c(S(=O)(=O)[N-]c2cccc(COCC3CC3)c2)c1 ZINC000064938386 1043219036 /nfs/dbraw/zinc/21/90/36/1043219036.db2.gz WRVTVVGOTPJYMY-UHFFFAOYSA-N -1 1 345.464 4.031 20 0 EIADMM COC(=O)c1c(Cl)cccc1Nc1cc(F)c([O-])c(Cl)c1 ZINC001214491559 1043273547 /nfs/dbraw/zinc/27/35/47/1043273547.db2.gz BVDMOUJHOKUOHS-UHFFFAOYSA-N -1 1 330.142 4.368 20 0 EIADMM COc1cc(C)c([N-]S(=O)(=O)c2ccc3ccccc3c2)cc1F ZINC000187068534 1043324621 /nfs/dbraw/zinc/32/46/21/1043324621.db2.gz WPHMNYVJTDYTLX-UHFFFAOYSA-N -1 1 345.395 4.097 20 0 EIADMM CC(C)(C)C(=O)c1ccc(NC(=O)c2c[n-]c3ccccc3c2=O)cc1 ZINC000674122098 1043432093 /nfs/dbraw/zinc/43/20/93/1043432093.db2.gz XPLGENRLELKSBF-UHFFFAOYSA-N -1 1 348.402 4.009 20 0 EIADMM Cc1ccc(-c2ccccc2)c(-c2noc(-c3ncccc3[O-])n2)c1 ZINC001212481043 1043436402 /nfs/dbraw/zinc/43/64/02/1043436402.db2.gz XJUIPGDMWXHOJM-UHFFFAOYSA-N -1 1 329.359 4.480 20 0 EIADMM COc1ccccc1-c1ccccc1-c1noc(-c2ncccc2[O-])n1 ZINC001212480661 1043438712 /nfs/dbraw/zinc/43/87/12/1043438712.db2.gz BIEAKFXGUBAYSP-UHFFFAOYSA-N -1 1 345.358 4.180 20 0 EIADMM CSc1ccncc1[N-]C(=O)c1cc(-c2ccccc2Cl)on1 ZINC000674257658 1043504646 /nfs/dbraw/zinc/50/46/46/1043504646.db2.gz ZHFPPQIJSSVLRK-UHFFFAOYSA-N -1 1 345.811 4.364 20 0 EIADMM CC(C)[C@]1(C(=O)[O-])CC[N@@H+](Cc2nc(C3CCCCC3)cs2)C1 ZINC000521257059 1043671933 /nfs/dbraw/zinc/67/19/33/1043671933.db2.gz CMNAVRKWGOMCKT-SFHVURJKSA-N -1 1 336.501 4.124 20 0 EIADMM O=C(Nc1ccc(OC(F)F)c(F)c1)Nc1ccc([O-])c(Cl)c1 ZINC000190944924 1043753645 /nfs/dbraw/zinc/75/36/45/1043753645.db2.gz MLDRYJBIQNAXGX-UHFFFAOYSA-N -1 1 346.692 4.430 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1ccncc1Oc1ccccc1 ZINC000442657985 1043800562 /nfs/dbraw/zinc/80/05/62/1043800562.db2.gz WNVZXAKLXRPLPN-UHFFFAOYSA-N -1 1 340.766 4.485 20 0 EIADMM CCCOc1cccc(NC(=O)c2cc(Cl)c([O-])c(OC)c2)c1 ZINC000442852304 1043861402 /nfs/dbraw/zinc/86/14/02/1043861402.db2.gz HKYJQWIPFMOVJX-UHFFFAOYSA-N -1 1 335.787 4.095 20 0 EIADMM CC(C)c1ocnc1C(=O)[N-]c1nnc(-c2cccc(Cl)c2)s1 ZINC000731986887 1043863293 /nfs/dbraw/zinc/86/32/93/1043863293.db2.gz RMWJTIDLIHEERJ-UHFFFAOYSA-N -1 1 348.815 4.222 20 0 EIADMM CCOc1ccc(N(CC)C(=O)c2cc(Cl)c([O-])c(OC)c2)cc1 ZINC000442863782 1043867557 /nfs/dbraw/zinc/86/75/57/1043867557.db2.gz AONYGWMCPDWSJJ-UHFFFAOYSA-N -1 1 349.814 4.120 20 0 EIADMM CCC[C@@H](Cc1ccccc1)NC(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC000442951503 1043903835 /nfs/dbraw/zinc/90/38/35/1043903835.db2.gz HFZCJWZHFPVJEK-HNNXBMFYSA-N -1 1 347.842 4.195 20 0 EIADMM CCCN(CC1CCCCC1)C(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC000442940970 1043910173 /nfs/dbraw/zinc/91/01/73/1043910173.db2.gz LUQWVEQRMXYHDH-UHFFFAOYSA-N -1 1 339.863 4.487 20 0 EIADMM COc1cc(C(=O)N[C@@H]2CCC[C@H]2c2ccccc2)cc(Cl)c1[O-] ZINC000442963977 1043924192 /nfs/dbraw/zinc/92/41/92/1043924192.db2.gz FTKARBUMNKCYBY-GOEBONIOSA-N -1 1 345.826 4.120 20 0 EIADMM COc1cc(C(=O)N(C)c2ccc(SC)cc2)cc(Cl)c1[O-] ZINC000442983720 1043953596 /nfs/dbraw/zinc/95/35/96/1043953596.db2.gz PWXNAHBUZLWFAC-UHFFFAOYSA-N -1 1 337.828 4.053 20 0 EIADMM CC(C)C(=O)c1ccc([C@@H](C)C(=O)Nc2c([O-])cccc2F)cc1 ZINC000670083925 1043960443 /nfs/dbraw/zinc/96/04/43/1043960443.db2.gz JXHJDDWBSVTPOT-GFCCVEGCSA-N -1 1 329.371 4.112 20 0 EIADMM CCCC[C@H](NC(=O)c1cc(Cl)c([O-])c(OC)c1)C1CCC1 ZINC000443055042 1043990397 /nfs/dbraw/zinc/99/03/97/1043990397.db2.gz VQWQYRHPIOEUHF-AWEZNQCLSA-N -1 1 325.836 4.143 20 0 EIADMM Cc1cccc(S(=O)(=O)[N-]c2ccccc2N2CCCCCC2)c1 ZINC000521901694 1044047919 /nfs/dbraw/zinc/04/79/19/1044047919.db2.gz WYOMGMUUEYZMBY-UHFFFAOYSA-N -1 1 344.480 4.176 20 0 EIADMM COc1cc(-c2nc(-c3cccc4[nH]ccc43)no2)cc(Cl)c1[O-] ZINC000443215475 1044084968 /nfs/dbraw/zinc/08/49/68/1044084968.db2.gz YPOGCQDOPSHRAX-UHFFFAOYSA-N -1 1 341.754 4.253 20 0 EIADMM COc1cc(-c2noc(-c3cc(Cl)c([O-])c(OC)c3)n2)ccc1C ZINC000443219728 1044109473 /nfs/dbraw/zinc/10/94/73/1044109473.db2.gz HHWVALLNOTWQAS-UHFFFAOYSA-N -1 1 346.770 4.088 20 0 EIADMM C[C@@]1(c2ccccc2)CCCN(C(=O)c2c([O-])cccc2Cl)C1 ZINC000733367796 1044205257 /nfs/dbraw/zinc/20/52/57/1044205257.db2.gz SWXQOEGMCBYHJJ-LJQANCHMSA-N -1 1 329.827 4.240 20 0 EIADMM Cc1ccnc(F)c1Nc1cc(Br)cc(Cl)c1[O-] ZINC001212561449 1044327404 /nfs/dbraw/zinc/32/74/04/1044327404.db2.gz QTHDHLZDIHIUTJ-UHFFFAOYSA-N -1 1 331.572 4.394 20 0 EIADMM C[C@@H]1C[C@@H](NC(=O)c2c([O-])cccc2F)C[C@@H](c2ccccc2)C1 ZINC001299309840 1044346283 /nfs/dbraw/zinc/34/62/83/1044346283.db2.gz QITFSYWIJZSYDJ-CWRNSKLLSA-N -1 1 327.399 4.234 20 0 EIADMM CCOc1cc(C(=O)N2c3ccccc3CC[C@H]2C)cc(Cl)c1[O-] ZINC000675536067 1044372393 /nfs/dbraw/zinc/37/23/93/1044372393.db2.gz XFVYPPVLKBJFKQ-GFCCVEGCSA-N -1 1 345.826 4.426 20 0 EIADMM CCCc1nc(C(=O)[N-]c2nnc(-c3ccc(C)cc3C)s2)co1 ZINC000509618935 1044381176 /nfs/dbraw/zinc/38/11/76/1044381176.db2.gz NYRCHOREUDRADQ-UHFFFAOYSA-N -1 1 342.424 4.015 20 0 EIADMM CCOc1cc(C(=O)Nc2cccc3ncccc32)cc(Cl)c1[O-] ZINC000193080548 1044476242 /nfs/dbraw/zinc/47/62/42/1044476242.db2.gz VPBQJWAGVJYRRF-UHFFFAOYSA-N -1 1 342.782 4.245 20 0 EIADMM COc1cc(Cl)c([N-]S(=O)(=O)c2cc(C)c(C)s2)cc1C ZINC000673494937 1044518797 /nfs/dbraw/zinc/51/87/97/1044518797.db2.gz BZFUTZYNVCXTLG-UHFFFAOYSA-N -1 1 345.873 4.136 20 0 EIADMM C[C@H](C[N-]S(=O)(=O)c1cc(Cl)sc1Cl)C(C)(C)C ZINC000734498313 1044584404 /nfs/dbraw/zinc/58/44/04/1044584404.db2.gz GXOPDZLLFGEJFX-SSDOTTSWSA-N -1 1 330.302 4.015 20 0 EIADMM O=C(Nc1ccc(F)cc1[O-])c1cccc(Oc2nccs2)c1 ZINC000676055491 1044623229 /nfs/dbraw/zinc/62/32/29/1044623229.db2.gz KGMBKYQBDUZGTR-UHFFFAOYSA-N -1 1 330.340 4.032 20 0 EIADMM O=C(CSc1nnc(-c2cccc(Cl)c2)o1)c1ccc([O-])cc1 ZINC000018595950 1044729879 /nfs/dbraw/zinc/72/98/79/1044729879.db2.gz TUXUKYMGDJSZTQ-UHFFFAOYSA-N -1 1 346.795 4.071 20 0 EIADMM CCCCN(CCCC)C(=O)c1ccc(Br)c([O-])c1 ZINC000231326793 1044844353 /nfs/dbraw/zinc/84/43/53/1044844353.db2.gz JNZITARUPMUIKT-UHFFFAOYSA-N -1 1 328.250 4.197 20 0 EIADMM C[C@H]1CCc2ccccc2N1C(=O)c1cc(Br)ccc1[O-] ZINC000220003123 1044848883 /nfs/dbraw/zinc/84/88/83/1044848883.db2.gz CXAADOZYFXWKLJ-NSHDSACASA-N -1 1 346.224 4.136 20 0 EIADMM C[C@H]1C[C@@H](c2ccc(F)cc2)CN1C(=O)c1c([O-])cccc1Cl ZINC000736724975 1044965299 /nfs/dbraw/zinc/96/52/99/1044965299.db2.gz PZDOQAWAWQMIPB-WCQYABFASA-N -1 1 333.790 4.203 20 0 EIADMM C[C@H](NC(=O)c1c([O-])cccc1Cl)c1ncc(-c2ccccc2)o1 ZINC000740142665 1045184367 /nfs/dbraw/zinc/18/43/67/1045184367.db2.gz UUJVNCAGQGHSHN-NSHDSACASA-N -1 1 342.782 4.192 20 0 EIADMM O=C(N[C@@H]1C[C@H]1c1c(F)cccc1Cl)c1c([O-])cccc1Cl ZINC000740928965 1045242425 /nfs/dbraw/zinc/24/24/25/1045242425.db2.gz VPJIMAZRADCMCA-PRHODGIISA-N -1 1 340.181 4.124 20 0 EIADMM O=C([O-])CC[C@@H]1CCCCN1Cc1csc(-c2ccsc2)n1 ZINC000315613921 1045406629 /nfs/dbraw/zinc/40/66/29/1045406629.db2.gz MYFQODMQTHYUJN-AWEZNQCLSA-N -1 1 336.482 4.091 20 0 EIADMM CC(C)N(Cc1ccc(Cl)c(Cl)c1)C(=O)c1cncc([O-])c1 ZINC000316082067 1045416355 /nfs/dbraw/zinc/41/63/55/1045416355.db2.gz QMMINDPKEJLFPW-UHFFFAOYSA-N -1 1 339.222 4.145 20 0 EIADMM C[C@@H](Sc1nc2ccccc2s1)C(=O)Nc1ccc(F)cc1[O-] ZINC000763115335 1045509274 /nfs/dbraw/zinc/50/92/74/1045509274.db2.gz ACVXDPFDDJEZSG-SECBINFHSA-N -1 1 348.424 4.260 20 0 EIADMM Cc1nc2ccc([N-]S(=O)(=O)c3ccc(C(C)C)cc3)cc2o1 ZINC000074838548 1045520039 /nfs/dbraw/zinc/52/00/39/1045520039.db2.gz ZDXFOLCVPAKTFP-UHFFFAOYSA-N -1 1 330.409 4.060 20 0 EIADMM O=C(c1c([O-])cccc1Cl)N(CCC(F)(F)F)CC(F)(F)F ZINC000791155490 1045699207 /nfs/dbraw/zinc/69/92/07/1045699207.db2.gz ONNKKSSFPRHNPQ-UHFFFAOYSA-N -1 1 349.658 4.003 20 0 EIADMM Cc1ccc(Oc2ccc(NC(=O)c3ccc([O-])c(F)c3)cc2)nc1 ZINC000768142314 1045718200 /nfs/dbraw/zinc/71/82/00/1045718200.db2.gz AGODEDAXSREOOH-UHFFFAOYSA-N -1 1 338.338 4.279 20 0 EIADMM Cc1oc(-c2ccccc2)nc1C(=O)[N-]c1nnc(C(C)(C)C)s1 ZINC000055974991 1045767683 /nfs/dbraw/zinc/76/76/83/1045767683.db2.gz NZRYIMPOHNYWQZ-UHFFFAOYSA-N -1 1 342.424 4.051 20 0 EIADMM Cn1c2ccccc2c2cc(C(=O)Nc3ccc(F)cc3[O-])sc21 ZINC000768256579 1045770161 /nfs/dbraw/zinc/77/01/61/1045770161.db2.gz XKAKQYDCBZZNGB-UHFFFAOYSA-N -1 1 340.379 4.490 20 0 EIADMM O=C([N-]Cc1ccc(F)cc1C(F)(F)F)C(F)(F)c1ccccc1 ZINC000916053779 1045898470 /nfs/dbraw/zinc/89/84/70/1045898470.db2.gz PGYORDPRIKFLIJ-UHFFFAOYSA-N -1 1 347.258 4.253 20 0 EIADMM COc1ccc2c(c1)CCCN2C(=O)c1ccc(C(C)C)cc1[O-] ZINC000769653095 1046039626 /nfs/dbraw/zinc/03/96/26/1046039626.db2.gz LKQASHFFOJJWAT-UHFFFAOYSA-N -1 1 325.408 4.117 20 0 EIADMM CCCN(Cc1ccc(OC)cc1)C(=O)c1c([O-])cccc1Cl ZINC000769671920 1046042575 /nfs/dbraw/zinc/04/25/75/1046042575.db2.gz NXSVGFNRRVSCNP-UHFFFAOYSA-N -1 1 333.815 4.107 20 0 EIADMM O=C(c1nc2ccccc2c(=O)[n-]1)N1CCCCC[C@H]1c1ccccc1 ZINC000079408905 1046227493 /nfs/dbraw/zinc/22/74/93/1046227493.db2.gz WWLHILYHCIADMU-SFHVURJKSA-N -1 1 347.418 4.093 20 0 EIADMM C[C@@H]1CC[C@H](C(=O)[O-])CN1Cc1cc(Cl)cc(C(F)(F)F)c1 ZINC000263360484 1046277046 /nfs/dbraw/zinc/27/70/46/1046277046.db2.gz RVGJKMMRDXXMLQ-KOLCDFICSA-N -1 1 335.753 4.044 20 0 EIADMM O=C(/C=C\c1ccc2ccc(Cl)cc2n1)Nc1c([O-])cccc1F ZINC000770864570 1046278310 /nfs/dbraw/zinc/27/83/10/1046278310.db2.gz YTRHRAMFFKPNRF-HJWRWDBZSA-N -1 1 342.757 4.385 20 0 EIADMM C[C@H](C(=O)[O-])N(C)Cc1ccc(-c2ccc(C(F)(F)F)cc2)s1 ZINC000263441790 1046289138 /nfs/dbraw/zinc/28/91/38/1046289138.db2.gz WUNDSQIZAMMWHO-SNVBAGLBSA-N -1 1 343.370 4.339 20 0 EIADMM Cc1c(-c2nc(-c3ccc([O-])c(F)c3)no2)cnn1C1CCCCC1 ZINC000445476993 1046441532 /nfs/dbraw/zinc/44/15/32/1046441532.db2.gz KYVTVMCLFDJDFQ-UHFFFAOYSA-N -1 1 342.374 4.258 20 0 EIADMM CC(=C([O-])Nc1nc(-c2cccc(Cl)c2)ns1)c1ccccc1 ZINC000476017368 1046643346 /nfs/dbraw/zinc/64/33/46/1046643346.db2.gz IAZOHIAMBCLIOO-LLVKDONJSA-N -1 1 343.839 4.023 20 0 EIADMM COc1cc(C(=O)N(C)c2ccc(C(C)C)cc2)cc(Cl)c1[O-] ZINC000785606475 1046718179 /nfs/dbraw/zinc/71/81/79/1046718179.db2.gz KSOZPMGUKOFFDC-UHFFFAOYSA-N -1 1 333.815 4.454 20 0 EIADMM COc1cc(C(=O)N[C@@H](c2ccccc2)C2CCC2)cc(Cl)c1[O-] ZINC000460191900 1047173139 /nfs/dbraw/zinc/17/31/39/1047173139.db2.gz JDKCJHDTJJPSQS-KRWDZBQOSA-N -1 1 345.826 4.325 20 0 EIADMM Cc1nc(S[C@H](C)c2ncc(-c3ccccc3)o2)[n-]c(=O)c1C ZINC000537415079 1047203579 /nfs/dbraw/zinc/20/35/79/1047203579.db2.gz DRMGBYFUIIMMPH-GFCCVEGCSA-N -1 1 327.409 4.307 20 0 EIADMM O=C([N-]OCC(F)(F)F)C1(Cc2cccc(Cl)c2)CCCCC1 ZINC000807094105 1047411758 /nfs/dbraw/zinc/41/17/58/1047411758.db2.gz ROVRQNBQLSLFKT-UHFFFAOYSA-N -1 1 349.780 4.443 20 0 EIADMM Cc1cc(Br)c([O-])c(NC(=O)CC(C)(C)C2CC2)c1 ZINC000498215585 1047431454 /nfs/dbraw/zinc/43/14/54/1047431454.db2.gz IAVZMMXPUOEONB-UHFFFAOYSA-N -1 1 326.234 4.228 20 0 EIADMM Cc1cccc(Cl)c1[N-]S(=O)(=O)c1cc(Cl)ccc1F ZINC000556304091 1047660570 /nfs/dbraw/zinc/66/05/70/1047660570.db2.gz MSNCTSSOZJTEKH-UHFFFAOYSA-N -1 1 334.199 4.242 20 0 EIADMM O=S(=O)([N-]c1ccc(F)cc1Cl)c1cc(Cl)ccc1F ZINC000556346758 1047691353 /nfs/dbraw/zinc/69/13/53/1047691353.db2.gz KDSVNBGSRZXAAD-UHFFFAOYSA-N -1 1 338.162 4.072 20 0 EIADMM O=C(N[C@H]1CCC[C@H]1Cc1ccccc1)c1c([O-])cccc1Cl ZINC001136901140 1047889841 /nfs/dbraw/zinc/88/98/41/1047889841.db2.gz DPTQMMYOEDNUHV-HOCLYGCPSA-N -1 1 329.827 4.187 20 0 EIADMM O=C(Cc1ccccc1OC1CCCC1)Nc1ccc([O-])c(F)c1F ZINC000556719182 1047891320 /nfs/dbraw/zinc/89/13/20/1047891320.db2.gz RVPCRLNEJOMRRN-UHFFFAOYSA-N -1 1 347.361 4.173 20 0 EIADMM O=C(Nc1cccc(C2SCCS2)c1)c1cc(F)ccc1[O-] ZINC000748008244 1048525264 /nfs/dbraw/zinc/52/52/64/1048525264.db2.gz KGXJAEHYQSOPTP-UHFFFAOYSA-N -1 1 335.425 4.262 20 0 EIADMM CN(Cc1cccc(C(F)(F)F)c1)C(=O)c1c([O-])cccc1Cl ZINC000920455265 1048676322 /nfs/dbraw/zinc/67/63/22/1048676322.db2.gz ZKOIOWWEABIHTF-UHFFFAOYSA-N -1 1 343.732 4.337 20 0 EIADMM O=C(NCCc1ccccc1C(F)(F)F)c1c([O-])cccc1Cl ZINC000920461834 1048678921 /nfs/dbraw/zinc/67/89/21/1048678921.db2.gz VLXFWTJHJRTUKT-UHFFFAOYSA-N -1 1 343.732 4.037 20 0 EIADMM C[C@@H](NC(=O)c1c([O-])cccc1Cl)c1ccc(F)c(Cl)c1 ZINC000920462266 1048679211 /nfs/dbraw/zinc/67/92/11/1048679211.db2.gz AQTBQISMPHKWRV-MRVPVSSYSA-N -1 1 328.170 4.329 20 0 EIADMM COc1ccc2cc(CNC(=O)c3c([O-])cccc3Cl)ccc2c1 ZINC000920436346 1048681712 /nfs/dbraw/zinc/68/17/12/1048681712.db2.gz GXWHHROLEJZHPD-UHFFFAOYSA-N -1 1 341.794 4.137 20 0 EIADMM O=C(NCCC(c1ccccc1)c1ccccc1)c1cc(F)ccc1[O-] ZINC001135483828 1048747773 /nfs/dbraw/zinc/74/77/73/1048747773.db2.gz OMOWJEDJJAONQR-UHFFFAOYSA-N -1 1 349.405 4.483 20 0 EIADMM [O-]c1cc(F)c(CN2CCC[C@@H]2c2cc(F)ccc2F)cc1F ZINC001144663960 1048780029 /nfs/dbraw/zinc/78/00/29/1048780029.db2.gz PLHZSZLHXUSJFE-MRXNPFEDSA-N -1 1 325.305 4.286 20 0 EIADMM CN(Cc1ccc(Br)cc1)Cc1cc(F)c([O-])cc1F ZINC001144666723 1048788048 /nfs/dbraw/zinc/78/80/48/1048788048.db2.gz NLPDOEQMUPKCJZ-UHFFFAOYSA-N -1 1 342.183 4.065 20 0 EIADMM [O-]c1cc(F)c(CN2CCc3cccc(C(F)(F)F)c3C2)cc1F ZINC001144659422 1048793865 /nfs/dbraw/zinc/79/38/65/1048793865.db2.gz IKUJLLHFXDFPDY-UHFFFAOYSA-N -1 1 343.295 4.248 20 0 EIADMM [O-]c1cc(F)c(CN2CCC[C@@H]2c2ccc(F)cc2F)cc1F ZINC001144659930 1048794083 /nfs/dbraw/zinc/79/40/83/1048794083.db2.gz RBFQHTMTOUIONR-MRXNPFEDSA-N -1 1 325.305 4.286 20 0 EIADMM O=C(Nc1ccc(-c2c[nH]cn2)cc1)c1ccc(C(F)(F)F)c([O-])c1 ZINC001135735820 1048874604 /nfs/dbraw/zinc/87/46/04/1048874604.db2.gz SERBCGBMLNCBPN-UHFFFAOYSA-N -1 1 347.296 4.053 20 0 EIADMM O=C(c1ccc(C(F)(F)F)c([O-])c1)N1CC[C@H](C2CCCCC2)C1 ZINC001146290621 1049012251 /nfs/dbraw/zinc/01/22/51/1049012251.db2.gz OYNPQHWFTZDEHE-AWEZNQCLSA-N -1 1 341.373 4.453 20 0 EIADMM O=C(N[C@@H]1CC[C@H]2CCCC[C@@H]2C1)c1ccc(C(F)(F)F)c([O-])c1 ZINC001136019208 1049039969 /nfs/dbraw/zinc/03/99/69/1049039969.db2.gz MNHISFTYHAMCPG-YRGRVCCFSA-N -1 1 341.373 4.500 20 0 EIADMM O=C(N[C@@H](c1cccs1)C1CC1)c1ccc(C(F)(F)F)cc1[O-] ZINC001136055623 1049057884 /nfs/dbraw/zinc/05/78/84/1049057884.db2.gz QJDDGXYQEQCFIC-CQSZACIVSA-N -1 1 341.354 4.354 20 0 EIADMM Cc1ccc([C@@H]2CCCCCN2C(=O)c2cc(C)cc(C=O)c2[O-])o1 ZINC001147733530 1049203315 /nfs/dbraw/zinc/20/33/15/1049203315.db2.gz FIODYRXQKHDECS-KRWDZBQOSA-N -1 1 341.407 4.172 20 0 EIADMM Cc1ccc([C@@H]2[C@@H](C)CCCN2C(=O)c2ccc(F)c([O-])c2)cc1 ZINC001147795743 1049217949 /nfs/dbraw/zinc/21/79/49/1049217949.db2.gz IAOFYKYZBQNIHZ-LIRRHRJNSA-N -1 1 327.399 4.453 20 0 EIADMM Cc1ccc([C@@H]2[C@H](C)CCCN2C(=O)c2ccc([O-])c(F)c2)cc1 ZINC001147796243 1049218416 /nfs/dbraw/zinc/21/84/16/1049218416.db2.gz QXKRZSBMHGQQTN-KUHUBIRLSA-N -1 1 327.399 4.453 20 0 EIADMM Cc1ccc([C@H]2C[C@H](C)CCN2C(=O)Cc2ccc([O-])c(Cl)c2)o1 ZINC001148223362 1049281837 /nfs/dbraw/zinc/28/18/37/1049281837.db2.gz DBJGGPXDJFBDNM-MLGOLLRUSA-N -1 1 347.842 4.489 20 0 EIADMM CC1(C)CO[C@@H](CC(=O)Nc2cc(Cl)c([O-])c3ccccc23)C1 ZINC001148253064 1049288575 /nfs/dbraw/zinc/28/85/75/1049288575.db2.gz OTIQYJMVFDJECN-NSHDSACASA-N -1 1 333.815 4.343 20 0 EIADMM O=C(Cc1ccc([O-])c(Cl)c1)Nc1cccc(CC(F)(F)F)c1 ZINC001148486503 1049326832 /nfs/dbraw/zinc/32/68/32/1049326832.db2.gz DLCYTGFDEPZOHD-UHFFFAOYSA-N -1 1 343.732 4.332 20 0 EIADMM O=C(c1ccc(C(F)(F)F)cc1[O-])N1C[C@@H]2C[C@H](C1)c1ccccc12 ZINC001148801279 1049381583 /nfs/dbraw/zinc/38/15/83/1049381583.db2.gz XDPRNBQOCUDDLG-TXEJJXNPSA-N -1 1 347.336 4.138 20 0 EIADMM Cn1nc(C(C)(C)C)cc1NC(=O)c1cccc(-c2ccccc2)c1[O-] ZINC001148861174 1049390153 /nfs/dbraw/zinc/39/01/53/1049390153.db2.gz NNKIDMDMTQLPQI-UHFFFAOYSA-N -1 1 349.434 4.343 20 0 EIADMM O=C(c1cccc(-c2ccccc2)c1[O-])N1CCC(=O)[C@@H]2CCCC[C@@H]21 ZINC001148860902 1049392064 /nfs/dbraw/zinc/39/20/64/1049392064.db2.gz APCVSYONGQQLOW-MJGOQNOKSA-N -1 1 349.430 4.033 20 0 EIADMM Cc1ccc(CO)cc1NC(=O)c1cccc(-c2ccccc2)c1[O-] ZINC001148861793 1049392148 /nfs/dbraw/zinc/39/21/48/1049392148.db2.gz YPJRLNIWXHKPSN-UHFFFAOYSA-N -1 1 333.387 4.112 20 0 EIADMM CCOC(=O)/C(=C/c1ccc([O-])c(Cl)c1)c1ccncc1Cl ZINC000812244088 1049397314 /nfs/dbraw/zinc/39/73/14/1049397314.db2.gz DKBOLPBXRPXZRY-KPKJPENVSA-N -1 1 338.190 4.198 20 0 EIADMM Cc1cc(Cl)cnc1[N-]S(=O)(=O)/C=C\c1ccc(Cl)cc1 ZINC000812338807 1049444494 /nfs/dbraw/zinc/44/44/94/1049444494.db2.gz QTKGRAPEXLYBHO-SREVYHEPSA-N -1 1 343.235 4.109 20 0 EIADMM CCN(C(=O)c1ncc2ccccc2c1[O-])[C@@H](C)c1ccc(F)cc1 ZINC001136315644 1049464477 /nfs/dbraw/zinc/46/44/77/1049464477.db2.gz GAWCNPSUWXYHEZ-ZDUSSCGKSA-N -1 1 338.382 4.303 20 0 EIADMM COc1cnc(C=Cc2ccc(-c3cccs3)cc2F)[n-]c1=O ZINC000821007695 1049594680 /nfs/dbraw/zinc/59/46/80/1049594680.db2.gz KHOQOYUFYAHDHU-SREVYHEPSA-N -1 1 328.368 4.229 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc3nc(Cl)sc3c2)cc1 ZINC000821095815 1049603261 /nfs/dbraw/zinc/60/32/61/1049603261.db2.gz ACRQNXSGRMZSJJ-UHFFFAOYSA-N -1 1 338.841 4.059 20 0 EIADMM COc1c(Cl)cc(NC(=O)c2ccc(F)c([O-])c2)cc1Cl ZINC001136523584 1049718808 /nfs/dbraw/zinc/71/88/08/1049718808.db2.gz WSCXBCMPCFUVRI-UHFFFAOYSA-N -1 1 330.142 4.099 20 0 EIADMM COc1ccccc1[C@H]1CCCCN1C(=O)c1ccc(Cl)cc1[O-] ZINC001136632418 1049800158 /nfs/dbraw/zinc/80/01/58/1049800158.db2.gz XAIONHBKJFHEHF-MRXNPFEDSA-N -1 1 345.826 4.422 20 0 EIADMM O=C(Nc1ccc([O-])c(F)c1F)[C@@H]1CCC[C@@H]1Cc1ccccc1 ZINC000616100559 1049846273 /nfs/dbraw/zinc/84/62/73/1049846273.db2.gz JVPQYRMIFKNUGK-ZIAGYGMSSA-N -1 1 331.362 4.268 20 0 EIADMM O=C(Nc1nc(/C=C/c2ccccc2)cs1)c1cccc([O-])c1F ZINC001136762875 1049868083 /nfs/dbraw/zinc/86/80/83/1049868083.db2.gz BQZQXQLNOVKBMY-MDZDMXLPSA-N -1 1 340.379 4.411 20 0 EIADMM CC(C)CCc1nnc([N-]C(=O)c2cc(-c3ccccc3)on2)s1 ZINC000617097988 1049949991 /nfs/dbraw/zinc/94/99/91/1049949991.db2.gz KZTOUGBYKZINQT-UHFFFAOYSA-N -1 1 342.424 4.034 20 0 EIADMM CCOc1cc(C(=O)N2CCC(C3CCC3)CC2)cc(Cl)c1[O-] ZINC000617774832 1050102737 /nfs/dbraw/zinc/10/27/37/1050102737.db2.gz MRRVYCHEGXHFCY-UHFFFAOYSA-N -1 1 337.847 4.097 20 0 EIADMM CC(C)(C)c1ccc(CNC(=O)c2ncc3ccccc3c2[O-])s1 ZINC001177211440 1050162755 /nfs/dbraw/zinc/16/27/55/1050162755.db2.gz IKXYXQRWZMTLQQ-UHFFFAOYSA-N -1 1 340.448 4.229 20 0 EIADMM COc1ccc(-c2ccccc2NC(=O)c2ccc([O-])cc2F)cc1 ZINC001186329140 1050287690 /nfs/dbraw/zinc/28/76/90/1050287690.db2.gz MGZSJSXWYMPWDM-UHFFFAOYSA-N -1 1 337.350 4.459 20 0 EIADMM Cc1ccnc(Cl)c1[N-]S(=O)(=O)c1csc2ccccc21 ZINC001186452297 1050320380 /nfs/dbraw/zinc/32/03/80/1050320380.db2.gz OCLJOFZNNCVASF-UHFFFAOYSA-N -1 1 338.841 4.059 20 0 EIADMM [O-]c1cnccc1-c1nc(-c2ccc(Cl)c(C(F)(F)F)c2)no1 ZINC001212721447 1050433636 /nfs/dbraw/zinc/43/36/36/1050433636.db2.gz QVYXMSFTBGGTDF-UHFFFAOYSA-N -1 1 341.676 4.176 20 0 EIADMM Cc1c(F)ccc([N-]S(=O)(=O)c2cc3c(s2)CCCC3)c1F ZINC001187215798 1050512033 /nfs/dbraw/zinc/51/20/33/1050512033.db2.gz VDXHKTWBOHWOOI-UHFFFAOYSA-N -1 1 343.420 4.014 20 0 EIADMM O=C(Nc1cccc(Br)c1)Nc1cc(F)c([O-])c(F)c1 ZINC001187464187 1050545856 /nfs/dbraw/zinc/54/58/56/1050545856.db2.gz OWTNAUBMDOJYRO-UHFFFAOYSA-N -1 1 343.127 4.077 20 0 EIADMM [O-]c1ccc(CNc2ncnc3c4ccccc4oc32)cc1Cl ZINC001187509621 1050550837 /nfs/dbraw/zinc/55/08/37/1050550837.db2.gz GVELBZQKIQSEGR-UHFFFAOYSA-N -1 1 325.755 4.347 20 0 EIADMM Cc1c(NCc2cccc([O-])c2Cl)cnn1-c1cccc(C)c1 ZINC001179007251 1050609508 /nfs/dbraw/zinc/60/95/08/1050609508.db2.gz USIAQCNGOGDDBB-UHFFFAOYSA-N -1 1 327.815 4.460 20 0 EIADMM COc1cc(Nc2c(Cl)ccc([O-])c2Cl)cc(OC)c1OC ZINC001173906183 1050618486 /nfs/dbraw/zinc/61/84/86/1050618486.db2.gz WUSQCUXGRWBMCV-UHFFFAOYSA-N -1 1 344.194 4.468 20 0 EIADMM COc1ccc(OC)c(OC)c1Nc1c(Cl)ccc([O-])c1Cl ZINC001174054932 1050693952 /nfs/dbraw/zinc/69/39/52/1050693952.db2.gz NAEVCPSNLOZEFT-UHFFFAOYSA-N -1 1 344.194 4.468 20 0 EIADMM Cc1ccc(-c2cc(C(=O)Nc3cc(F)c([O-])cc3Cl)on2)cc1 ZINC001179655133 1050737716 /nfs/dbraw/zinc/73/77/16/1050737716.db2.gz DSHUFWSIDDVTHO-UHFFFAOYSA-N -1 1 346.745 4.400 20 0 EIADMM C[C@@H](CCOc1ccccc1)C(=O)Nc1cc(F)c([O-])cc1Cl ZINC001179660478 1050741393 /nfs/dbraw/zinc/74/13/93/1050741393.db2.gz TVCHTGYNWDICBF-NSHDSACASA-N -1 1 337.778 4.228 20 0 EIADMM Cc1cnc(Cl)c(NC(=O)c2ccc([O-])c(C(F)(F)F)c2)c1 ZINC001188561851 1050792270 /nfs/dbraw/zinc/79/22/70/1050792270.db2.gz CXGNBDVQZNHODN-UHFFFAOYSA-N -1 1 330.693 4.020 20 0 EIADMM O=C(NC1CCCC1)c1cccc(Nc2cc(F)c([O-])cc2F)c1 ZINC001174197454 1050832494 /nfs/dbraw/zinc/83/24/94/1050832494.db2.gz GDRIDTCETPXBKH-UHFFFAOYSA-N -1 1 332.350 4.086 20 0 EIADMM Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000182866723 1050865625 /nfs/dbraw/zinc/86/56/25/1050865625.db2.gz VQKYPFODZKVIMD-UHFFFAOYSA-N -1 1 334.759 4.131 20 0 EIADMM CCc1ccc(C(=O)Nc2nc3c(s2)C[C@H](C(C)C)CC3)c([O-])c1 ZINC001180111448 1050888938 /nfs/dbraw/zinc/88/89/38/1050888938.db2.gz YFNFPEQOYRTDQQ-CYBMUJFWSA-N -1 1 344.480 4.424 20 0 EIADMM Cn1nc(C(F)(F)F)cc1Nc1ccc(Cl)c(Cl)c1[O-] ZINC001174327502 1050893788 /nfs/dbraw/zinc/89/37/88/1050893788.db2.gz QOWJFJWJZOQIAA-UHFFFAOYSA-N -1 1 326.105 4.195 20 0 EIADMM O=S(=O)([N-]CCC1=CCCCCC1)c1cc2cc(F)ccc2o1 ZINC001189064673 1050897157 /nfs/dbraw/zinc/89/71/57/1050897157.db2.gz VNDXVCNLVJFCSJ-UHFFFAOYSA-N -1 1 337.416 4.131 20 0 EIADMM Cc1nc(SC[C@@H]2CCC[C@@H](c3ccccc3)O2)[n-]c(=O)c1C ZINC001189061716 1050898184 /nfs/dbraw/zinc/89/81/84/1050898184.db2.gz RZBUAAYSLCWJGH-HOTGVXAUSA-N -1 1 330.453 4.202 20 0 EIADMM Cc1ncc(Br)cc1Nc1cc([O-])c(F)c(F)c1F ZINC001249959587 1050903048 /nfs/dbraw/zinc/90/30/48/1050903048.db2.gz YIQDQEIHYWCZNT-UHFFFAOYSA-N -1 1 333.107 4.019 20 0 EIADMM CC(=O)c1cccc(S(=O)(=O)[N-]c2ccc(C)c3ccccc23)c1 ZINC001189235541 1050933582 /nfs/dbraw/zinc/93/35/82/1050933582.db2.gz OGPYFEUXCLBDSC-UHFFFAOYSA-N -1 1 339.416 4.152 20 0 EIADMM CC(C)(C)[C@H]1CCC[C@H]([N-]S(=O)(=O)c2ccc(C(F)F)o2)CC1 ZINC001189288991 1050947882 /nfs/dbraw/zinc/94/78/82/1050947882.db2.gz LETGUWCEEJPVRO-RYUDHWBXSA-N -1 1 349.443 4.491 20 0 EIADMM O=S(=O)(Cc1ccc(F)c(F)c1)[N-]c1cc2ccccc2s1 ZINC001189272341 1050953507 /nfs/dbraw/zinc/95/35/07/1050953507.db2.gz FSZYNXIRVGQFMS-UHFFFAOYSA-N -1 1 339.388 4.121 20 0 EIADMM CCOc1cc(C(=O)N[C@H](C)C2CCC(F)CC2)cc(Cl)c1[O-] ZINC000619962185 1050969252 /nfs/dbraw/zinc/96/92/52/1050969252.db2.gz JEUCFJINXXKJJX-XSRFYTQQSA-N -1 1 343.826 4.091 20 0 EIADMM Cc1ccccc1CC1CN(C(=O)c2ccc(C(F)(F)F)c([O-])c2)C1 ZINC000620045878 1051008481 /nfs/dbraw/zinc/00/84/81/1051008481.db2.gz MXHSYGAUFLEFKM-UHFFFAOYSA-N -1 1 349.352 4.034 20 0 EIADMM O=C(Nc1cccc(F)c1[O-])NC(c1ccccc1)c1ccccc1 ZINC001189539619 1051014204 /nfs/dbraw/zinc/01/42/04/1051014204.db2.gz NDRHCSZDGROXOL-UHFFFAOYSA-N -1 1 336.366 4.442 20 0 EIADMM COc1cc(Nc2ccc(F)c(Br)c2[O-])cc(F)c1F ZINC001174586372 1051070204 /nfs/dbraw/zinc/07/02/04/1051070204.db2.gz ULBSVNUNBLTATD-UHFFFAOYSA-N -1 1 348.118 4.324 20 0 EIADMM CCc1ccccc1[N-]S(=O)(=O)c1cc(F)cc(C(F)(F)F)c1 ZINC001189982774 1051096749 /nfs/dbraw/zinc/09/67/49/1051096749.db2.gz YCYSTBXBCQIRJZ-UHFFFAOYSA-N -1 1 347.333 4.208 20 0 EIADMM [O-]c1c(Cl)cc(Cl)cc1Nc1cnn([C@H]2CCCCO2)c1 ZINC001174610876 1051108725 /nfs/dbraw/zinc/10/87/25/1051108725.db2.gz JYSDPHZYGLMYNH-CYBMUJFWSA-N -1 1 328.199 4.338 20 0 EIADMM CCC(C)(C)c1ccc(S(=O)(=O)[N-]c2ccc(F)c(O)c2)cc1 ZINC001190445081 1051175094 /nfs/dbraw/zinc/17/50/94/1051175094.db2.gz OPJUOKVPMZHIPV-UHFFFAOYSA-N -1 1 337.416 4.020 20 0 EIADMM CCC(C)(C)c1ccc(S(=O)(=O)[N-]c2ccc(C)nc2C)cc1 ZINC001190422974 1051180174 /nfs/dbraw/zinc/18/01/74/1051180174.db2.gz JWXHYEQROLFJOF-UHFFFAOYSA-N -1 1 332.469 4.187 20 0 EIADMM O=C(Cc1cccc(OC(F)(F)F)c1)Nc1ccc([O-])c(Cl)c1 ZINC000153640879 1051207207 /nfs/dbraw/zinc/20/72/07/1051207207.db2.gz NQFCAEJNVUPAGY-UHFFFAOYSA-N -1 1 345.704 4.125 20 0 EIADMM CN(Cc1nc(-c2ccccc2)c[nH]1)Cc1cccc([O-])c1Cl ZINC001181544374 1051251568 /nfs/dbraw/zinc/25/15/68/1051251568.db2.gz OLNXGLFSVJCJTJ-UHFFFAOYSA-N -1 1 327.815 4.068 20 0 EIADMM O=C(Nc1ccccc1OC(F)(F)F)Nc1cc(F)c([O-])cc1F ZINC001190683204 1051255912 /nfs/dbraw/zinc/25/59/12/1051255912.db2.gz CXYLKTTYGVSBSY-UHFFFAOYSA-N -1 1 348.227 4.213 20 0 EIADMM O=C(Nc1ccccc1OC(F)(F)F)Nc1c([O-])cccc1F ZINC001190682199 1051256256 /nfs/dbraw/zinc/25/62/56/1051256256.db2.gz SPCLMRGQQGEWSM-UHFFFAOYSA-N -1 1 330.237 4.074 20 0 EIADMM Cc1ncc(Nc2cc(Cl)c([O-])cc2F)cc1Br ZINC001250020260 1051303701 /nfs/dbraw/zinc/30/37/01/1051303701.db2.gz HQMWZHPNJMLSIZ-UHFFFAOYSA-N -1 1 331.572 4.394 20 0 EIADMM O=c1oc2cc([O-])ccc2cc1Nc1cc(C(F)(F)F)ccc1F ZINC001175076310 1051366190 /nfs/dbraw/zinc/36/61/90/1051366190.db2.gz SOIXWGSHYKKMFM-UHFFFAOYSA-N -1 1 339.244 4.400 20 0 EIADMM CC[C@H](C)C[C@H](C)NC(=O)c1ccccc1C(=O)c1ccc([O-])cc1 ZINC001191511171 1051472378 /nfs/dbraw/zinc/47/23/78/1051472378.db2.gz YKMOLNMTCPOZAS-GJZGRUSLSA-N -1 1 339.435 4.178 20 0 EIADMM CCS(=O)(=O)c1ccc([O-])c(Nc2cccc3ccsc32)c1 ZINC001175384266 1051565933 /nfs/dbraw/zinc/56/59/33/1051565933.db2.gz PSWFVHMEODIYOD-UHFFFAOYSA-N -1 1 333.434 4.144 20 0 EIADMM O=S(=O)(Cc1ccc(Cl)cc1F)[N-]c1ccccc1C(F)F ZINC001191893657 1051579302 /nfs/dbraw/zinc/57/93/02/1051579302.db2.gz JDDBCRHCAYIEBU-UHFFFAOYSA-N -1 1 349.761 4.359 20 0 EIADMM CCNC(=O)c1ccc(Nc2ccc(Cl)c(Cl)c2[O-])cc1 ZINC001175634047 1051685802 /nfs/dbraw/zinc/68/58/02/1051685802.db2.gz RXBIWOVHBBPZQT-UHFFFAOYSA-N -1 1 325.195 4.192 20 0 EIADMM [O-]c1c(Br)ccc(Cl)c1Nc1cccc2c[nH]nc21 ZINC001175639976 1051687231 /nfs/dbraw/zinc/68/72/31/1051687231.db2.gz LJRLVETYYYFVRU-UHFFFAOYSA-N -1 1 338.592 4.428 20 0 EIADMM O=C(Nc1ccc(OC(F)F)c(Cl)c1)Nc1c([O-])cccc1F ZINC001192314725 1051689521 /nfs/dbraw/zinc/68/95/21/1051689521.db2.gz MAHNBEYSAOONTO-UHFFFAOYSA-N -1 1 346.692 4.430 20 0 EIADMM Cc1cc([C@H](C)NC(=O)c2c(F)ccc([O-])c2F)ccc1Cl ZINC001192553228 1051756114 /nfs/dbraw/zinc/75/61/14/1051756114.db2.gz XORJKFOIDBYRQN-VIFPVBQESA-N -1 1 325.742 4.123 20 0 EIADMM O=C(Nc1ccccc1-c1nccs1)c1c(F)ccc([O-])c1F ZINC001192538730 1051764204 /nfs/dbraw/zinc/76/42/04/1051764204.db2.gz CDIYEBPVECPUIV-UHFFFAOYSA-N -1 1 332.331 4.046 20 0 EIADMM Cc1nc(-c2cccc(NC(=O)c3cc([O-])cc(F)c3F)c2)cs1 ZINC001192651348 1051780945 /nfs/dbraw/zinc/78/09/45/1051780945.db2.gz GTZZEEGTJLJBGC-UHFFFAOYSA-N -1 1 346.358 4.355 20 0 EIADMM O=C(Nc1cnc2cc(Cl)ccc2c1)c1cc([O-])cc(F)c1F ZINC001192651367 1051781848 /nfs/dbraw/zinc/78/18/48/1051781848.db2.gz HKFULNUUMFVBRP-UHFFFAOYSA-N -1 1 334.709 4.124 20 0 EIADMM O=C(Nc1ccc2c3c(cccc31)CC2)c1cc([O-])cc(F)c1F ZINC001192670093 1051788209 /nfs/dbraw/zinc/78/82/09/1051788209.db2.gz FAPAZVRYKNVRGJ-UHFFFAOYSA-N -1 1 325.314 4.175 20 0 EIADMM Cc1c(N[C@@H](C)C(C)C)cccc1C(=O)Nc1nc(Cl)ccc1[O-] ZINC001183210774 1051812204 /nfs/dbraw/zinc/81/22/04/1051812204.db2.gz YAZUEAFGZYMSPO-LBPRGKRZSA-N -1 1 347.846 4.458 20 0 EIADMM Cc1c(N[C@H](C)C(C)C)cccc1C(=O)Nc1nc(Cl)ccc1[O-] ZINC001183210773 1051812453 /nfs/dbraw/zinc/81/24/53/1051812453.db2.gz YAZUEAFGZYMSPO-GFCCVEGCSA-N -1 1 347.846 4.458 20 0 EIADMM COc1ccc(Nc2cc(Cl)c(C)c(Cl)c2[O-])cc1CO ZINC001175987411 1051859714 /nfs/dbraw/zinc/85/97/14/1051859714.db2.gz VBJVESQRJWKBIT-UHFFFAOYSA-N -1 1 328.195 4.252 20 0 EIADMM Cc1c2ccccc2oc1[C@@H](C)NCc1nc(=O)c2sccc2[n-]1 ZINC001193373741 1051911719 /nfs/dbraw/zinc/91/17/19/1051911719.db2.gz NHDRKSDEDJNILS-LLVKDONJSA-N -1 1 339.420 4.302 20 0 EIADMM O=S(=O)(CC1CCC1)[N-]c1ccccc1Oc1ccc(F)cc1 ZINC001193468406 1051928230 /nfs/dbraw/zinc/92/82/30/1051928230.db2.gz XPQHSOYKTNNWAN-UHFFFAOYSA-N -1 1 335.400 4.160 20 0 EIADMM Cc1cccc(Oc2ccccc2)c1[N-]S(=O)(=O)CC1CCC1 ZINC001193507019 1051940873 /nfs/dbraw/zinc/94/08/73/1051940873.db2.gz MXQOWEFKANBGKT-UHFFFAOYSA-N -1 1 331.437 4.329 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc(F)cc2C)c2ccccc12 ZINC001193824270 1052004612 /nfs/dbraw/zinc/00/46/12/1052004612.db2.gz FLAYXHXYGASDHA-UHFFFAOYSA-N -1 1 329.396 4.397 20 0 EIADMM O=C(N[C@H]1CCCC2(CC2)C1)c1c([O-])cnc2ccc(Cl)cc21 ZINC001184367655 1052005725 /nfs/dbraw/zinc/00/57/25/1052005725.db2.gz DZFBEVVAGODMIJ-LBPRGKRZSA-N -1 1 330.815 4.046 20 0 EIADMM [O-]c1cc(Nc2ccc(OCc3ccccc3)nc2)cc(F)c1F ZINC001176305499 1052010331 /nfs/dbraw/zinc/01/03/31/1052010331.db2.gz PPTCRQNKOAITEH-UHFFFAOYSA-N -1 1 328.318 4.388 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc3ccncc3c2)c2ccccc12 ZINC001193857654 1052015157 /nfs/dbraw/zinc/01/51/57/1052015157.db2.gz ODQIUPCELYFOKB-UHFFFAOYSA-N -1 1 348.427 4.497 20 0 EIADMM [O-]c1cc(F)cc(F)c1Nc1cccc2c1cnn2[C@@H]1CCCCO1 ZINC001176314431 1052018997 /nfs/dbraw/zinc/01/89/97/1052018997.db2.gz AQOPYUMWMYEDDN-KRWDZBQOSA-N -1 1 345.349 4.463 20 0 EIADMM CC(C)(C)c1nc([N-]c2cccc3c2cnn3[C@@H]2CCCCO2)no1 ZINC001176314839 1052019595 /nfs/dbraw/zinc/01/95/95/1052019595.db2.gz DPKUAEAMZBFFFG-HNNXBMFYSA-N -1 1 341.415 4.160 20 0 EIADMM Nc1ccccc1S(=O)(=O)[N-]c1ccc(C2CC2)c2ccccc12 ZINC001193931956 1052022890 /nfs/dbraw/zinc/02/28/90/1052022890.db2.gz JVSGMZQVPPSILB-UHFFFAOYSA-N -1 1 338.432 4.100 20 0 EIADMM O=C([O-])C[C@@H](NCc1ccc(-c2ccccc2F)o1)c1cccs1 ZINC000671162056 1052059553 /nfs/dbraw/zinc/05/95/53/1052059553.db2.gz JIJIBJIXMZANLG-OAHLLOKOSA-N -1 1 345.395 4.453 20 0 EIADMM O=C(Nc1cccc([O-])c1Br)Oc1ccc(Cl)cc1 ZINC001194065088 1052065888 /nfs/dbraw/zinc/06/58/88/1052065888.db2.gz KTYCFQOVMMZXGM-UHFFFAOYSA-N -1 1 342.576 4.419 20 0 EIADMM [O-]c1c(Cl)cc(Cl)cc1Nc1cnn(Cc2cccnc2)c1 ZINC001176456221 1052079398 /nfs/dbraw/zinc/07/93/98/1052079398.db2.gz HNBMMNZORIQBBX-UHFFFAOYSA-N -1 1 335.194 4.082 20 0 EIADMM Cc1c(Cl)cc(Nc2cnn(Cc3cccnc3)c2)c([O-])c1Cl ZINC001176458324 1052080102 /nfs/dbraw/zinc/08/01/02/1052080102.db2.gz PAORQHZATHMWAJ-UHFFFAOYSA-N -1 1 349.221 4.391 20 0 EIADMM Cc1ccc(F)c([N-]S(=O)(=O)c2ccc(-c3cccs3)cc2)n1 ZINC001194145427 1052087099 /nfs/dbraw/zinc/08/70/99/1052087099.db2.gz FOOBOEMSSXVCGY-UHFFFAOYSA-N -1 1 348.424 4.058 20 0 EIADMM CCCCCCOC(=O)Nc1cc(OC)cc(Br)c1[O-] ZINC001194185008 1052098687 /nfs/dbraw/zinc/09/86/87/1052098687.db2.gz DHGUNFSIGVWOJH-UHFFFAOYSA-N -1 1 346.221 4.292 20 0 EIADMM COc1c(Br)cccc1Nc1c(F)cc(F)c([O-])c1F ZINC001176670828 1052158250 /nfs/dbraw/zinc/15/82/50/1052158250.db2.gz MNLYKRQMRYQJMZ-UHFFFAOYSA-N -1 1 348.118 4.324 20 0 EIADMM COCCCOc1ccc(F)cc1Nc1c(F)cc(F)c([O-])c1F ZINC001176671740 1052159231 /nfs/dbraw/zinc/15/92/31/1052159231.db2.gz NAYCHFFTCXOCJV-UHFFFAOYSA-N -1 1 345.292 4.108 20 0 EIADMM Cc1cccc(C)c1S(=O)(=O)[N-]c1ccc(Cl)c2cnccc12 ZINC001194642404 1052183679 /nfs/dbraw/zinc/18/36/79/1052183679.db2.gz DTHSXCWISPZDIK-UHFFFAOYSA-N -1 1 346.839 4.306 20 0 EIADMM Cc1cccc(C)c1S(=O)(=O)[N-]c1ccc(-c2ccccn2)cc1 ZINC001194638189 1052184031 /nfs/dbraw/zinc/18/40/31/1052184031.db2.gz IOEVZKGPOGFFHH-UHFFFAOYSA-N -1 1 338.432 4.166 20 0 EIADMM Cc1cccc(C)c1S(=O)(=O)[N-]c1cccc(-c2ccccn2)c1 ZINC001194639376 1052184342 /nfs/dbraw/zinc/18/43/42/1052184342.db2.gz QMHDWBKNRSUAIA-UHFFFAOYSA-N -1 1 338.432 4.166 20 0 EIADMM CC(C)c1ccc(C(=O)[C@H](C)OC(=O)c2ccc([O-])cc2F)cc1 ZINC000773586730 1052192499 /nfs/dbraw/zinc/19/24/99/1052192499.db2.gz WMZYNNNXIIXJFE-LBPRGKRZSA-N -1 1 330.355 4.083 20 0 EIADMM CCCc1ccccc1[N-]S(=O)(=O)c1ccc(-c2cnco2)cc1 ZINC001185227996 1052197847 /nfs/dbraw/zinc/19/78/47/1052197847.db2.gz ZOQSKDCJMIYCKE-UHFFFAOYSA-N -1 1 342.420 4.095 20 0 EIADMM O=S(=O)([N-]c1ccc(C2CC2)cc1)c1ccc(-c2cnco2)cc1 ZINC001185226684 1052197962 /nfs/dbraw/zinc/19/79/62/1052197962.db2.gz AEZBDYYWXADIEL-UHFFFAOYSA-N -1 1 340.404 4.020 20 0 EIADMM CCCc1cccc([N-]S(=O)(=O)c2ccc(-c3cnco3)cc2)c1 ZINC001185232646 1052199478 /nfs/dbraw/zinc/19/94/78/1052199478.db2.gz JBHWFHFFMCYSEV-UHFFFAOYSA-N -1 1 342.420 4.095 20 0 EIADMM CCc1ccc(C(=O)N(CC(C)C)c2cccc(OC)c2)c([O-])c1 ZINC000622334884 1052213018 /nfs/dbraw/zinc/21/30/18/1052213018.db2.gz GMCRLELTPUYHIN-UHFFFAOYSA-N -1 1 327.424 4.266 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2cccc3cncc(C)c32)ccc1Cl ZINC001185529916 1052258048 /nfs/dbraw/zinc/25/80/48/1052258048.db2.gz OFYRCPKIXIKIGL-UHFFFAOYSA-N -1 1 346.839 4.306 20 0 EIADMM CN(C(=O)c1ccc(C(F)(F)F)cc1[O-])C1CCC(C)(C)CC1 ZINC000622424613 1052261487 /nfs/dbraw/zinc/26/14/87/1052261487.db2.gz CFORUXMXAAPNIM-UHFFFAOYSA-N -1 1 329.362 4.452 20 0 EIADMM CC(C)[C@H](CC(F)(F)F)NC(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000622543279 1052321527 /nfs/dbraw/zinc/32/15/27/1052321527.db2.gz GBSWNCQFYXXQDS-JTQLQIEISA-N -1 1 343.267 4.118 20 0 EIADMM C[C@@H](C1CCCCC1)N(C)C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000622586843 1052339007 /nfs/dbraw/zinc/33/90/07/1052339007.db2.gz MRVBMCFIKFREEB-NSHDSACASA-N -1 1 329.362 4.452 20 0 EIADMM CC(C)(C)[C@@H]1CCCN(C(=O)c2ccc(C(F)(F)F)cc2[O-])C1 ZINC000622574679 1052341376 /nfs/dbraw/zinc/34/13/76/1052341376.db2.gz VTSFEDVJNCZMAN-GFCCVEGCSA-N -1 1 329.362 4.309 20 0 EIADMM O=C([N-]c1c(F)cc(F)cc1F)c1cc(F)c(Cl)nc1Cl ZINC000072506559 1052374417 /nfs/dbraw/zinc/37/44/17/1052374417.db2.gz ZEKHYNFZHHRUTJ-UHFFFAOYSA-N -1 1 339.075 4.197 20 0 EIADMM CC(C)(C)C[C@H]1CCN(C(=O)c2ccc(C(F)(F)F)cc2[O-])C1 ZINC000622673481 1052383651 /nfs/dbraw/zinc/38/36/51/1052383651.db2.gz OVFPIOPKDVBBGA-LLVKDONJSA-N -1 1 329.362 4.309 20 0 EIADMM CCOC(=O)c1cnc(C(C)=Cc2ccc3ccccc3c2)[n-]c1=O ZINC000347483236 1052681537 /nfs/dbraw/zinc/68/15/37/1052681537.db2.gz MBPBUUBKKGOJHR-RAXLEYEMSA-N -1 1 334.375 4.073 20 0 EIADMM Cc1noc(C2CC2)c1[N-]C(=O)c1cc(-c2cccc(Cl)c2)on1 ZINC000184073424 1052991227 /nfs/dbraw/zinc/99/12/27/1052991227.db2.gz RROYNIAUEYMWJW-UHFFFAOYSA-N -1 1 343.770 4.421 20 0 EIADMM Cc1cc(C)c(C)c(S(=O)(=O)[N-]c2ccc3c(c2)N=NC3)c1C ZINC000039733787 1053078106 /nfs/dbraw/zinc/07/81/06/1053078106.db2.gz NYYLTSJPFFQRPV-UHFFFAOYSA-N -1 1 329.425 4.318 20 0 EIADMM CCC(CC)COC(=O)Nc1cc(OC)cc(Br)c1[O-] ZINC001194706961 1053083493 /nfs/dbraw/zinc/08/34/93/1053083493.db2.gz NMVFLYPZOXAWPV-UHFFFAOYSA-N -1 1 346.221 4.148 20 0 EIADMM Cc1sc(C)c2c1[n-]c(-c1cccc(NC(=O)C(C)C)c1)nc2=O ZINC000864355137 1053247571 /nfs/dbraw/zinc/24/75/71/1053247571.db2.gz KRZSFKSDSJJCIB-UHFFFAOYSA-N -1 1 341.436 4.275 20 0 EIADMM O=C(Nc1cc([O-])c(F)cc1F)Oc1ccccc1C(F)(F)F ZINC001195197215 1053326682 /nfs/dbraw/zinc/32/66/82/1053326682.db2.gz SGYFFDPIQWNZNW-UHFFFAOYSA-N -1 1 333.212 4.300 20 0 EIADMM O=C(Nc1cc(F)cc(F)c1[O-])Oc1ccccc1C(F)(F)F ZINC001195201290 1053328011 /nfs/dbraw/zinc/32/80/11/1053328011.db2.gz NKYOXCNOPJZAKV-UHFFFAOYSA-N -1 1 333.212 4.300 20 0 EIADMM Cc1ccc([O-])c(C(=O)N(C)Cc2ccccc2Oc2ccccc2)n1 ZINC001195322308 1053358637 /nfs/dbraw/zinc/35/86/37/1053358637.db2.gz BHFIJJZBVQZZIK-UHFFFAOYSA-N -1 1 348.402 4.160 20 0 EIADMM O=C(Nc1cccc(C(F)(F)F)c1[O-])c1nc(-c2ccccc2)c[nH]1 ZINC001195346076 1053376417 /nfs/dbraw/zinc/37/64/17/1053376417.db2.gz NCCHFZOYLIILID-UHFFFAOYSA-N -1 1 347.296 4.053 20 0 EIADMM Cc1cc(F)c([N-]S(=O)(=O)c2c(C)cccc2Cl)cc1F ZINC001195317221 1053377368 /nfs/dbraw/zinc/37/73/68/1053377368.db2.gz QMTACZJOJUURMV-UHFFFAOYSA-N -1 1 331.771 4.036 20 0 EIADMM CCOC(=O)NC(=S)[N-]c1ccc(Oc2cccc(C)c2)cc1 ZINC001195491428 1053422461 /nfs/dbraw/zinc/42/24/61/1053422461.db2.gz WWOXLBTWFGRZBU-UHFFFAOYSA-N -1 1 330.409 4.230 20 0 EIADMM Cc1c(=O)[n-]c(SCc2coc(C3CC3)n2)nc1-c1ccccc1 ZINC000865364659 1053484475 /nfs/dbraw/zinc/48/44/75/1053484475.db2.gz SRDGZUFBBRLKIG-UHFFFAOYSA-N -1 1 339.420 4.315 20 0 EIADMM Cc1nc(SCc2ccc(Cl)nc2Cl)[n-]c(=O)c1C1CC1 ZINC000865373333 1053485459 /nfs/dbraw/zinc/48/54/59/1053485459.db2.gz PRDSDJMBOQRTBT-UHFFFAOYSA-N -1 1 342.251 4.362 20 0 EIADMM [O-]c1ccc(NC(=S)Nc2ccc(C(F)(F)F)cc2)c(F)c1F ZINC001196188168 1053598179 /nfs/dbraw/zinc/59/81/79/1053598179.db2.gz SICKOSKQPKZHIR-UHFFFAOYSA-N -1 1 348.296 4.498 20 0 EIADMM O=C(NCCc1c(F)cc([O-])cc1F)Nc1ccc2sccc2c1 ZINC001196477159 1053676833 /nfs/dbraw/zinc/67/68/33/1053676833.db2.gz XBLGJYCEXZAYNR-UHFFFAOYSA-N -1 1 348.374 4.249 20 0 EIADMM O=C(Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)[C@@H](F)CC1CCCCC1 ZINC000794926302 1053752809 /nfs/dbraw/zinc/75/28/09/1053752809.db2.gz KXGHCAZKLKBIJW-HNNXBMFYSA-N -1 1 331.391 4.029 20 0 EIADMM O=c1oc2cc([O-])ccc2cc1NC1=CC[C@@H](C(F)(F)F)CC1 ZINC001196889386 1053790809 /nfs/dbraw/zinc/79/08/09/1053790809.db2.gz MKIFIMBDAYPGHW-SNVBAGLBSA-N -1 1 325.286 4.157 20 0 EIADMM C[C@@H]1CCC(C)(C)N1C(=O)c1ccc(NC(=O)OC(C)(C)C)cc1[O-] ZINC000854898040 1053855847 /nfs/dbraw/zinc/85/58/47/1053855847.db2.gz NPSZDPYQKBLTFX-GFCCVEGCSA-N -1 1 348.443 4.142 20 0 EIADMM Cc1csc([N-]S(=O)(=O)Cc2cc(Cl)ccc2Cl)c1 ZINC001197504530 1053929905 /nfs/dbraw/zinc/92/99/05/1053929905.db2.gz JDXVICCJOGOSEY-UHFFFAOYSA-N -1 1 336.265 4.305 20 0 EIADMM O=C(N[C@H]1C[C@H](c2cccc(Cl)c2)C1)c1ccc(Cl)cc1[O-] ZINC001626485038 1053971205 /nfs/dbraw/zinc/97/12/05/1053971205.db2.gz PKJUINPHVJWOFI-YEORSEQZSA-N -1 1 336.218 4.375 20 0 EIADMM O=C(Nc1cccc(C(F)(F)F)c1[O-])c1cccc(C2CCC2)n1 ZINC001197875385 1054012361 /nfs/dbraw/zinc/01/23/61/1054012361.db2.gz PIFDTCXRXRIWGX-UHFFFAOYSA-N -1 1 336.313 4.326 20 0 EIADMM Cc1nc(C(C)C)[n-]c(=O)c1C(=O)N1CCC[C@@H](C2CCCCC2)C1 ZINC000856306284 1054055383 /nfs/dbraw/zinc/05/53/83/1054055383.db2.gz ZKBIILIBXFHDGZ-MRXNPFEDSA-N -1 1 345.487 4.047 20 0 EIADMM CC(C)c1ccc(S(=O)(=O)[N-]c2cccc(-c3cc[nH]n3)c2)cc1 ZINC000032086196 1054091088 /nfs/dbraw/zinc/09/10/88/1054091088.db2.gz BTAZCNAPHFNCOK-UHFFFAOYSA-N -1 1 341.436 4.001 20 0 EIADMM C[C@@H](C(=O)[N-]OCCCC(F)(F)F)c1ccccc1C(F)(F)F ZINC000871213276 1054168889 /nfs/dbraw/zinc/16/88/89/1054168889.db2.gz NUXRHHXCOMIYGK-SECBINFHSA-N -1 1 343.267 4.199 20 0 EIADMM Cc1nc(SCc2cc(C(F)(F)F)co2)[n-]c(=O)c1C1CC1 ZINC000871679966 1054246349 /nfs/dbraw/zinc/24/63/49/1054246349.db2.gz SYRQZHMBTNKAGN-UHFFFAOYSA-N -1 1 330.331 4.272 20 0 EIADMM Cc1nc2ccc([N-]S(=O)(=O)c3ccc4occc4c3)cc2s1 ZINC001198854470 1054279451 /nfs/dbraw/zinc/27/94/51/1054279451.db2.gz CMTVGMFJFGGULR-UHFFFAOYSA-N -1 1 344.417 4.152 20 0 EIADMM O=C([N-]CC(F)(F)c1ccc(Cl)cc1)C(F)(F)c1ccccc1 ZINC000857504734 1054284267 /nfs/dbraw/zinc/28/42/67/1054284267.db2.gz ISMPDWOWUGYSSM-UHFFFAOYSA-N -1 1 345.723 4.340 20 0 EIADMM CCOc1ccc(S(=O)(=O)[N-]c2c(C)ccnc2C)cc1C(C)C ZINC000872005140 1054329987 /nfs/dbraw/zinc/32/99/87/1054329987.db2.gz SXYQQFVZNFLFQV-UHFFFAOYSA-N -1 1 348.468 4.021 20 0 EIADMM C[C@@H]1CN(CCOc2ccc(C(=O)[O-])cc2Cl)Cc2ccccc21 ZINC000872166804 1054421228 /nfs/dbraw/zinc/42/12/28/1054421228.db2.gz RZWHKCLGFBKRJT-CYBMUJFWSA-N -1 1 345.826 4.036 20 0 EIADMM O=c1nc(N2CCCC[C@H]2CCCc2ccccc2)cc(Cl)[n-]1 ZINC000858455011 1054492847 /nfs/dbraw/zinc/49/28/47/1054492847.db2.gz IMVGQTMKFKFIPH-HNNXBMFYSA-N -1 1 331.847 4.217 20 0 EIADMM CC(C)n1cc2c(n1)[C@H]([N-]c1nc(-c3ccc(F)cc3)no1)CCC2 ZINC000858475643 1054497169 /nfs/dbraw/zinc/49/71/69/1054497169.db2.gz DQUZHRUXAKBYIX-OAHLLOKOSA-N -1 1 341.390 4.143 20 0 EIADMM CCCOc1c(F)c(F)c([N-]c2noc3cccnc32)c(F)c1F ZINC001201300912 1054747834 /nfs/dbraw/zinc/74/78/34/1054747834.db2.gz ZKYVFPJBKSOLCS-UHFFFAOYSA-N -1 1 341.264 4.312 20 0 EIADMM COc1cc(OC(F)(F)F)ccc1Nc1ccc(F)c(F)c1[O-] ZINC001201362701 1054760779 /nfs/dbraw/zinc/76/07/79/1054760779.db2.gz MNMUVAUPFGVPKP-UHFFFAOYSA-N -1 1 335.228 4.321 20 0 EIADMM CC1(C)CCc2onc(C(=O)[N-]c3c(F)cc(Cl)cc3F)c2C1 ZINC000875528017 1054798056 /nfs/dbraw/zinc/79/80/56/1054798056.db2.gz RCVMYHXZEPGOFQ-UHFFFAOYSA-N -1 1 340.757 4.373 20 0 EIADMM O=C(CC1(O)CCCCC1)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000862294264 1055046100 /nfs/dbraw/zinc/04/61/00/1055046100.db2.gz DZVRPBQLJPUPEN-UHFFFAOYSA-N -1 1 333.815 4.223 20 0 EIADMM CC(C)Cc1ccc(S(=O)(=O)[N-]c2cccc3[nH]ccc32)cc1 ZINC000110401999 1055113916 /nfs/dbraw/zinc/11/39/16/1055113916.db2.gz JJHNRRCRBDYGJS-UHFFFAOYSA-N -1 1 328.437 4.167 20 0 EIADMM O=C(Nc1ccc(C(F)(F)F)cc1)Nc1cc(Cl)ncc1[O-] ZINC001202404617 1055159926 /nfs/dbraw/zinc/15/99/26/1055159926.db2.gz ZKZNAOBACVULNI-UHFFFAOYSA-N -1 1 331.681 4.103 20 0 EIADMM CC[C@H]1CCC[C@@]1(C)C(=O)N1CCC(C(=O)c2ccc([O-])cc2)CC1 ZINC000878046096 1055179860 /nfs/dbraw/zinc/17/98/60/1055179860.db2.gz QTHQIHQZPFNCTN-LAUBAEHRSA-N -1 1 343.467 4.030 20 0 EIADMM CCc1cccc2c(CC(=O)Nc3ccc([O-])c(Cl)c3)c[nH]c21 ZINC000111667045 1055226485 /nfs/dbraw/zinc/22/64/85/1055226485.db2.gz CMYUJCALAZBLJB-UHFFFAOYSA-N -1 1 328.799 4.271 20 0 EIADMM C[C@@H](c1ccc(Br)cc1)N1CCC(CCC(=O)[O-])CC1 ZINC000086755665 1055269658 /nfs/dbraw/zinc/26/96/58/1055269658.db2.gz DIBJJOVPAKXYCJ-LBPRGKRZSA-N -1 1 340.261 4.087 20 0 EIADMM CCc1oc2ccccc2c1CN(C)C(=O)c1c(F)ccc([O-])c1F ZINC000347630308 1055544034 /nfs/dbraw/zinc/54/40/34/1055544034.db2.gz DGWFVSNNVKXPFW-UHFFFAOYSA-N -1 1 345.345 4.251 20 0 EIADMM CC[C@@H](C)c1ccc(S(=O)(=O)[N-]c2cccc(C(C)=O)c2)cc1 ZINC000007056220 1056761850 /nfs/dbraw/zinc/76/18/50/1056761850.db2.gz AAFIKSRVSRGUMS-CYBMUJFWSA-N -1 1 331.437 4.204 20 0 EIADMM Cc1ccc(Cl)cc1[N-]S(=O)(=O)c1ccc(F)c(Cl)c1 ZINC000007409002 1056795534 /nfs/dbraw/zinc/79/55/34/1056795534.db2.gz QZOBLETUNHHMON-UHFFFAOYSA-N -1 1 334.199 4.242 20 0 EIADMM O=S(=O)([N-]c1ccc2ccccc2c1)c1ccc2ncccc2c1 ZINC000741646448 1058322504 /nfs/dbraw/zinc/32/25/04/1058322504.db2.gz DXEDQYYYGIZSQM-UHFFFAOYSA-N -1 1 334.400 4.189 20 0 EIADMM CC(=O)c1ccc([O-])c(CCOC(=O)c2ccc(C(C)C)cc2)c1 ZINC000744474019 1059542478 /nfs/dbraw/zinc/54/24/78/1059542478.db2.gz NEBOEWJZHPUCCN-UHFFFAOYSA-N -1 1 326.392 4.118 20 0 EIADMM CC(=O)c1ccc([O-])c(CCOC(=O)Cc2cccc3ccccc32)c1 ZINC000744478456 1059547105 /nfs/dbraw/zinc/54/71/05/1059547105.db2.gz WISQIOHJILOXAH-UHFFFAOYSA-N -1 1 348.398 4.076 20 0 EIADMM CC[C@@H](CC(=O)OCCc1cc(C(C)=O)ccc1[O-])c1ccccc1 ZINC000744957032 1059676850 /nfs/dbraw/zinc/67/68/50/1059676850.db2.gz LIBSAFQUECURIO-INIZCTEOSA-N -1 1 340.419 4.264 20 0 EIADMM O=C(Nc1ccc(-n2ccc(=O)[n-]2)cc1)[C@@H]1CC[C@@H]2CCCC[C@@H]2C1 ZINC001168913916 1060517037 /nfs/dbraw/zinc/51/70/37/1060517037.db2.gz HKUXAPDBJKUPGQ-ARFHVFGLSA-N -1 1 339.439 4.123 20 0 EIADMM CC1=C(C)C[C@](C)(C(=O)Nc2ccc(-n3ccc(=O)[n-]3)cc2)CC1 ZINC001168921828 1060521512 /nfs/dbraw/zinc/52/15/12/1060521512.db2.gz FYXMGUFINKFGEY-LJQANCHMSA-N -1 1 325.412 4.043 20 0 EIADMM CCOc1cc(C(=O)N2CCc3cc(C)c(C)cc32)cc(Cl)c1[O-] ZINC000804321451 1060815163 /nfs/dbraw/zinc/81/51/63/1060815163.db2.gz UWCXLMSLWFSKRY-UHFFFAOYSA-N -1 1 345.826 4.264 20 0 EIADMM Cn1c2ccc(Br)cc2nc1-c1ccc([O-])c(Cl)c1 ZINC000037442061 213146500 /nfs/dbraw/zinc/14/65/00/213146500.db2.gz IJURVFXFPCXTQO-UHFFFAOYSA-N -1 1 337.604 4.362 20 0 EIADMM CCOc1cc(C(=O)NC[C@H](CC)c2ccccc2)cc(Cl)c1[O-] ZINC000216507130 1032305034 /nfs/dbraw/zinc/30/50/34/1032305034.db2.gz ZDWVMBWILCTAIG-ZDUSSCGKSA-N -1 1 347.842 4.368 20 0 EIADMM Cc1oc(-c2ccccc2)nc1C(=O)Nc1ccc(Cl)cc1[O-] ZINC000532838482 1032342209 /nfs/dbraw/zinc/34/22/09/1032342209.db2.gz ZARQCKWASUROTD-UHFFFAOYSA-N -1 1 328.755 4.261 20 0 EIADMM CCC1(C(=O)Nc2cc(Cl)c([O-])c3ccccc23)CCOCC1 ZINC000529539364 1032444310 /nfs/dbraw/zinc/44/43/10/1032444310.db2.gz RGOIKLKIHRQNNY-UHFFFAOYSA-N -1 1 333.815 4.344 20 0 EIADMM CO[C@@H]1CCCC[C@@H]1C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000529539295 1032444779 /nfs/dbraw/zinc/44/47/79/1032444779.db2.gz QEIUWIYTDSBOQQ-XJKSGUPXSA-N -1 1 333.815 4.343 20 0 EIADMM Cc1cc(C(=O)CCc2nc(-c3ccc([O-])c(F)c3)no2)c(C)s1 ZINC000445475900 1032502107 /nfs/dbraw/zinc/50/21/07/1032502107.db2.gz WFAIROLHHQDCBC-UHFFFAOYSA-N -1 1 346.383 4.075 20 0 EIADMM Cc1nc(-c2ccc(NCc3cccc(C(C)C)c3)nc2)[n-]c(=O)c1C ZINC000475744249 1032573577 /nfs/dbraw/zinc/57/35/77/1032573577.db2.gz PDAJXFTZDVUEGB-UHFFFAOYSA-N -1 1 348.450 4.018 20 0 EIADMM O=C([N-]c1nnc(-c2ccco2)s1)c1cc(Cl)sc1Cl ZINC000053210166 1018845164 /nfs/dbraw/zinc/84/51/64/1018845164.db2.gz BIGLVWVVLGRCPP-UHFFFAOYSA-N -1 1 346.220 4.419 20 0 EIADMM CC(C)(C)c1ccc(CN[C@H](C(=O)[O-])c2cc(F)ccc2F)cc1 ZINC000683172347 1019092638 /nfs/dbraw/zinc/09/26/38/1019092638.db2.gz DIVGUCSFXKLJKN-KRWDZBQOSA-N -1 1 333.378 4.178 20 0 EIADMM O=C([O-])[C@@H](NCc1ccc(Cl)c(Cl)c1)c1cc(F)ccc1F ZINC000683173661 1019098817 /nfs/dbraw/zinc/09/88/17/1019098817.db2.gz NNZBUSPXFGZKEP-AWEZNQCLSA-N -1 1 346.160 4.187 20 0 EIADMM COc1cc(-c2ccccc2)ccc1CNCc1cccc(C(=O)[O-])c1 ZINC000683176129 1019103783 /nfs/dbraw/zinc/10/37/83/1019103783.db2.gz HQFQFHFWHRGNEE-UHFFFAOYSA-N -1 1 347.414 4.350 20 0 EIADMM CCCc1cc(=O)[n-]c(SCc2csc(-c3ccsc3)n2)n1 ZINC000014755494 1019312647 /nfs/dbraw/zinc/31/26/47/1019312647.db2.gz PQKPOOZQWKSOBX-UHFFFAOYSA-N -1 1 349.506 4.200 20 0 EIADMM C[C@H](c1ccc2ccccc2c1)N(C(=O)c1cncc([O-])c1)C1CC1 ZINC000339819676 1019887794 /nfs/dbraw/zinc/88/77/94/1019887794.db2.gz IHNSPSOZVRJUCF-CQSZACIVSA-N -1 1 332.403 4.306 20 0 EIADMM CC(C)(C(=O)[O-])[C@H]1CCCN(Cc2csc(C3CCCC3)n2)C1 ZINC000652499935 1020537421 /nfs/dbraw/zinc/53/74/21/1020537421.db2.gz SQCHQKNRGGZCKO-AWEZNQCLSA-N -1 1 336.501 4.124 20 0 EIADMM Cc1ccc(-c2nc(C)c(C(=O)Nc3ccc(F)cc3[O-])s2)o1 ZINC000340327354 1020765625 /nfs/dbraw/zinc/76/56/25/1020765625.db2.gz HEZQQUPRXYBGPQ-UHFFFAOYSA-N -1 1 332.356 4.117 20 0 EIADMM Cc1ccsc1-c1nsc([N-]C(=O)c2coc(C3CCC3)n2)n1 ZINC000683451155 1020849703 /nfs/dbraw/zinc/84/97/03/1020849703.db2.gz KCCNEZDNQNUKKS-UHFFFAOYSA-N -1 1 346.437 4.083 20 0 EIADMM C[C@@H](Oc1cccc2ccccc21)C(=O)Nc1c([O-])cccc1F ZINC000683494692 1020857549 /nfs/dbraw/zinc/85/75/49/1020857549.db2.gz FFSQJLRANLDVRL-GFCCVEGCSA-N -1 1 325.339 4.091 20 0 EIADMM [O-]c1ccc(-c2noc(C3CC(OCc4ccccc4)C3)n2)c(F)c1 ZINC000683591832 1020944425 /nfs/dbraw/zinc/94/44/25/1020944425.db2.gz CDTKJGWHTAYWFS-UHFFFAOYSA-N -1 1 340.354 4.044 20 0 EIADMM CC(C)n1cc(Nc2cc(Br)cc(Cl)c2[O-])cn1 ZINC001210324507 1021030446 /nfs/dbraw/zinc/03/04/46/1021030446.db2.gz QDJJFDMVWZENOE-UHFFFAOYSA-N -1 1 330.613 4.329 20 0 EIADMM CC(C)c1ccc(S(=O)(=O)[N-]c2ccccc2N2CCCC2)cc1 ZINC000612796943 1021380502 /nfs/dbraw/zinc/38/05/02/1021380502.db2.gz LNDBUGRKUXJAAN-UHFFFAOYSA-N -1 1 344.480 4.211 20 0 EIADMM CC(C)[C@H]1CN([C@H](C(=O)[O-])c2cccc(Cl)c2Cl)CCS1 ZINC000580085807 1021628175 /nfs/dbraw/zinc/62/81/75/1021628175.db2.gz UJGQBJBZZLPPMX-OCCSQVGLSA-N -1 1 348.295 4.193 20 0 EIADMM CCc1cc(=O)[n-]c(SCCc2cc(Cl)ccc2Cl)n1 ZINC000447308790 1033001007 /nfs/dbraw/zinc/00/10/07/1033001007.db2.gz ICOHLIVSXJGNIV-UHFFFAOYSA-N -1 1 329.252 4.386 20 0 EIADMM Cc1c2cc(F)ccc2sc1C([O-])=C(C#N)c1cc(C)nc(C)n1 ZINC000066506488 1021868356 /nfs/dbraw/zinc/86/83/56/1021868356.db2.gz VKUIFHYEQUREHR-CQSZACIVSA-N -1 1 339.395 4.246 20 0 EIADMM O=C([O-])C[C@H](NCc1ccccc1F)c1cccc(C(F)(F)F)c1 ZINC000340676042 1021894186 /nfs/dbraw/zinc/89/41/86/1021894186.db2.gz HVSOZPHXOYLBLS-HNNXBMFYSA-N -1 1 341.304 4.150 20 0 EIADMM CCCS(=O)(=O)[N-]c1cccc(-c2ccc3ccccc3c2)n1 ZINC000462367730 1022171031 /nfs/dbraw/zinc/17/10/31/1022171031.db2.gz DQVZHDFRWZOVEY-UHFFFAOYSA-N -1 1 326.421 4.054 20 0 EIADMM O=C([O-])c1csc(CN2CCCCC[C@@H]2/C=C/c2ccccc2)n1 ZINC000580720471 1022406124 /nfs/dbraw/zinc/40/61/24/1022406124.db2.gz JTWMBCQIQBYEQJ-SIFUEBAJSA-N -1 1 342.464 4.299 20 0 EIADMM COc1cccc([C@@H](C)CCCC(=O)Nc2c([O-])cccc2F)c1 ZINC000684058092 1022518478 /nfs/dbraw/zinc/51/84/78/1022518478.db2.gz UEIXENOKPYOPQS-ZDUSSCGKSA-N -1 1 331.387 4.452 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cccc([C@H]4CCCOC4)c3)n2)c(F)c1 ZINC000580872510 1022642478 /nfs/dbraw/zinc/64/24/78/1022642478.db2.gz QXJXQIUXHAGFAA-AWEZNQCLSA-N -1 1 340.354 4.142 20 0 EIADMM Cc1ccccc1C1CC(N(Cc2nc(C(=O)[O-])cs2)C2CC2)C1 ZINC000580955734 1022748726 /nfs/dbraw/zinc/74/87/26/1022748726.db2.gz OCVZOFJBZGQSDN-UHFFFAOYSA-N -1 1 342.464 4.060 20 0 EIADMM CCC(CC)c1nnc([N-]C(=O)c2sccc2OC(F)F)s1 ZINC000104303931 1022751023 /nfs/dbraw/zinc/75/10/23/1022751023.db2.gz ASKJKPZCGLMWID-UHFFFAOYSA-N -1 1 347.412 4.357 20 0 EIADMM CCN(C(=O)c1ncc2ccccc2c1[O-])[C@H](C)Cc1ccsc1 ZINC000613701748 1022800903 /nfs/dbraw/zinc/80/09/03/1022800903.db2.gz NLKNVWGMIWUHPW-CYBMUJFWSA-N -1 1 340.448 4.095 20 0 EIADMM CC(C)c1nnc([N-]C(=O)c2coc(-c3ccccc3Cl)n2)s1 ZINC000345080297 1033096638 /nfs/dbraw/zinc/09/66/38/1033096638.db2.gz VSSBZSGWMGDOQZ-UHFFFAOYSA-N -1 1 348.815 4.222 20 0 EIADMM C[C@H](c1cccs1)N(C)C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000180410863 1023229249 /nfs/dbraw/zinc/22/92/49/1023229249.db2.gz CAHFFAQVABGQNN-SECBINFHSA-N -1 1 329.343 4.306 20 0 EIADMM C[C@H](NC(=O)c1ccc([O-])cc1F)c1ccc(C(F)(F)F)cc1 ZINC000181116051 1023231634 /nfs/dbraw/zinc/23/16/34/1023231634.db2.gz ZHMZDRPVCGAZJX-VIFPVBQESA-N -1 1 327.277 4.041 20 0 EIADMM O=C([O-])c1cccc(CN2CCC(c3c(F)cccc3F)CC2)c1 ZINC000414636605 1023303035 /nfs/dbraw/zinc/30/30/35/1023303035.db2.gz KIDLNAGTJOLRTA-UHFFFAOYSA-N -1 1 331.362 4.043 20 0 EIADMM Cc1ncsc1CN[C@H](CC(=O)[O-])c1cc(Cl)cc(Cl)c1 ZINC000417556952 1023354316 /nfs/dbraw/zinc/35/43/16/1023354316.db2.gz AHJGDYSEJFHQNC-GFCCVEGCSA-N -1 1 345.251 4.064 20 0 EIADMM COc1cc(CN[C@@H](CC(=O)[O-])c2ccc(C)o2)cc2ccccc21 ZINC000417567207 1023361788 /nfs/dbraw/zinc/36/17/88/1023361788.db2.gz JDSDWYFLPZEFII-KRWDZBQOSA-N -1 1 339.391 4.055 20 0 EIADMM C[C@@H](OC(C)(C)C)[C@H](NCc1ccc(-c2ccccc2)s1)C(=O)[O-] ZINC000417585321 1023366405 /nfs/dbraw/zinc/36/64/05/1023366405.db2.gz OOIYHZJSYNNBNB-DYVFJYSZSA-N -1 1 347.480 4.162 20 0 EIADMM O=C([O-])[C@@H]1C[C@@H](NCc2csc(Cl)c2Cl)c2ccccc21 ZINC000417637523 1023391624 /nfs/dbraw/zinc/39/16/24/1023391624.db2.gz ZABGPKPTFJJQRN-VXGBXAGGSA-N -1 1 342.247 4.458 20 0 EIADMM Cc1cc(CNCc2ccc(C(=O)[O-])c(C)c2)c(OC(F)F)cc1C ZINC000417665267 1023401168 /nfs/dbraw/zinc/40/11/68/1023401168.db2.gz CFKYHENVTZQWDO-UHFFFAOYSA-N -1 1 349.377 4.201 20 0 EIADMM Cc1cc(CNCc2cnc(C3CCCC3)s2)ccc1C(=O)[O-] ZINC000417674319 1023403935 /nfs/dbraw/zinc/40/39/35/1023403935.db2.gz YWMUFCQKBVGLQM-UHFFFAOYSA-N -1 1 330.453 4.097 20 0 EIADMM C[C@@H]1CC[C@H](C(=O)[O-])[C@H](C)N1Cc1nc(C2CCCCC2)cs1 ZINC000581619479 1023433490 /nfs/dbraw/zinc/43/34/90/1023433490.db2.gz YCQNLGJDZJQCRD-IPYPFGDCSA-N -1 1 336.501 4.264 20 0 EIADMM Cc1ccc(C(F)(F)F)c([N-]S(=O)(=O)Cc2ccccc2C)c1 ZINC000656741776 1023477455 /nfs/dbraw/zinc/47/74/55/1023477455.db2.gz OZXVZWROQZCIHQ-UHFFFAOYSA-N -1 1 343.370 4.264 20 0 EIADMM CC(C)(C)[C@@H]1CCN(C(=O)c2c([O-])cnc3ccc(Cl)cc32)C1 ZINC000549224623 1023491906 /nfs/dbraw/zinc/49/19/06/1023491906.db2.gz YWMORAOSMMNNPO-LLVKDONJSA-N -1 1 332.831 4.102 20 0 EIADMM CCc1ccccc1[C@@H]1C[C@H]1C(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC000549242006 1023532062 /nfs/dbraw/zinc/53/20/62/1023532062.db2.gz SXCSTWRYWQFPEL-ZWKOTPCHSA-N -1 1 347.418 4.087 20 0 EIADMM C[C@@H](Oc1ccccc1NC(=O)c1ccc([O-])c(F)c1)C(F)(F)F ZINC000644504727 1023614222 /nfs/dbraw/zinc/61/42/22/1023614222.db2.gz NCNRSISPSWNOIA-SECBINFHSA-N -1 1 343.276 4.113 20 0 EIADMM Cc1nc2cc([N-]S(=O)(=O)c3ccc4ccccc4c3)ccc2o1 ZINC000008109851 1023684689 /nfs/dbraw/zinc/68/46/89/1023684689.db2.gz CYWJHGTYBHEVOL-UHFFFAOYSA-N -1 1 338.388 4.090 20 0 EIADMM CC(=O)c1ccc(C(=O)[N-]c2c(C)noc2-c2ccccc2)s1 ZINC000349563313 1023919645 /nfs/dbraw/zinc/91/96/45/1023919645.db2.gz GHQHEFWVVLQYSD-UHFFFAOYSA-N -1 1 326.377 4.166 20 0 EIADMM CCc1nc(SCc2cc(C)nc3ccccc23)[n-]c(=O)c1C ZINC000581954656 1023929576 /nfs/dbraw/zinc/92/95/76/1023929576.db2.gz GGMIESCKLWENMA-UHFFFAOYSA-N -1 1 325.437 4.202 20 0 EIADMM Cc1cc(Cl)ccc1[N-]S(=O)(=O)c1cccc(Cl)c1C ZINC000048652596 1024670191 /nfs/dbraw/zinc/67/01/91/1024670191.db2.gz OOEJJWHZUTUOGV-UHFFFAOYSA-N -1 1 330.236 4.411 20 0 EIADMM Cc1ccc(F)c(S(=O)(=O)[N-]c2cc(Cl)ccc2Cl)c1 ZINC000048652421 1024671739 /nfs/dbraw/zinc/67/17/39/1024671739.db2.gz IAYSPOVKOMZVCN-UHFFFAOYSA-N -1 1 334.199 4.242 20 0 EIADMM Cc1ccc([C@@H](CC(=O)[O-])NCc2cc(Cl)cc(Cl)c2)o1 ZINC000426776943 1024760187 /nfs/dbraw/zinc/76/01/87/1024760187.db2.gz JBCXSSKJSJHMNW-CYBMUJFWSA-N -1 1 328.195 4.200 20 0 EIADMM O=C([O-])c1sccc1CN(CCC(F)(F)F)Cc1ccccc1 ZINC000652433070 1024828641 /nfs/dbraw/zinc/82/86/41/1024828641.db2.gz PVVVRRWFZDQCRW-UHFFFAOYSA-N -1 1 343.370 4.401 20 0 EIADMM Cc1cc(C)cc(C2=CCN(Cc3ccc(C(=O)[O-])cc3F)CC2)c1 ZINC000652442405 1024836550 /nfs/dbraw/zinc/83/65/50/1024836550.db2.gz CMSDKHVRDJLCSO-UHFFFAOYSA-N -1 1 339.410 4.430 20 0 EIADMM CSc1cccc(C)c1[N-]S(=O)(=O)c1ccc2ncccc2c1 ZINC000471969963 1024836642 /nfs/dbraw/zinc/83/66/42/1024836642.db2.gz LDWHMFGPPIHYPZ-UHFFFAOYSA-N -1 1 344.461 4.066 20 0 EIADMM Cc1ccc(-c2csc(CN3CCC[C@@H](CCC(=O)[O-])C3)n2)cc1 ZINC000652495357 1024854630 /nfs/dbraw/zinc/85/46/30/1024854630.db2.gz UNILHGMFFRWGOK-HNNXBMFYSA-N -1 1 344.480 4.195 20 0 EIADMM CC(C)Oc1ccc([N-]S(=O)(=O)c2cccc(C(F)F)c2)cc1 ZINC000780374774 1024959090 /nfs/dbraw/zinc/95/90/90/1024959090.db2.gz DBNDTMMOIXFWRQ-UHFFFAOYSA-N -1 1 341.379 4.212 20 0 EIADMM CCCOc1ccc(S(=O)(=O)[N-]c2cccnc2C)cc1C(C)C ZINC000663298916 1025013165 /nfs/dbraw/zinc/01/31/65/1025013165.db2.gz BNMGJSRKTOMWDX-UHFFFAOYSA-N -1 1 348.468 4.103 20 0 EIADMM C[C@@H]1CCN(C(=O)c2cc3ccccc3cc2[O-])c2c(O)cccc21 ZINC000186255986 1025024246 /nfs/dbraw/zinc/02/42/46/1025024246.db2.gz IGEFTFXOQBNFKH-CYBMUJFWSA-N -1 1 333.387 4.405 20 0 EIADMM CCOc1cccc([N-]S(=O)(=O)c2cccc3ccccc32)c1 ZINC000323548166 1025222870 /nfs/dbraw/zinc/22/28/70/1025222870.db2.gz OHKOCTAWIPBQNH-UHFFFAOYSA-N -1 1 327.405 4.039 20 0 EIADMM CSc1ccc([N-]S(=O)(=O)c2cccc(C(F)(F)F)c2)cc1 ZINC000007745743 1025450112 /nfs/dbraw/zinc/45/01/12/1025450112.db2.gz RPZVKHAVOIVUFJ-UHFFFAOYSA-N -1 1 347.383 4.228 20 0 EIADMM CCc1nc(SCCOc2ccc(F)cc2Cl)[n-]c(=O)c1C ZINC000657263778 1025458870 /nfs/dbraw/zinc/45/88/70/1025458870.db2.gz HYMYWZRCAGOATP-UHFFFAOYSA-N -1 1 342.823 4.017 20 0 EIADMM CCc1nc(SCc2cc(F)ccc2OC(F)F)[n-]c(=O)c1C ZINC000657264590 1025466583 /nfs/dbraw/zinc/46/65/83/1025466583.db2.gz VXMJQKIOQLBKNT-UHFFFAOYSA-N -1 1 344.358 4.086 20 0 EIADMM Cc1cc(C)cc(-c2nnc(SCC(=O)c3ccc([O-])cc3)o2)c1 ZINC000008174398 1025579221 /nfs/dbraw/zinc/57/92/21/1025579221.db2.gz BZPVLRVULKQONE-UHFFFAOYSA-N -1 1 340.404 4.034 20 0 EIADMM O=C([O-])c1ccc(C[N@H+]2CC[C@H](C(F)(F)F)C3(CCC3)C2)s1 ZINC000563282394 1026327756 /nfs/dbraw/zinc/32/77/56/1026327756.db2.gz KTSGJGQMODDENM-LBPRGKRZSA-N -1 1 333.375 4.001 20 0 EIADMM CCc1cc(=O)[n-]c(SCc2ncc(-c3ccccc3C)o2)n1 ZINC000519581500 1026466515 /nfs/dbraw/zinc/46/65/15/1026466515.db2.gz VBQDJNYRMPLSHA-UHFFFAOYSA-N -1 1 327.409 4.000 20 0 EIADMM Cc1cc2cc(CN[C@@H](CC(=O)[O-])c3ccsc3)oc2cc1C ZINC000426697775 1026484175 /nfs/dbraw/zinc/48/41/75/1026484175.db2.gz XOUAFDSKEWRJHL-INIZCTEOSA-N -1 1 329.421 4.417 20 0 EIADMM Cc1ccc(-c2ccc(CNCc3ccccc3CC(=O)[O-])o2)cc1 ZINC000426712674 1026509078 /nfs/dbraw/zinc/50/90/78/1026509078.db2.gz XZMUAXGGVUWPNA-UHFFFAOYSA-N -1 1 335.403 4.172 20 0 EIADMM O=C([O-])[C@H](NCc1cc(F)cc(Cl)c1)c1ccc(Cl)c(F)c1 ZINC000426752890 1026538330 /nfs/dbraw/zinc/53/83/30/1026538330.db2.gz FWMCRLWYGROPML-CQSZACIVSA-N -1 1 346.160 4.187 20 0 EIADMM Cc1ccc(CN[C@@H](CC(=O)[O-])c2cc(Cl)cc(Cl)c2)nc1 ZINC000426754962 1026540852 /nfs/dbraw/zinc/54/08/52/1026540852.db2.gz VLZIWPQZUHPWMK-HNNXBMFYSA-N -1 1 339.222 4.002 20 0 EIADMM CC(C)c1ccc([C@H](CC(=O)[O-])NCc2cc(F)ccc2F)cc1 ZINC000426769985 1026548275 /nfs/dbraw/zinc/54/82/75/1026548275.db2.gz NQNYYVPJCXUECE-SFHVURJKSA-N -1 1 333.378 4.394 20 0 EIADMM CCc1ccc(-c2ccc(CN[C@@H](CC(C)(C)C)C(=O)[O-])o2)cc1 ZINC000426778241 1026552857 /nfs/dbraw/zinc/55/28/57/1026552857.db2.gz VYGVDVIMJFSEDW-KRWDZBQOSA-N -1 1 329.440 4.488 20 0 EIADMM O=C([O-])[C@@H](NCc1ccc(Cl)c(Cl)c1)c1ccccc1F ZINC000426782904 1026556465 /nfs/dbraw/zinc/55/64/65/1026556465.db2.gz IARROWAIYIHHSZ-AWEZNQCLSA-N -1 1 328.170 4.048 20 0 EIADMM O=C([O-])[C@H](NCc1cc(C(F)(F)F)ccc1Cl)c1ccsc1 ZINC000426783747 1026557720 /nfs/dbraw/zinc/55/77/20/1026557720.db2.gz NGUGMLWASBSESY-GFCCVEGCSA-N -1 1 349.761 4.336 20 0 EIADMM O=C([O-])[C@H](NCc1ccc(Cl)cc1Cl)c1cccc(F)c1 ZINC000426805858 1026560677 /nfs/dbraw/zinc/56/06/77/1026560677.db2.gz GKORRKHVTSPGIS-CQSZACIVSA-N -1 1 328.170 4.048 20 0 EIADMM O=C([O-])[C@H](NCc1ccc(-c2cccc(F)c2)s1)c1ccccc1 ZINC000426803216 1026571876 /nfs/dbraw/zinc/57/18/76/1026571876.db2.gz LDJFAFKIOKUSHL-GOSISDBHSA-N -1 1 341.407 4.470 20 0 EIADMM O=C([O-])[C@@H](NCc1cc(Cl)ccc1Cl)c1cccc(F)c1 ZINC000426809646 1026572937 /nfs/dbraw/zinc/57/29/37/1026572937.db2.gz WATNIVIOWZILBP-AWEZNQCLSA-N -1 1 328.170 4.048 20 0 EIADMM O=C(Nc1ccc(-c2ncc[nH]2)cc1)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684872726 1026641575 /nfs/dbraw/zinc/64/15/75/1026641575.db2.gz YFBWXKMSAGOHAI-UHFFFAOYSA-N -1 1 347.296 4.053 20 0 EIADMM O=C(c1ccc(C(F)(F)F)c([O-])c1)N1CCc2ccc(Cl)cc21 ZINC000684875823 1026646183 /nfs/dbraw/zinc/64/61/83/1026646183.db2.gz OSJLJMKZMJQFNG-UHFFFAOYSA-N -1 1 341.716 4.267 20 0 EIADMM COC(=O)c1c[n-]c(SCc2ccc(-c3ccsc3)cc2)n1 ZINC000432657896 1026679582 /nfs/dbraw/zinc/67/95/82/1026679582.db2.gz MRTPZZVVEFSABZ-UHFFFAOYSA-N -1 1 330.434 4.217 20 0 EIADMM CN(C(=O)c1ccccc1[O-])c1ccc(OCc2ccccc2)cc1 ZINC000187930432 1026693898 /nfs/dbraw/zinc/69/38/98/1026693898.db2.gz MIKOMQUPCXOMTH-UHFFFAOYSA-N -1 1 333.387 4.248 20 0 EIADMM CC[C@H](C)Cc1c(C)sc2[nH]c(-c3ccc([O-])cn3)nc(=O)c12 ZINC000427441419 1026855009 /nfs/dbraw/zinc/85/50/09/1026855009.db2.gz AWFHTUXYJISGFN-VIFPVBQESA-N -1 1 329.425 4.062 20 0 EIADMM CC(C)CC1(NC(=O)c2ccc(NC(=O)OC(C)(C)C)cc2[O-])CC1 ZINC001167597447 1026930619 /nfs/dbraw/zinc/93/06/19/1026930619.db2.gz JHRWBEZOSQGHLR-UHFFFAOYSA-N -1 1 348.443 4.048 20 0 EIADMM CCCC[C@H](CCC)CNC(=O)c1c(C)nc(C(C)(C)C)[n-]c1=O ZINC000440829699 1027071927 /nfs/dbraw/zinc/07/19/27/1027071927.db2.gz WNJFGVHUHPKCDG-AWEZNQCLSA-N -1 1 335.492 4.124 20 0 EIADMM CSCc1ccc([N-]S(=O)(=O)c2ccccc2SC)cc1 ZINC000188420045 1027534549 /nfs/dbraw/zinc/53/45/49/1027534549.db2.gz HLBOISVPLBPIGZ-UHFFFAOYSA-N -1 1 339.507 4.072 20 0 EIADMM COCC(C)(C)c1noc(-c2cc(Oc3ccccc3)ccc2[O-])n1 ZINC000896590823 1027667343 /nfs/dbraw/zinc/66/73/43/1027667343.db2.gz ODQQYWJTGKAGJB-UHFFFAOYSA-N -1 1 340.379 4.159 20 0 EIADMM C[C@@H]1CCC[C@@H](NC(=O)c2ccc(NC(=O)OC(C)(C)C)cc2[O-])C1 ZINC000303854853 1027680954 /nfs/dbraw/zinc/68/09/54/1027680954.db2.gz OUGAYXZEEHEEBA-CHWSQXEVSA-N -1 1 348.443 4.048 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc3oc(C(C)C)nc3c2)cc1F ZINC000614788843 1027686340 /nfs/dbraw/zinc/68/63/40/1027686340.db2.gz SHPNYFVGAHKACL-UHFFFAOYSA-N -1 1 348.399 4.200 20 0 EIADMM Cc1oc([C@@H](C)N(C)Cc2cccc(OC(C)C)c2)cc1C(=O)[O-] ZINC000582127815 1027736894 /nfs/dbraw/zinc/73/68/94/1027736894.db2.gz KGONGLAPOIYEID-CYBMUJFWSA-N -1 1 331.412 4.266 20 0 EIADMM COc1cc(C(=O)NCc2ccc(C3CCC3)cc2)cc(Cl)c1[O-] ZINC000427570135 1027985425 /nfs/dbraw/zinc/98/54/25/1027985425.db2.gz DSDGWFHPCRLQDK-UHFFFAOYSA-N -1 1 345.826 4.252 20 0 EIADMM COc1cc(C(=O)N2CC[C@@H](C)C[C@H]2c2ccco2)cc(Cl)c1[O-] ZINC000153927897 1028067133 /nfs/dbraw/zinc/06/71/33/1028067133.db2.gz XMHDYIGAPMTWEH-RISCZKNCSA-N -1 1 349.814 4.261 20 0 EIADMM O=S(=O)([N-]c1cc(F)cc(F)c1F)c1cccc2ccccc21 ZINC000323256447 1028155779 /nfs/dbraw/zinc/15/57/79/1028155779.db2.gz FUCNZEBQBSTSFC-UHFFFAOYSA-N -1 1 337.322 4.058 20 0 EIADMM COc1cc(-c2nc(-c3ccc(C)cc3F)no2)cc(Cl)c1[O-] ZINC000445383059 1028504440 /nfs/dbraw/zinc/50/44/40/1028504440.db2.gz DADFWSVCALKQBS-UHFFFAOYSA-N -1 1 334.734 4.219 20 0 EIADMM CC(=O)Nc1ccc(NC(=O)c2ccc(C(C)C)cc2[O-])cc1C ZINC000052281589 1028531137 /nfs/dbraw/zinc/53/11/37/1028531137.db2.gz HOAKRHOMSYALRQ-UHFFFAOYSA-N -1 1 326.396 4.035 20 0 EIADMM CCC(CC)n1nccc1-c1nc(-c2ccc([O-])cc2Cl)no1 ZINC000445447928 1028539065 /nfs/dbraw/zinc/53/90/65/1028539065.db2.gz JFJIXAOUCYZGAV-UHFFFAOYSA-N -1 1 332.791 4.320 20 0 EIADMM COc1ccc(O[C@H](C)c2nc(-c3ccc([O-])cc3Cl)no2)cc1 ZINC000445449992 1028540158 /nfs/dbraw/zinc/54/01/58/1028540158.db2.gz XBTDHRJQXWJMJY-SNVBAGLBSA-N -1 1 346.770 4.244 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cccc([C@@H]4CCOC4)c3)n2)c(Cl)c1 ZINC000445450954 1028544519 /nfs/dbraw/zinc/54/45/19/1028544519.db2.gz YUDBTCCZFWSEQL-CYBMUJFWSA-N -1 1 342.782 4.267 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cc(F)c(Cl)cc3F)n2)cc1F ZINC000445472634 1028601556 /nfs/dbraw/zinc/60/15/56/1028601556.db2.gz RLMMRPFJSAZGPS-UHFFFAOYSA-N -1 1 326.661 4.180 20 0 EIADMM Cc1nc(CC(C)C)c(-c2nc(-c3ccc([O-])cc3F)no2)s1 ZINC000445455612 1028606866 /nfs/dbraw/zinc/60/68/66/1028606866.db2.gz FGTJKABXRNFSOX-UHFFFAOYSA-N -1 1 333.388 4.212 20 0 EIADMM [O-]c1ccc(-c2noc(Cn3ccc4ccc(Cl)cc43)n2)c(F)c1 ZINC000445454608 1028607209 /nfs/dbraw/zinc/60/72/09/1028607209.db2.gz GQVUIFWUPLMKLZ-UHFFFAOYSA-N -1 1 343.745 4.238 20 0 EIADMM COc1ccc(-c2nc(-c3ccc(Cl)cc3Cl)no2)c([O-])c1 ZINC000445455961 1028609267 /nfs/dbraw/zinc/60/92/67/1028609267.db2.gz RMMRVUYFPMLTJI-UHFFFAOYSA-N -1 1 337.162 4.425 20 0 EIADMM [O-]c1ccc(-c2noc([C@@H]3C[C@@H]3c3c(F)cccc3F)n2)c(F)c1 ZINC000445457018 1028613629 /nfs/dbraw/zinc/61/36/29/1028613629.db2.gz QHNWLHGTUWOKOE-WDEREUQCSA-N -1 1 332.281 4.131 20 0 EIADMM CCOc1ccc(/C=C\c2nc(-c3ccc([O-])c(F)c3)no2)cc1 ZINC000445482493 1028630657 /nfs/dbraw/zinc/63/06/57/1028630657.db2.gz QDQKJHUIJDJRGX-YHYXMXQVSA-N -1 1 326.327 4.150 20 0 EIADMM COc1ccccc1/C(C)=C/c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445481006 1028631236 /nfs/dbraw/zinc/63/12/36/1028631236.db2.gz NDWARPBHVTZLFB-PKNBQFBNSA-N -1 1 326.327 4.150 20 0 EIADMM [O-]c1ccc(-c2noc([C@@H]3C[C@@H]3c3c(F)cccc3F)n2)cc1F ZINC000445474185 1028645352 /nfs/dbraw/zinc/64/53/52/1028645352.db2.gz XIIZUXQRNSYOIC-VHSXEESVSA-N -1 1 332.281 4.131 20 0 EIADMM C[C@H](C(=O)[N-][C@@H](c1ccc(Cl)cc1)C(F)(F)F)C(F)(F)F ZINC000080440472 1028783944 /nfs/dbraw/zinc/78/39/44/1028783944.db2.gz CVBFUWGTKNNSOI-MUWHJKNJSA-N -1 1 333.659 4.258 20 0 EIADMM O=C(Nc1ccc2nc(C3CC3)sc2c1)c1c(F)ccc([O-])c1F ZINC000343267158 1028833982 /nfs/dbraw/zinc/83/39/82/1028833982.db2.gz FXSCFJQNBDTZOY-UHFFFAOYSA-N -1 1 346.358 4.410 20 0 EIADMM CC(=O)c1cc(F)c([N-]C(=O)c2cnc(-c3ccco3)s2)c(F)c1 ZINC000347139000 1028886193 /nfs/dbraw/zinc/88/61/93/1028886193.db2.gz SRXITMJPWXERDO-UHFFFAOYSA-N -1 1 348.330 4.136 20 0 EIADMM O=C(CCCCCc1ccc(O)cc1)Nc1ccc([O-])c(F)c1F ZINC000665569396 1029095856 /nfs/dbraw/zinc/09/58/56/1029095856.db2.gz FNWZLKDVALEHIV-UHFFFAOYSA-N -1 1 335.350 4.118 20 0 EIADMM O=S(=O)([N-]c1cccc(Cl)c1F)c1cc(F)ccc1Cl ZINC000103057953 1029160860 /nfs/dbraw/zinc/16/08/60/1029160860.db2.gz GMDRPUMCQUSCLH-UHFFFAOYSA-N -1 1 338.162 4.072 20 0 EIADMM CC(C)c1cccc(S(=O)(=O)[N-]c2cccc3c2ccn3C)c1 ZINC000525156991 1029489579 /nfs/dbraw/zinc/48/95/79/1029489579.db2.gz QKEIBUQWCHLBPD-UHFFFAOYSA-N -1 1 328.437 4.103 20 0 EIADMM Cc1nc(-c2ccc(N[C@H](C)[C@H](C)c3ccccc3)nc2)[n-]c(=O)c1C ZINC000080687975 1029713629 /nfs/dbraw/zinc/71/36/29/1029713629.db2.gz NAGVUZJILRKFKO-DZGCQCFKSA-N -1 1 348.450 4.053 20 0 EIADMM CC[C@H]1CCC[C@H](Nc2ccc(-c3nc(C)c(C)c(=O)[n-]3)cn2)C1 ZINC000301393946 1029724654 /nfs/dbraw/zinc/72/46/54/1029724654.db2.gz JYAXTUPWBRPQDV-HOCLYGCPSA-N -1 1 326.444 4.242 20 0 EIADMM CCc1ccc(CCNc2ccc(-c3nc(C)c(C)c(=O)[n-]3)cn2)cc1 ZINC000301393553 1029724738 /nfs/dbraw/zinc/72/47/38/1029724738.db2.gz JLFMETSGNKMKCU-UHFFFAOYSA-N -1 1 348.450 4.078 20 0 EIADMM Cc1nc(-c2ccc(N[C@@H]3CCC[C@@H](C)[C@@H]3C)nc2)[n-]c(=O)c1C ZINC000301570807 1029763024 /nfs/dbraw/zinc/76/30/24/1029763024.db2.gz WUYNWRBRKWTDSS-BFQNTYOBSA-N -1 1 326.444 4.098 20 0 EIADMM CCC[C@@H](Nc1ccc(-c2nc(C)c(C)c(=O)[n-]2)cn1)c1ccccc1 ZINC000080945181 1029764417 /nfs/dbraw/zinc/76/44/17/1029764417.db2.gz IBQVVPISXGKFDN-GOSISDBHSA-N -1 1 348.450 4.402 20 0 EIADMM Cc1nc(-c2ccc(N3CCCC[C@H]3CC(C)C)nc2)[n-]c(=O)c1C ZINC000301752722 1029804514 /nfs/dbraw/zinc/80/45/14/1029804514.db2.gz VTBNYZUFZCNZHI-KRWDZBQOSA-N -1 1 340.471 4.266 20 0 EIADMM C[C@H]1C[C@@H](c2cccnc2)N(C(=O)c2cc3ccccc3cc2[O-])C1 ZINC000182851534 1029993940 /nfs/dbraw/zinc/99/39/40/1029993940.db2.gz MQBJJVGBRCJJAH-LIRRHRJNSA-N -1 1 332.403 4.164 20 0 EIADMM Cc1c(F)cccc1S(=O)(=O)[N-]c1ccc2oc(C(C)C)nc2c1 ZINC000525749965 1029996707 /nfs/dbraw/zinc/99/67/07/1029996707.db2.gz RNJNARSWHPNVFS-UHFFFAOYSA-N -1 1 348.399 4.200 20 0 EIADMM CC(C)C(=O)c1ccc([C@@H](C)C(=O)Nc2cccc(F)c2[O-])cc1 ZINC000530005594 1030047879 /nfs/dbraw/zinc/04/78/79/1030047879.db2.gz MSMHNPLNTSDBOH-GFCCVEGCSA-N -1 1 329.371 4.112 20 0 EIADMM C[C@@H]1CN(C(=O)c2cc3ccccc3cc2[O-])C[C@H](c2ccccc2)O1 ZINC000143490835 1030072762 /nfs/dbraw/zinc/07/27/62/1030072762.db2.gz ICWOPYVAMVCCRW-QVKFZJNVSA-N -1 1 347.414 4.148 20 0 EIADMM CCOc1cc(C(=O)N(CC)Cc2cccs2)cc(Cl)c1[O-] ZINC000186415525 1030271284 /nfs/dbraw/zinc/27/12/84/1030271284.db2.gz SAMNRVXKAIPYPX-UHFFFAOYSA-N -1 1 339.844 4.168 20 0 EIADMM Cc1ccc(C)c2sc(NC(=O)c3c(F)ccc([O-])c3F)nc21 ZINC000685431441 1030307582 /nfs/dbraw/zinc/30/75/82/1030307582.db2.gz FCHKVOOMWLUXPD-UHFFFAOYSA-N -1 1 334.347 4.149 20 0 EIADMM COc1cc(C(=O)N2CC[C@H](C)[C@H]3CCCC[C@H]32)cc(Cl)c1[O-] ZINC000526949752 1030342002 /nfs/dbraw/zinc/34/20/02/1030342002.db2.gz KVWHIHJUBHCEFC-NJZAAPMLSA-N -1 1 337.847 4.095 20 0 EIADMM CO[C@H](CSc1nc(C(F)F)cc(=O)[n-]1)c1ccc(Cl)cc1 ZINC000685574963 1030534580 /nfs/dbraw/zinc/53/45/80/1030534580.db2.gz NKGBQASBKZAMLM-LLVKDONJSA-N -1 1 346.786 4.253 20 0 EIADMM CCC[C@H](CC(C)C)C(=O)N1CCC(C(=O)c2ccc([O-])cc2)CC1 ZINC000648490684 1030885177 /nfs/dbraw/zinc/88/51/77/1030885177.db2.gz XNCFLJZVJSXNAP-GOSISDBHSA-N -1 1 345.483 4.276 20 0 EIADMM C[C@H]([N@@H+](C)Cc1ccc(C(=O)[O-])cc1Br)C(C)(C)C ZINC000226726244 1031103194 /nfs/dbraw/zinc/10/31/94/1031103194.db2.gz CMVLNYMPZWCIBJ-JTQLQIEISA-N -1 1 328.250 4.014 20 0 EIADMM O=C(Nc1ccc(F)cc1[O-])[C@@H]1C[C@@H]1c1cccc(C(F)(F)F)c1 ZINC000532622135 1031433807 /nfs/dbraw/zinc/43/38/07/1031433807.db2.gz DUQMRRARMBEPMG-CHWSQXEVSA-N -1 1 339.288 4.292 20 0 EIADMM C[C@@H](C(=O)Nc1ccc(F)cc1[O-])c1ccc(Br)s1 ZINC000532621997 1031436866 /nfs/dbraw/zinc/43/68/66/1031436866.db2.gz XTYDJNNVCMLUJO-SSDOTTSWSA-N -1 1 344.205 4.098 20 0 EIADMM COc1ccc(C(=O)Nc2nc(-c3ccccc3)c(C)s2)c([O-])c1 ZINC000614227337 1033855996 /nfs/dbraw/zinc/85/59/96/1033855996.db2.gz DNXAPVRDLQVRSE-UHFFFAOYSA-N -1 1 340.404 4.085 20 0 EIADMM CC(C)(C)c1ccc(NC2([P@](=O)([O-])O)Cc3ccccc3C2)cc1 ZINC001167934787 1034721064 /nfs/dbraw/zinc/72/10/64/1034721064.db2.gz KGMONWJVQJITEZ-UHFFFAOYSA-N -1 1 345.379 4.069 20 0 EIADMM COC(=O)c1[n-]c(=N[C@@H](C)c2cc(Cl)ccc2Cl)sc1C ZINC000433778713 1034907580 /nfs/dbraw/zinc/90/75/80/1034907580.db2.gz BDUYEAMXRDDVOA-ZETCQYMHSA-N -1 1 345.251 4.140 20 0 EIADMM O=C([N-]c1nc(C2CCCCC2)cs1)c1nnc(-c2ccco2)o1 ZINC000913425263 1035719963 /nfs/dbraw/zinc/71/99/63/1035719963.db2.gz QPIPYUZZDULUIE-UHFFFAOYSA-N -1 1 344.396 4.086 20 0 EIADMM CC(C)[C@@H](NC(=O)c1ccc(Br)c([O-])c1)c1ccccc1 ZINC000485221865 1035784860 /nfs/dbraw/zinc/78/48/60/1035784860.db2.gz HHXGRKPFMKTDCV-MRXNPFEDSA-N -1 1 348.240 4.282 20 0 EIADMM Cc1nc(-c2cccc(NC(=O)c3cc4ccccc4cc3[O-])c2)no1 ZINC000195688510 1035882486 /nfs/dbraw/zinc/88/24/86/1035882486.db2.gz CCOGHUOFQOGOQP-UHFFFAOYSA-N -1 1 345.358 4.156 20 0 EIADMM C[C@H](CN1CCOc2cc(C(=O)[O-])ccc2C1)c1cccc(Cl)c1 ZINC000905798789 1035897014 /nfs/dbraw/zinc/89/70/14/1035897014.db2.gz OQOBRDOKPGBYCI-CYBMUJFWSA-N -1 1 345.826 4.036 20 0 EIADMM Cc1oc([C@@H](C)N2CC=C(c3ccc(F)cc3)CC2)cc1C(=O)[O-] ZINC000571217525 1036007760 /nfs/dbraw/zinc/00/77/60/1036007760.db2.gz JMYZKVCOLGWUEG-GFCCVEGCSA-N -1 1 329.371 4.276 20 0 EIADMM CCOCc1cccc([N-]S(=O)(=O)c2ccc(C(C)C)cc2)c1 ZINC000588077540 1036205432 /nfs/dbraw/zinc/20/54/32/1036205432.db2.gz RWEHXVKHGYRZPB-UHFFFAOYSA-N -1 1 333.453 4.147 20 0 EIADMM COc1cccc([N-]S(=O)(=O)c2ccccc2-c2ccccc2)c1 ZINC000485795056 1036263322 /nfs/dbraw/zinc/26/33/22/1036263322.db2.gz RHBXQBFAESCBDE-UHFFFAOYSA-N -1 1 339.416 4.163 20 0 EIADMM O=S(=O)([N-]c1cccc(F)c1)c1ccccc1-c1ccccc1 ZINC000485799934 1036281121 /nfs/dbraw/zinc/28/11/21/1036281121.db2.gz KKOJOMZTMJRUKI-UHFFFAOYSA-N -1 1 327.380 4.294 20 0 EIADMM O=S(=O)([N-]C1(c2ccccc2)CC1)c1cc(Cl)sc1Cl ZINC000588174801 1036282362 /nfs/dbraw/zinc/28/23/62/1036282362.db2.gz BZKDODJZZSVKTK-UHFFFAOYSA-N -1 1 348.276 4.023 20 0 EIADMM Cc1cc([C@@H](C)N2CCC(Oc3ccc(C)cc3)CC2)oc1C(=O)[O-] ZINC000572249566 1036458046 /nfs/dbraw/zinc/45/80/46/1036458046.db2.gz PPVMRSMFBOYKNI-OAHLLOKOSA-N -1 1 343.423 4.199 20 0 EIADMM CC(=O)c1cc(F)c([N-]C(=O)c2coc(C3CCCCC3)n2)c(F)c1 ZINC000486411046 1036679942 /nfs/dbraw/zinc/67/99/42/1036679942.db2.gz SAPWHOMUNZJBQN-UHFFFAOYSA-N -1 1 348.349 4.455 20 0 EIADMM CCOc1cc(C=C2SC(=S)[N-]C2=O)cc(Cl)c1OC ZINC000056687983 1036800210 /nfs/dbraw/zinc/80/02/10/1036800210.db2.gz YQTIXMHXMBSTDN-UXBLZVDNSA-N -1 1 329.830 4.076 20 0 EIADMM CCCCSCCC(=O)Nc1cccc([O-])c1Br ZINC000908713468 1036923432 /nfs/dbraw/zinc/92/34/32/1036923432.db2.gz VLFIUGILWUGTNJ-UHFFFAOYSA-N -1 1 332.263 4.017 20 0 EIADMM CC(C)C[C@H](C)n1nccc1NC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000487190780 1037040270 /nfs/dbraw/zinc/04/02/70/1037040270.db2.gz BDDJKVHHDGUNPY-NSHDSACASA-N -1 1 336.823 4.493 20 0 EIADMM CCc1cc(=O)[n-]c(SCc2nc(-c3ccsc3)oc2C)n1 ZINC000573054188 1037242480 /nfs/dbraw/zinc/24/24/80/1037242480.db2.gz IYTCWLDJMWQJMY-UHFFFAOYSA-N -1 1 333.438 4.062 20 0 EIADMM COc1ccccc1C[C@H](C)[N@@H+](C)Cc1cc(C(=O)[O-])ccc1Cl ZINC000569981444 1037361098 /nfs/dbraw/zinc/36/10/98/1037361098.db2.gz DXJKCNWRDPRRFL-ZDUSSCGKSA-N -1 1 347.842 4.110 20 0 EIADMM CCc1ccccc1S(=O)(=O)[N-]c1nc(C)c(Cl)cc1Cl ZINC000488428456 1037586908 /nfs/dbraw/zinc/58/69/08/1037586908.db2.gz BBJSHZNZCXXKIZ-UHFFFAOYSA-N -1 1 345.251 4.060 20 0 EIADMM COCc1c(C(=O)Nc2c([O-])cccc2F)sc2cccc(F)c21 ZINC000605438101 1037787006 /nfs/dbraw/zinc/78/70/06/1037787006.db2.gz CLVBWYIRBGGVSQ-UHFFFAOYSA-N -1 1 349.358 4.284 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N1CCC(c2ccccc2F)CC1 ZINC000605473135 1037813493 /nfs/dbraw/zinc/81/34/93/1037813493.db2.gz NROWXYAZTXASCQ-UHFFFAOYSA-N -1 1 333.790 4.205 20 0 EIADMM CCCCCC[C@H](CC)CN(C)C(=O)c1cnc(C2CC2)[n-]c1=O ZINC000912721405 1038237344 /nfs/dbraw/zinc/23/73/44/1038237344.db2.gz KTEWXBWMJJDTQG-AWEZNQCLSA-N -1 1 333.476 4.128 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2ccc(OC(C)(C)C)cc2)c(C)s1 ZINC000607616078 1038240449 /nfs/dbraw/zinc/24/04/49/1038240449.db2.gz TWIDOWBZNGYQMQ-UHFFFAOYSA-N -1 1 339.482 4.343 20 0 EIADMM COc1ccc2sc(C(=O)Nc3c([O-])cccc3F)c(C)c2c1 ZINC000608366241 1038803683 /nfs/dbraw/zinc/80/36/83/1038803683.db2.gz GYKVCLCYPDXSOL-UHFFFAOYSA-N -1 1 331.368 4.315 20 0 EIADMM Cc1csc(-c2cccc(C(=O)Nc3c([O-])cccc3F)c2)n1 ZINC000608367626 1038804237 /nfs/dbraw/zinc/80/42/37/1038804237.db2.gz ZSTUGOYKQRWESA-UHFFFAOYSA-N -1 1 328.368 4.216 20 0 EIADMM O=C(Cc1coc(-c2ccc(Cl)cc2)n1)Nc1c([O-])cccc1F ZINC000608367012 1038804275 /nfs/dbraw/zinc/80/42/75/1038804275.db2.gz GPPMKAKRFRBJHS-UHFFFAOYSA-N -1 1 346.745 4.021 20 0 EIADMM O=C(COc1ccc(Cl)c2ccccc12)Nc1c([O-])cccc1F ZINC000608366904 1038804873 /nfs/dbraw/zinc/80/48/73/1038804873.db2.gz QASIFTGMTBMRAJ-UHFFFAOYSA-N -1 1 345.757 4.355 20 0 EIADMM CC(C)Cn1cc(C(=O)Nc2c([O-])cccc2F)c2ccccc21 ZINC000608367122 1038805278 /nfs/dbraw/zinc/80/52/78/1038805278.db2.gz USQKIIYJASROSQ-UHFFFAOYSA-N -1 1 326.371 4.394 20 0 EIADMM C[C@@H]1CCCN(Cc2cc(C(F)(F)F)ccc2Cl)[C@H]1C(=O)[O-] ZINC000424417518 1038850465 /nfs/dbraw/zinc/85/04/65/1038850465.db2.gz MCDGVBAKKHBFKI-NOZJJQNGSA-N -1 1 335.753 4.044 20 0 EIADMM O=C([O-])CC[C@H]1CCCCN1Cc1cc(F)cc(C(F)(F)F)c1 ZINC000322926971 1038852176 /nfs/dbraw/zinc/85/21/76/1038852176.db2.gz NJTCNOLJELFYSK-CQSZACIVSA-N -1 1 333.325 4.064 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2ccc(CCC(C)C)cc2)cc1O ZINC000462101031 1038907110 /nfs/dbraw/zinc/90/71/10/1038907110.db2.gz HTFJJODMGLNUAJ-UHFFFAOYSA-N -1 1 333.453 4.090 20 0 EIADMM CCSc1cccc([N-]S(=O)(=O)c2ccc(SC)cc2)c1 ZINC000505274681 1039182213 /nfs/dbraw/zinc/18/22/13/1039182213.db2.gz OHSXKYQWULCGBA-UHFFFAOYSA-N -1 1 339.507 4.321 20 0 EIADMM CC(C)(C)O[C@@H](C(=O)Nc1ccc([O-])c(F)c1F)c1ccccc1 ZINC000456779325 1039601288 /nfs/dbraw/zinc/60/12/88/1039601288.db2.gz HTUUZPGPNOHKDS-MRXNPFEDSA-N -1 1 335.350 4.165 20 0 EIADMM O=C(Nc1ccc([O-])c(F)c1F)C1(Cc2cccc(F)c2)CCC1 ZINC000456789631 1039607187 /nfs/dbraw/zinc/60/71/87/1039607187.db2.gz UVMWXPOJTXHYBU-UHFFFAOYSA-N -1 1 335.325 4.161 20 0 EIADMM CCCc1ccc(CSc2nc([O-])cc(=O)n2C2CCCC2)cc1 ZINC000552535656 1039611482 /nfs/dbraw/zinc/61/14/82/1039611482.db2.gz VKYBPSOUVSQVCO-UHFFFAOYSA-N -1 1 344.480 4.309 20 0 EIADMM CCCc1ccc(CSc2nc(=O)cc([O-])n2C2CCCC2)cc1 ZINC000552535656 1039611500 /nfs/dbraw/zinc/61/15/00/1039611500.db2.gz VKYBPSOUVSQVCO-UHFFFAOYSA-N -1 1 344.480 4.309 20 0 EIADMM COc1ccc(C2(C(=O)Nc3ccc([O-])c(F)c3F)CCCC2)cc1 ZINC000456793441 1039612276 /nfs/dbraw/zinc/61/22/76/1039612276.db2.gz MBOQAWGXVXYBOX-UHFFFAOYSA-N -1 1 347.361 4.130 20 0 EIADMM CCCc1ccc(C(=O)CCC(=O)Nc2ccc([O-])c(F)c2F)cc1 ZINC000456795069 1039612553 /nfs/dbraw/zinc/61/25/53/1039612553.db2.gz RZADLBHANJXWJE-UHFFFAOYSA-N -1 1 347.361 4.225 20 0 EIADMM O=C(Nc1ccc(F)cc1[O-])c1cnc(-c2ccccc2F)s1 ZINC000534709463 1039715729 /nfs/dbraw/zinc/71/57/29/1039715729.db2.gz NVQHFNUETQUHAL-UHFFFAOYSA-N -1 1 332.331 4.046 20 0 EIADMM CCc1cc(C)cc(CC)c1[N-]S(=O)(=O)c1cccc(COC)c1 ZINC000481884367 1039884738 /nfs/dbraw/zinc/88/47/38/1039884738.db2.gz CJUNPAGQGHWJPQ-UHFFFAOYSA-N -1 1 347.480 4.067 20 0 EIADMM COc1cc(C(=O)N2C[C@H](C)C[C@@H]2c2ccccc2)cc(Cl)c1[O-] ZINC000553337671 1040144847 /nfs/dbraw/zinc/14/48/47/1040144847.db2.gz RMEYYGNPJBKMFW-MLGOLLRUSA-N -1 1 345.826 4.278 20 0 EIADMM CCOc1cc(C(=O)N[C@@H]2CCCC[C@H]2CC)cc(Cl)c1[O-] ZINC000567977219 1040265330 /nfs/dbraw/zinc/26/53/30/1040265330.db2.gz IFBMXIDBTNDRSS-BXUZGUMPSA-N -1 1 325.836 4.143 20 0 EIADMM CC[C@@H](C)c1ccc(S(=O)(=O)[N-]c2c(F)cccc2OC)cc1 ZINC000479558502 1040470153 /nfs/dbraw/zinc/47/01/53/1040470153.db2.gz XXJHENQEFUVKFT-GFCCVEGCSA-N -1 1 337.416 4.149 20 0 EIADMM CCOc1cc(C(=O)Nc2ccc(C3CCC3)cn2)cc(Cl)c1[O-] ZINC000515085650 1040470298 /nfs/dbraw/zinc/47/02/98/1040470298.db2.gz YOEUSKQBTRUANN-UHFFFAOYSA-N -1 1 346.814 4.359 20 0 EIADMM O=C(CO[C@@H]1CCCc2ccccc21)Nc1ccc([O-])c(Cl)c1 ZINC000435764836 1040604556 /nfs/dbraw/zinc/60/45/56/1040604556.db2.gz QAVVQUIVJCBXTB-QGZVFWFLSA-N -1 1 331.799 4.078 20 0 EIADMM O=C(c1ncc2ccccc2c1[O-])N(Cc1ccco1)C1CCCC1 ZINC000667022581 1040663551 /nfs/dbraw/zinc/66/35/51/1040663551.db2.gz LVBKXZFGTLBLTM-UHFFFAOYSA-N -1 1 336.391 4.118 20 0 EIADMM [O-]c1ccc(-c2noc(-c3occc3Br)n2)c(Cl)c1 ZINC000445450993 1040793565 /nfs/dbraw/zinc/79/35/65/1040793565.db2.gz ZHEOQDRLVSSAMN-UHFFFAOYSA-N -1 1 341.548 4.118 20 0 EIADMM CC(C)[C@@H]1C[C@H](Cc2nc(-c3ccc([O-])cc3Cl)no2)CCO1 ZINC000445455594 1040795389 /nfs/dbraw/zinc/79/53/89/1040795389.db2.gz PZYRKVPGXGANCL-ABAIWWIYSA-N -1 1 336.819 4.089 20 0 EIADMM CC(C)[C@H]1C[C@@H](Cc2nc(-c3ccc([O-])cc3Cl)no2)CCO1 ZINC000445455604 1040795475 /nfs/dbraw/zinc/79/54/75/1040795475.db2.gz PZYRKVPGXGANCL-XHDPSFHLSA-N -1 1 336.819 4.089 20 0 EIADMM Cc1ccc(SCCN2Cc3ccc(C(=O)[O-])cc3C2)cc1C ZINC000659791083 1040878023 /nfs/dbraw/zinc/87/80/23/1040878023.db2.gz NUTNWXVTHQTKEG-UHFFFAOYSA-N -1 1 327.449 4.110 20 0 EIADMM Cc1cc2cc[nH]c2cc1[N-]S(=O)(=O)c1cccc(C(C)C)c1 ZINC000436172692 1040936683 /nfs/dbraw/zinc/93/66/83/1040936683.db2.gz AJLGKNSIUXQVCS-UHFFFAOYSA-N -1 1 328.437 4.401 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2cc3[nH]ccc3cc2C)cc1Cl ZINC000436175255 1040941054 /nfs/dbraw/zinc/94/10/54/1040941054.db2.gz LYLNYZOJKNUANC-UHFFFAOYSA-N -1 1 334.828 4.239 20 0 EIADMM CCc1cc(=O)[n-]c(SCc2coc(-c3ccc(Cl)cc3)n2)n1 ZINC000436206968 1040959456 /nfs/dbraw/zinc/95/94/56/1040959456.db2.gz HCXATRMPOWMKSG-UHFFFAOYSA-N -1 1 347.827 4.345 20 0 EIADMM CCOc1ccc(SCc2nc(-c3ccc([O-])cc3F)no2)cc1 ZINC000445464521 1041028565 /nfs/dbraw/zinc/02/85/65/1041028565.db2.gz UIQNPCCJQDYITK-UHFFFAOYSA-N -1 1 346.383 4.272 20 0 EIADMM Cc1cccc([N-]S(=O)(=O)c2cc(Cl)sc2Cl)c1F ZINC000538295724 1041248215 /nfs/dbraw/zinc/24/82/15/1041248215.db2.gz DTNXJBJJMSJFPB-UHFFFAOYSA-N -1 1 340.228 4.303 20 0 EIADMM C/C(=C\c1ccc(Cl)cc1)CN[C@@H](C)c1nc(C(=O)[O-])cs1 ZINC000904024334 1041269828 /nfs/dbraw/zinc/26/98/28/1041269828.db2.gz QAEFKRVMHMLUEO-HUYFXPKMSA-N -1 1 336.844 4.249 20 0 EIADMM COc1cc(NC(=O)c2cc3ccccc3cc2[O-])c(C)c(OC)c1 ZINC000436496799 1041281852 /nfs/dbraw/zinc/28/18/52/1041281852.db2.gz ZZVAVEIQCNTOHE-UHFFFAOYSA-N -1 1 337.375 4.123 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1CCc2cc(F)c(F)cc21 ZINC000436527494 1041310482 /nfs/dbraw/zinc/31/04/82/1041310482.db2.gz LNYIIAFGIMKZOT-UHFFFAOYSA-N -1 1 325.314 4.027 20 0 EIADMM CC(=O)Nc1cc(F)c(F)cc1NC(=O)c1ccc(C(C)C)cc1[O-] ZINC000436547293 1041323716 /nfs/dbraw/zinc/32/37/16/1041323716.db2.gz WRQNFICTYYEHPN-UHFFFAOYSA-N -1 1 348.349 4.005 20 0 EIADMM O=C(c1cc(F)ccc1[O-])N(CCc1ccc(F)cc1)C1CCCC1 ZINC000436539325 1041334441 /nfs/dbraw/zinc/33/44/41/1041334441.db2.gz NUQMHCGHOZXFQU-UHFFFAOYSA-N -1 1 345.389 4.298 20 0 EIADMM COCCN(C(=O)c1cc2ccccc2cc1[O-])[C@H](C)c1ccccc1 ZINC000436541443 1041335910 /nfs/dbraw/zinc/33/59/10/1041335910.db2.gz XKNFMDNZDFDMED-MRXNPFEDSA-N -1 1 349.430 4.395 20 0 EIADMM C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1cc2ccccc2cc1[O-] ZINC000436545153 1041337776 /nfs/dbraw/zinc/33/77/76/1041337776.db2.gz MQXOOWKGMWMRJK-XHDPSFHLSA-N -1 1 337.341 4.348 20 0 EIADMM CCc1nc([C@@H](C)NC(=O)c2ccc3ccccc3c2[O-])cs1 ZINC000436545375 1041338456 /nfs/dbraw/zinc/33/84/56/1041338456.db2.gz MGQCVCLUAJUGIN-LLVKDONJSA-N -1 1 326.421 4.055 20 0 EIADMM CCc1nc([C@H](C)NC(=O)c2ccc3ccccc3c2[O-])cs1 ZINC000436545377 1041338661 /nfs/dbraw/zinc/33/86/61/1041338661.db2.gz MGQCVCLUAJUGIN-NSHDSACASA-N -1 1 326.421 4.055 20 0 EIADMM CC1(c2ccccc2)CCN(C(=O)c2ccc(Cl)cc2[O-])CC1 ZINC000436576878 1041341804 /nfs/dbraw/zinc/34/18/04/1041341804.db2.gz MUPNTBGDVOYMML-UHFFFAOYSA-N -1 1 329.827 4.240 20 0 EIADMM [O-]c1ccc(Oc2ccccc2)cc1-c1nc(-c2ccc(F)cn2)no1 ZINC000436560464 1041342139 /nfs/dbraw/zinc/34/21/39/1041342139.db2.gz DBXYVVBSXILTOJ-UHFFFAOYSA-N -1 1 349.321 4.436 20 0 EIADMM CC[C@H](C)[C@H](C)N(C(=O)c1ccc(Br)cc1[O-])C1CC1 ZINC000436563049 1041343692 /nfs/dbraw/zinc/34/36/92/1041343692.db2.gz CJOMSGFUBGJPID-QWRGUYRKSA-N -1 1 340.261 4.194 20 0 EIADMM C[C@H]1[C@@H](Cc2ccccc2)CCN1C(=O)c1cc(Cl)ccc1[O-] ZINC000436574223 1041351435 /nfs/dbraw/zinc/35/14/35/1041351435.db2.gz JOBRQRJSQNRCPG-DZGCQCFKSA-N -1 1 329.827 4.139 20 0 EIADMM O=C(NC1CCC2(CCOCC2)CC1)c1ccc2ccccc2c1[O-] ZINC000436592227 1041351640 /nfs/dbraw/zinc/35/16/40/1041351640.db2.gz ZUKSPLZTDMMVQY-UHFFFAOYSA-N -1 1 339.435 4.015 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1CCOC2(C1)CCCCCC2 ZINC000436593653 1041352539 /nfs/dbraw/zinc/35/25/39/1041352539.db2.gz BXYYHEGGEWMHPP-UHFFFAOYSA-N -1 1 339.435 4.111 20 0 EIADMM CCCCOc1ccc(C(=O)Nc2cnn([C@H](C)CC)c2C)c([O-])c1 ZINC000436593870 1041352559 /nfs/dbraw/zinc/35/25/59/1041352559.db2.gz GGHLSIWZWAXVAB-CYBMUJFWSA-N -1 1 345.443 4.299 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1CCC[C@H](Nc2ccccc2)C1 ZINC000436601965 1041369205 /nfs/dbraw/zinc/36/92/05/1041369205.db2.gz IUZYPCHGFJAEJD-SFHVURJKSA-N -1 1 346.430 4.262 20 0 EIADMM O=C(c1ccc(C(F)(F)F)cc1[O-])N1CCC=C(c2ccccc2)C1 ZINC000436724843 1041444182 /nfs/dbraw/zinc/44/41/82/1041444182.db2.gz VELDVNQBSOMAKA-UHFFFAOYSA-N -1 1 347.336 4.341 20 0 EIADMM O=C(Nc1ccc(Cl)cc1OCC(F)F)c1cc(F)ccc1[O-] ZINC000436735347 1041445953 /nfs/dbraw/zinc/44/59/53/1041445953.db2.gz DYXRIRDPAWHBAJ-UHFFFAOYSA-N -1 1 345.704 4.081 20 0 EIADMM COc1ccc([C@H](C)N(C)C(=O)c2ccc3ccccc3c2[O-])cc1 ZINC000436759188 1041455978 /nfs/dbraw/zinc/45/59/78/1041455978.db2.gz USIVVXDVVXEVRH-AWEZNQCLSA-N -1 1 335.403 4.387 20 0 EIADMM CC(C)C(=O)Nc1cccc(NC(=O)c2ccc3ccccc3c2[O-])c1 ZINC000436759047 1041456229 /nfs/dbraw/zinc/45/62/29/1041456229.db2.gz QTFYSNKLGIHLPT-UHFFFAOYSA-N -1 1 348.402 4.392 20 0 EIADMM CCS[C@H]1CCCCN(C(=O)c2ccc(C(F)(F)F)cc2[O-])C1 ZINC000436750265 1041463309 /nfs/dbraw/zinc/46/33/09/1041463309.db2.gz FQVRSKGONYPIIX-LBPRGKRZSA-N -1 1 347.402 4.159 20 0 EIADMM O=C(N[C@H](c1ccccc1)[C@@H]1CCOC1)c1ccc2ccccc2c1[O-] ZINC000436750976 1041463374 /nfs/dbraw/zinc/46/33/74/1041463374.db2.gz PZYWOMZMYLJHKW-YLJYHZDGSA-N -1 1 347.414 4.053 20 0 EIADMM C[C@@H]1CN(C(=O)c2ccc(C(F)(F)F)cc2[O-])[C@H]1c1ccccc1 ZINC000436754332 1041467373 /nfs/dbraw/zinc/46/73/73/1041467373.db2.gz YHFMAIIVQXHULH-BDJLRTHQSA-N -1 1 335.325 4.244 20 0 EIADMM C[C@H](CN(C)C(=O)c1ccc(C(F)(F)F)cc1[O-])c1ccccc1 ZINC000436776548 1041470098 /nfs/dbraw/zinc/47/00/98/1041470098.db2.gz KOIOSLXFTNESBA-GFCCVEGCSA-N -1 1 337.341 4.287 20 0 EIADMM O=c1cc(C2CC2)nc(SCc2ncc(-c3ccccc3F)o2)[n-]1 ZINC000195080058 1041470530 /nfs/dbraw/zinc/47/05/30/1041470530.db2.gz XASHGQBQBLNBEM-UHFFFAOYSA-N -1 1 343.383 4.146 20 0 EIADMM O=C(Nc1ccc(F)cc1-c1ccc(F)cc1)c1ccc(O)cc1[O-] ZINC000436778428 1041472131 /nfs/dbraw/zinc/47/21/31/1041472131.db2.gz GWQOTEBWZCYJLG-UHFFFAOYSA-N -1 1 341.313 4.295 20 0 EIADMM O=C(Nc1ccc(Cn2cccn2)cc1)c1cc2ccccc2cc1[O-] ZINC000436777687 1041472843 /nfs/dbraw/zinc/47/28/43/1041472843.db2.gz DBLFZGXLGBEGCK-UHFFFAOYSA-N -1 1 343.386 4.043 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1CCN(C2CC2)c2ccccc21 ZINC000436782664 1041479486 /nfs/dbraw/zinc/47/94/86/1041479486.db2.gz OTVMHLKBXSXHMQ-UHFFFAOYSA-N -1 1 344.414 4.175 20 0 EIADMM COc1ccccc1CN(C(=O)c1ccc2ccccc2c1[O-])C1CC1 ZINC000436783253 1041480909 /nfs/dbraw/zinc/48/09/09/1041480909.db2.gz LMAJAPZJAMFOMV-UHFFFAOYSA-N -1 1 347.414 4.359 20 0 EIADMM CCN(C(=O)c1ccc(C(F)(F)F)cc1[O-])c1cccc(OC)c1 ZINC000436794293 1041485693 /nfs/dbraw/zinc/48/56/93/1041485693.db2.gz VEBCCWAEFLTHAG-UHFFFAOYSA-N -1 1 339.313 4.086 20 0 EIADMM CC[C@@H](C)[C@@H](C)N(C(=O)c1ccc(C(F)(F)F)cc1[O-])C1CC1 ZINC000436819073 1041487396 /nfs/dbraw/zinc/48/73/96/1041487396.db2.gz MOSVTGWQDDEACC-GHMZBOCLSA-N -1 1 329.362 4.450 20 0 EIADMM CC(C)[C@@H]1C[C@@H](CNC(=O)c2ccc([O-])cc2F)c2ccccc21 ZINC000436805364 1041489534 /nfs/dbraw/zinc/48/95/34/1041489534.db2.gz FDFLIJBGCAIBFX-UGSOOPFHSA-N -1 1 327.399 4.188 20 0 EIADMM CSc1ccc(C)c([N-]S(=O)(=O)c2ccc3c(c2)CCC3)c1 ZINC000540497463 1041498809 /nfs/dbraw/zinc/49/88/09/1041498809.db2.gz UCPMRLBYHKNDQV-UHFFFAOYSA-N -1 1 333.478 4.006 20 0 EIADMM C[C@]1(c2ccccc2)CCCN(C(=O)c2ccc([O-])cc2F)CC1 ZINC000436853755 1041504466 /nfs/dbraw/zinc/50/44/66/1041504466.db2.gz SEZWIQOKOIJHHO-FQEVSTJZSA-N -1 1 327.399 4.115 20 0 EIADMM CCc1ccc(C(=O)N(c2ccc(OC)cc2)[C@@H](C)C2CC2)c([O-])c1 ZINC000436827181 1041504621 /nfs/dbraw/zinc/50/46/21/1041504621.db2.gz RUCGXCAYPGKWEG-AWEZNQCLSA-N -1 1 339.435 4.409 20 0 EIADMM CC1(C)CN(C(=O)c2cc3ccccc3cc2[O-])[C@H]1c1cccnc1 ZINC000436840147 1041508736 /nfs/dbraw/zinc/50/87/36/1041508736.db2.gz WFMYPFBQZNSZBQ-IBGZPJMESA-N -1 1 332.403 4.164 20 0 EIADMM CC[C@@H](c1cccc(OC)c1)N(C)C(=O)c1ccc(Cl)cc1[O-] ZINC000436845600 1041511886 /nfs/dbraw/zinc/51/18/86/1041511886.db2.gz KKQCGRNBMZARCD-INIZCTEOSA-N -1 1 333.815 4.278 20 0 EIADMM C[C@@H]1C[C@@H]1c1ccc(CN(C(=O)c2ccc([O-])cc2F)C2CC2)o1 ZINC000436864059 1041522578 /nfs/dbraw/zinc/52/25/78/1041522578.db2.gz XDVUGNMKZUZPOG-BZNIZROVSA-N -1 1 329.371 4.053 20 0 EIADMM CCCOc1nc(C)ccc1-c1nc(-c2ccc([O-])cc2Cl)no1 ZINC000436870259 1041527871 /nfs/dbraw/zinc/52/78/71/1041527871.db2.gz HCAWNIZRJSFIGJ-UHFFFAOYSA-N -1 1 345.786 4.255 20 0 EIADMM Cc1nc2ccc(-c3nc(-c4ccc([O-])cc4Cl)no3)cc2o1 ZINC000436870256 1041528982 /nfs/dbraw/zinc/52/89/82/1041528982.db2.gz HCAGOEKPSQZUOV-UHFFFAOYSA-N -1 1 327.727 4.212 20 0 EIADMM [O-]c1ccc(-c2noc(Cc3cccc(Cl)c3Cl)n2)cc1F ZINC000436873455 1041531368 /nfs/dbraw/zinc/53/13/68/1041531368.db2.gz MTTOOFBZVSSMAB-UHFFFAOYSA-N -1 1 339.153 4.479 20 0 EIADMM [O-]c1ccc(-c2noc([C@H]3CC[C@@H](c4ccccc4)O3)n2)c(F)c1 ZINC000436876562 1041536592 /nfs/dbraw/zinc/53/65/92/1041536592.db2.gz ABNPGVRXORYLMT-JKSUJKDBSA-N -1 1 326.327 4.174 20 0 EIADMM CCCCc1nc2ccc(NC(=O)c3ccc(O)cc3F)cc2[nH]1 ZINC000436880321 1041537576 /nfs/dbraw/zinc/53/75/76/1041537576.db2.gz NMXUJBOHPBCKKB-UHFFFAOYSA-N -1 1 327.359 4.003 20 0 EIADMM CCCCc1nc2cc(NC(=O)c3ccc([O-])cc3F)ccc2[nH]1 ZINC000436880321 1041537583 /nfs/dbraw/zinc/53/75/83/1041537583.db2.gz NMXUJBOHPBCKKB-UHFFFAOYSA-N -1 1 327.359 4.003 20 0 EIADMM O=S(=O)([N-]C1CCCCCC1)c1cc(Cl)sc1Cl ZINC000032548826 1041549863 /nfs/dbraw/zinc/54/98/63/1041549863.db2.gz WMRJVXAOCQEMAS-UHFFFAOYSA-N -1 1 328.286 4.056 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2nc(C)c(Cl)cc2Cl)cc1C ZINC000538855059 1041560061 /nfs/dbraw/zinc/56/00/61/1041560061.db2.gz KPOMVTVVEQSTRN-UHFFFAOYSA-N -1 1 345.251 4.114 20 0 EIADMM CC[C@H](C)Oc1ccc(-c2noc(-c3ccc(OC)cc3[O-])n2)cc1 ZINC000436938529 1041567644 /nfs/dbraw/zinc/56/76/44/1041567644.db2.gz JCVNYUQJVBBDDM-LBPRGKRZSA-N -1 1 340.379 4.295 20 0 EIADMM [O-]c1c(-c2nc(COc3cccc(F)c3)no2)ccc2ccccc21 ZINC000436995437 1041584918 /nfs/dbraw/zinc/58/49/18/1041584918.db2.gz IBVWJVQFQYXLGY-UHFFFAOYSA-N -1 1 336.322 4.314 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2ccc3oc(C(C)C)nc3c2)ccc1F ZINC000517934754 1042272622 /nfs/dbraw/zinc/27/26/22/1042272622.db2.gz FWBRRROVYXRZOW-UHFFFAOYSA-N -1 1 348.399 4.200 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2cccc(-c3nccs3)c2)ccc1F ZINC000517934136 1042288696 /nfs/dbraw/zinc/28/86/96/1042288696.db2.gz MRVSDAINRJIWEN-UHFFFAOYSA-N -1 1 348.424 4.058 20 0 EIADMM CCCc1cc(=O)[n-]c(SCc2csc(-c3cccs3)n2)n1 ZINC000058914750 1042327278 /nfs/dbraw/zinc/32/72/78/1042327278.db2.gz LVPXYSSIDHTPCF-UHFFFAOYSA-N -1 1 349.506 4.200 20 0 EIADMM Cc1ccc(Cl)c(NC(=O)c2cc(Br)ccc2[O-])c1 ZINC000300438868 1042328449 /nfs/dbraw/zinc/32/84/49/1042328449.db2.gz OBUVQSCHWNSWKW-UHFFFAOYSA-N -1 1 340.604 4.369 20 0 EIADMM CCCCOc1ccc([N-]S(=O)(=O)c2cccc(F)c2)c(C)c1 ZINC000518082807 1042335108 /nfs/dbraw/zinc/33/51/08/1042335108.db2.gz XKAPRUKZNOYFMB-UHFFFAOYSA-N -1 1 337.416 4.114 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2cccc(CC(F)(F)F)c2)ccc1F ZINC000438775992 1042342648 /nfs/dbraw/zinc/34/26/48/1042342648.db2.gz RYLKDRWPKBAPRQ-UHFFFAOYSA-N -1 1 347.333 4.040 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccccc2CC(F)(F)F)c(C)c1 ZINC000172901471 1042511581 /nfs/dbraw/zinc/51/15/81/1042511581.db2.gz YGPRMCFOFOCJAV-UHFFFAOYSA-N -1 1 343.370 4.209 20 0 EIADMM O=S(=O)([N-]c1cccc(Cl)c1F)c1csc2ccccc21 ZINC000506559538 1042608442 /nfs/dbraw/zinc/60/84/42/1042608442.db2.gz GCIFGYQHOMWRGA-UHFFFAOYSA-N -1 1 341.816 4.495 20 0 EIADMM Cn1ccc2ccc([N-]S(=O)(=O)c3cccc4ccccc43)cc21 ZINC000439568019 1042694085 /nfs/dbraw/zinc/69/40/85/1042694085.db2.gz FRKMIRAPJHXFTM-UHFFFAOYSA-N -1 1 336.416 4.132 20 0 EIADMM CC(C)(C)c1ncc(/C=C/C(=O)Nc2ccc([O-])c(F)c2F)s1 ZINC000493095824 1042816049 /nfs/dbraw/zinc/81/60/49/1042816049.db2.gz OCMMKMQUTPZSQE-QPJJXVBHSA-N -1 1 338.379 4.076 20 0 EIADMM C[C@@H]1CCC[C@H]1[N-]S(=O)(=O)c1c(Cl)cc(Cl)cc1Cl ZINC000520555857 1042887383 /nfs/dbraw/zinc/88/73/83/1042887383.db2.gz UZAFVZGJEGJVHI-RDDDGLTNSA-N -1 1 342.675 4.114 20 0 EIADMM CC1(C)CN(C(=O)c2cc(Cl)ccc2[O-])CC[C@@H]1C(F)(F)F ZINC000190671835 1042942817 /nfs/dbraw/zinc/94/28/17/1042942817.db2.gz ZFSQSNXQSOANLV-LBPRGKRZSA-N -1 1 335.753 4.096 20 0 EIADMM Cc1ccc(C(=O)CCCC(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000184417537 1043095294 /nfs/dbraw/zinc/09/52/94/1043095294.db2.gz KYMLZZVPPPOHEH-UHFFFAOYSA-N -1 1 331.799 4.346 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1ccc2ccc(Cl)cc2n1 ZINC000509176410 1043200174 /nfs/dbraw/zinc/20/01/74/1043200174.db2.gz AIQLIFDYUPSEQB-UHFFFAOYSA-N -1 1 333.174 4.500 20 0 EIADMM O=C([N-]c1nnc(C2CC2)s1)c1ccc(Oc2ccccc2)o1 ZINC000673988664 1043250481 /nfs/dbraw/zinc/25/04/81/1043250481.db2.gz DEXLREBRFNQCHO-UHFFFAOYSA-N -1 1 327.365 4.053 20 0 EIADMM Cc1cc2cc([N-]S(=O)(=O)c3cccc(Cl)c3C)ccc2[nH]1 ZINC000114229589 1043552450 /nfs/dbraw/zinc/55/24/50/1043552450.db2.gz ITDHJZWVQFUDCY-UHFFFAOYSA-N -1 1 334.828 4.239 20 0 EIADMM Cc1c(Cl)cccc1S(=O)(=O)[N-]c1ccc2ncsc2c1 ZINC000114226341 1043555388 /nfs/dbraw/zinc/55/53/88/1043555388.db2.gz MWZQECUIOIVUDU-UHFFFAOYSA-N -1 1 338.841 4.059 20 0 EIADMM Cc1cc([C@@H](C)N2CCC(Oc3cccc(F)c3)CC2)oc1C(=O)[O-] ZINC000530163248 1043629013 /nfs/dbraw/zinc/62/90/13/1043629013.db2.gz FYQMUNWVDGEZRD-CYBMUJFWSA-N -1 1 347.386 4.030 20 0 EIADMM CC(C)[C@@]1(C(=O)[O-])CC[N@@H+](Cc2nc(C3CCCCC3)cs2)C1 ZINC000521257054 1043672348 /nfs/dbraw/zinc/67/23/48/1043672348.db2.gz CMNAVRKWGOMCKT-GOSISDBHSA-N -1 1 336.501 4.124 20 0 EIADMM CC(C)c1ocnc1C(=O)[N-]c1nnc(CC2CCCCC2)s1 ZINC000731989670 1043863532 /nfs/dbraw/zinc/86/35/32/1043863532.db2.gz PABKXYLCJKOMBO-UHFFFAOYSA-N -1 1 334.445 4.025 20 0 EIADMM COc1ccc2nc(C)c(C(=O)Nc3ccc([O-])c(Cl)c3)cc2c1 ZINC000732308874 1043894942 /nfs/dbraw/zinc/89/49/42/1043894942.db2.gz GUYGAJYQJUDNLD-UHFFFAOYSA-N -1 1 342.782 4.163 20 0 EIADMM COc1cc(C(=O)N2CCCCc3ccccc32)cc(Cl)c1[O-] ZINC000442954893 1043902548 /nfs/dbraw/zinc/90/25/48/1043902548.db2.gz HSICEYJPZYIBHH-UHFFFAOYSA-N -1 1 331.799 4.037 20 0 EIADMM COc1cc(C(=O)N[C@@H](C)c2cccc(C)c2C)cc(Cl)c1[O-] ZINC000442981978 1043947114 /nfs/dbraw/zinc/94/71/14/1043947114.db2.gz KBTHTTQJJQSTJI-LBPRGKRZSA-N -1 1 333.815 4.162 20 0 EIADMM COc1cc(C(=O)NCC(C)(C)C2=CCCCC2)cc(Cl)c1[O-] ZINC000443126564 1044037767 /nfs/dbraw/zinc/03/77/67/1044037767.db2.gz BCUFSGZIBVLAHK-UHFFFAOYSA-N -1 1 337.847 4.311 20 0 EIADMM Cc1nc(Br)ccc1Nc1cc([O-])c(Cl)cc1F ZINC001212565005 1044340669 /nfs/dbraw/zinc/34/06/69/1044340669.db2.gz PPLNVQSRTRXMKX-UHFFFAOYSA-N -1 1 331.572 4.394 20 0 EIADMM C[C@@H](c1cccs1)N(Cc1ccccc1)C(=O)c1ncccc1[O-] ZINC000494828852 1044406405 /nfs/dbraw/zinc/40/64/05/1044406405.db2.gz IWQAXRLUINKYAT-AWEZNQCLSA-N -1 1 338.432 4.252 20 0 EIADMM Cc1nc(-c2ccc(N[C@@H]3CC[C@H](C)[C@H](C)C3)nc2)[n-]c(=O)c1C ZINC000543450981 1044623063 /nfs/dbraw/zinc/62/30/63/1044623063.db2.gz AFTFCSDRKVUQSQ-HWWQOWPSSA-N -1 1 326.444 4.098 20 0 EIADMM O=C(Nc1ncc(-c2ccccc2F)s1)c1ccc([O-])c(F)c1 ZINC000670145008 1044832089 /nfs/dbraw/zinc/83/20/89/1044832089.db2.gz XQQBKTPXNSOEPI-UHFFFAOYSA-N -1 1 332.331 4.046 20 0 EIADMM C[C@@H](CCNC(=O)c1ccc(Br)c([O-])c1)c1ccccc1 ZINC000231329263 1044844037 /nfs/dbraw/zinc/84/40/37/1044844037.db2.gz XILZYLBEPFMZNO-LBPRGKRZSA-N -1 1 348.240 4.078 20 0 EIADMM C[C@@H]1C[C@H](c2ccc(F)cc2)CN1C(=O)c1c([O-])cccc1Cl ZINC000736724976 1044964810 /nfs/dbraw/zinc/96/48/10/1044964810.db2.gz PZDOQAWAWQMIPB-YPMHNXCESA-N -1 1 333.790 4.203 20 0 EIADMM O=C(c1c([O-])cccc1Cl)N1CCC(c2ccccc2F)CC1 ZINC000736683654 1044965252 /nfs/dbraw/zinc/96/52/52/1044965252.db2.gz QDRXRLPFIYFEDR-UHFFFAOYSA-N -1 1 333.790 4.205 20 0 EIADMM CSc1cccc(S(=O)(=O)[N-]c2cccc(C(F)F)c2)c1 ZINC000509062879 1045039523 /nfs/dbraw/zinc/03/95/23/1045039523.db2.gz CPBOCOYZUITHQC-UHFFFAOYSA-N -1 1 329.393 4.147 20 0 EIADMM CSc1cccc(S(=O)(=O)[N-]c2cc(SC)ccc2C)c1 ZINC000509392193 1045085754 /nfs/dbraw/zinc/08/57/54/1045085754.db2.gz OBGXNOAWDUDXBZ-UHFFFAOYSA-N -1 1 339.507 4.240 20 0 EIADMM C[C@@H](C(=O)[N-]OCc1ccc(C(F)(F)F)cc1)c1cccc(F)c1 ZINC000746920980 1045529819 /nfs/dbraw/zinc/52/98/19/1045529819.db2.gz DJSINSBLXSXJTC-LLVKDONJSA-N -1 1 341.304 4.196 20 0 EIADMM Cc1cc(Cl)ccc1O[C@H](C)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000533540864 1045557801 /nfs/dbraw/zinc/55/78/01/1045557801.db2.gz QEJQWJXEQKANTN-SNVBAGLBSA-N -1 1 340.206 4.413 20 0 EIADMM CC(=O)Nc1ccc([O-])c(C(=O)Nc2ccccc2SC(C)C)c1 ZINC000123315776 1045880093 /nfs/dbraw/zinc/88/00/93/1045880093.db2.gz PJYCLYVUWQQKPQ-UHFFFAOYSA-N -1 1 344.436 4.103 20 0 EIADMM COc1ccc([C@@H]2CCCN2C(=O)c2c([O-])cccc2Cl)cc1 ZINC000769633884 1046028268 /nfs/dbraw/zinc/02/82/68/1046028268.db2.gz LJSVQVYSQRUJEB-HNNXBMFYSA-N -1 1 331.799 4.032 20 0 EIADMM C[C@H]1CC[C@@H](C(=O)[O-])CN1Cc1cc(Cl)cc(C(F)(F)F)c1 ZINC000263360483 1046277740 /nfs/dbraw/zinc/27/77/40/1046277740.db2.gz RVGJKMMRDXXMLQ-GXSJLCMTSA-N -1 1 335.753 4.044 20 0 EIADMM COc1ccc2oc(C)c(-c3nc(-c4ccc([O-])cc4F)no3)c2c1 ZINC000771209408 1046353584 /nfs/dbraw/zinc/35/35/84/1046353584.db2.gz DMLWMLLRUGVYJB-UHFFFAOYSA-N -1 1 340.310 4.312 20 0 EIADMM COc1ccc2oc(C)c(-c3nc(-c4ccc([O-])c(F)c4)no3)c2c1 ZINC000771223536 1046355862 /nfs/dbraw/zinc/35/58/62/1046355862.db2.gz LXUQWKBLUQCDEA-UHFFFAOYSA-N -1 1 340.310 4.312 20 0 EIADMM CCC(=O)c1cccc(S(=O)(=O)[N-]c2ccccc2C(C)C)c1 ZINC000126127504 1046438074 /nfs/dbraw/zinc/43/80/74/1046438074.db2.gz DETARBUEYWQRCP-UHFFFAOYSA-N -1 1 331.437 4.204 20 0 EIADMM O=C(OCc1ncc(Cl)s1)c1ccc(Cl)c(Cl)c1[O-] ZINC000772098758 1046561992 /nfs/dbraw/zinc/56/19/92/1046561992.db2.gz VQOLXFRZCMVKKR-UHFFFAOYSA-N -1 1 338.599 4.166 20 0 EIADMM CCOc1cc(-c2noc([C@H](CC)SC)n2)cc(Cl)c1[O-] ZINC000445409627 1046647366 /nfs/dbraw/zinc/64/73/66/1046647366.db2.gz BJMRFALFMSDZNK-NSHDSACASA-N -1 1 328.821 4.308 20 0 EIADMM COCc1ncsc1C(=O)[N-]c1ccccc1SC(F)(F)F ZINC000786039347 1046804647 /nfs/dbraw/zinc/80/46/47/1046804647.db2.gz LHHVYQLJOPLKDC-UHFFFAOYSA-N -1 1 348.371 4.154 20 0 EIADMM O=c1cc(CSc2c(F)cc(F)cc2F)c2ccc([O-])cc2o1 ZINC000917440128 1046879758 /nfs/dbraw/zinc/87/97/58/1046879758.db2.gz NHXPXNOTQXZHRS-UHFFFAOYSA-N -1 1 338.306 4.208 20 0 EIADMM CCC1(CC)CCCN(C(=O)c2c(C)nc(C(C)C)[n-]c2=O)CC1 ZINC000787620143 1047033034 /nfs/dbraw/zinc/03/30/34/1047033034.db2.gz ZAYINKSWLXVFBS-UHFFFAOYSA-N -1 1 333.476 4.047 20 0 EIADMM Cc1ccc(F)c(C(=O)[N-]c2nc(-c3cccs3)ns2)c1F ZINC000497982346 1047239689 /nfs/dbraw/zinc/23/96/89/1047239689.db2.gz KNWVRFMMXZJYMW-UHFFFAOYSA-N -1 1 337.376 4.106 20 0 EIADMM CSc1c(F)cccc1[N-]C(=O)c1csc(-c2ccccn2)n1 ZINC001130857759 1047418450 /nfs/dbraw/zinc/41/84/50/1047418450.db2.gz KDEBJDGAAPCCCT-UHFFFAOYSA-N -1 1 345.424 4.318 20 0 EIADMM CCC(=O)Nc1ccc(C)c(NC(=O)c2cc3ccccc3cc2[O-])c1 ZINC000129729323 1047495729 /nfs/dbraw/zinc/49/57/29/1047495729.db2.gz CRXDUKYWALJBHQ-UHFFFAOYSA-N -1 1 348.402 4.455 20 0 EIADMM O=C(Nc1nc(Cl)ccc1[O-])c1ccc(CCC(F)(F)F)cc1 ZINC000789932096 1047495899 /nfs/dbraw/zinc/49/58/99/1047495899.db2.gz QEWRSDMCOOWPBU-UHFFFAOYSA-N -1 1 344.720 4.188 20 0 EIADMM O=C(Nc1ccc(N2CCCC2)c(Cl)c1)c1ccc([O-])cc1F ZINC000154874481 1047728953 /nfs/dbraw/zinc/72/89/53/1047728953.db2.gz AYFBZMPGEYVQDO-UHFFFAOYSA-N -1 1 334.778 4.037 20 0 EIADMM CC(C)(C)c1ccccc1S(=O)(=O)[N-]c1ccc2ncsc2c1 ZINC000460421093 1047785444 /nfs/dbraw/zinc/78/54/44/1047785444.db2.gz BLODNEQPIOTPFB-UHFFFAOYSA-N -1 1 346.477 4.395 20 0 EIADMM Cc1cc(F)cc(S(=O)(=O)[N-]c2ccccc2CC(F)(F)F)c1 ZINC000476425872 1047807382 /nfs/dbraw/zinc/80/73/82/1047807382.db2.gz DNUJMMWMGJBPLX-UHFFFAOYSA-N -1 1 347.333 4.040 20 0 EIADMM COCc1ccc(-c2nc3ccc(-c4ccccc4)cc3c(=O)[n-]2)cc1 ZINC000498761903 1047837744 /nfs/dbraw/zinc/83/77/44/1047837744.db2.gz BOYOUORZYKZZOG-UHFFFAOYSA-N -1 1 342.398 4.404 20 0 EIADMM Cc1ccc([C@H]2CCC[C@@H]2N(C)C(=O)c2ccc(F)c([O-])c2)cc1 ZINC001136989527 1048035096 /nfs/dbraw/zinc/03/50/96/1048035096.db2.gz JKDDAAFEMRIPOG-AEFFLSMTSA-N -1 1 327.399 4.248 20 0 EIADMM Cc1ccc(C(=O)Nc2c([O-])cc(Br)cc2Cl)s1 ZINC000556847504 1048071044 /nfs/dbraw/zinc/07/10/44/1048071044.db2.gz DNYFXZYGAMLAAX-UHFFFAOYSA-N -1 1 346.633 4.430 20 0 EIADMM CCc1ccc([C@@H]2C[C@H](C)CCN2C(=O)c2ccc([O-])c(F)c2)o1 ZINC001137026362 1048078165 /nfs/dbraw/zinc/07/81/65/1048078165.db2.gz ICMKVUCMIOJDGD-WBMJQRKESA-N -1 1 331.387 4.300 20 0 EIADMM COc1ccccc1C[C@@H](C)N(C)C(=O)c1ccc2ccccc2c1[O-] ZINC000131957306 1048173640 /nfs/dbraw/zinc/17/36/40/1048173640.db2.gz DHRGOIYTHBBJTF-OAHLLOKOSA-N -1 1 349.430 4.257 20 0 EIADMM C[C@@H]([NH2+]Cc1cccc(O)c1Cl)c1ccc(N2CCCC2=O)cc1 ZINC000815118084 1048332506 /nfs/dbraw/zinc/33/25/06/1048332506.db2.gz FPPZFODOKGNBMN-CYBMUJFWSA-N -1 1 344.842 4.023 20 0 EIADMM [O-]c1cccc(CNCc2ccc(Br)cc2F)c1Cl ZINC000815124124 1048337299 /nfs/dbraw/zinc/33/72/99/1048337299.db2.gz NYCRQHHNIXCUNZ-UHFFFAOYSA-N -1 1 344.611 4.237 20 0 EIADMM Cc1ccc(-c2cnc(NC([O-])=NO[C@H]3CCCCO3)s2)c(C)c1 ZINC000844662098 1048457991 /nfs/dbraw/zinc/45/79/91/1048457991.db2.gz LVVYATQFADWJLQ-HNNXBMFYSA-N -1 1 347.440 4.007 20 0 EIADMM Cc1ccc(-c2cnc(NC(=O)[N-]O[C@H]3CCCCO3)s2)c(C)c1 ZINC000844662098 1048458003 /nfs/dbraw/zinc/45/80/03/1048458003.db2.gz LVVYATQFADWJLQ-HNNXBMFYSA-N -1 1 347.440 4.007 20 0 EIADMM O=c1cc(C(F)F)nc(SCCSc2ccc(F)cc2)[n-]1 ZINC000809986927 1048590060 /nfs/dbraw/zinc/59/00/60/1048590060.db2.gz OYKDKADZZDSCMP-UHFFFAOYSA-N -1 1 332.372 4.143 20 0 EIADMM O=C(Nc1ccc(OC(F)F)cc1)c1ccc(C(F)(F)F)cc1[O-] ZINC001135338679 1048671763 /nfs/dbraw/zinc/67/17/63/1048671763.db2.gz NSIHLRXIELPJIB-UHFFFAOYSA-N -1 1 347.239 4.265 20 0 EIADMM CN(Cc1ccccc1C(F)(F)F)C(=O)c1c([O-])cccc1Cl ZINC000920438896 1048681790 /nfs/dbraw/zinc/68/17/90/1048681790.db2.gz YGVKVEBELOVSBQ-UHFFFAOYSA-N -1 1 343.732 4.337 20 0 EIADMM [O-]c1cc(F)c(CN2CCC[C@@H]2c2cc(F)ccc2F)c(F)c1 ZINC001144554563 1048723206 /nfs/dbraw/zinc/72/32/06/1048723206.db2.gz AFTBLDYEWBERAC-QGZVFWFLSA-N -1 1 325.305 4.286 20 0 EIADMM CN(Cc1ccc(Br)cc1)Cc1c(F)cc([O-])cc1F ZINC001144555021 1048725218 /nfs/dbraw/zinc/72/52/18/1048725218.db2.gz RGHSFGDPPAZAQC-UHFFFAOYSA-N -1 1 342.183 4.065 20 0 EIADMM CN(Cc1cccc(Br)c1)Cc1cc(F)c([O-])cc1F ZINC001144647644 1048768634 /nfs/dbraw/zinc/76/86/34/1048768634.db2.gz KEZIXTFWBNQWDF-UHFFFAOYSA-N -1 1 342.183 4.065 20 0 EIADMM CCOc1ccc([C@@H]2CCCN2Cc2cc(F)c([O-])cc2F)cc1 ZINC001144657914 1048777279 /nfs/dbraw/zinc/77/72/79/1048777279.db2.gz MWTRJAPLTTXEGY-SFHVURJKSA-N -1 1 333.378 4.406 20 0 EIADMM O=C([O-])c1ccsc1CN(Cc1ccccc1)Cc1ccncc1 ZINC001144664336 1048781201 /nfs/dbraw/zinc/78/12/01/1048781201.db2.gz FJWRMAKEJGAKAP-UHFFFAOYSA-N -1 1 338.432 4.044 20 0 EIADMM CN(Cc1ccc(C(F)(F)F)cc1)Cc1cc(F)c([O-])cc1F ZINC001144658141 1048792777 /nfs/dbraw/zinc/79/27/77/1048792777.db2.gz SHVWMUKHXLTXRC-UHFFFAOYSA-N -1 1 331.284 4.321 20 0 EIADMM CCOc1cc(C(=O)N[C@@H]2CCC[C@@H](C(C)C)C2)cc(Cl)c1[O-] ZINC001144746163 1048843545 /nfs/dbraw/zinc/84/35/45/1048843545.db2.gz VCOOHACVLJZGBW-TZMCWYRMSA-N -1 1 339.863 4.389 20 0 EIADMM O=C([O-])c1ccoc1CN1CCC[C@H]1c1ccccc1C(F)(F)F ZINC000846243849 1048846828 /nfs/dbraw/zinc/84/68/28/1048846828.db2.gz JBIBTHAVNHZIOT-AWEZNQCLSA-N -1 1 339.313 4.334 20 0 EIADMM CSc1ccc([O-])c(C(=O)Nc2ccc3oc(C4CC4)nc3c2)c1 ZINC001135847962 1048915496 /nfs/dbraw/zinc/91/54/96/1048915496.db2.gz WUOFZXBRCZYVRV-UHFFFAOYSA-N -1 1 340.404 4.385 20 0 EIADMM O=C([N-][C@H](CF)c1ccc(F)cc1)C(F)(F)c1ccc(Cl)cc1 ZINC001132555080 1048920629 /nfs/dbraw/zinc/92/06/29/1048920629.db2.gz MXZYQOSJTPIEBW-CQSZACIVSA-N -1 1 345.723 4.398 20 0 EIADMM C[C@]1(c2cccc(F)c2)CCN(C(=O)c2ccc3ccccc3c2[O-])C1 ZINC001145053244 1048977038 /nfs/dbraw/zinc/97/70/38/1048977038.db2.gz FWODDNTWWXQHTI-QFIPXVFZSA-N -1 1 349.405 4.488 20 0 EIADMM O=C(c1ccc(C(F)(F)F)c([O-])c1)N1CC[C@@H](C2CCCCC2)C1 ZINC001146290622 1049012708 /nfs/dbraw/zinc/01/27/08/1049012708.db2.gz OYNPQHWFTZDEHE-CQSZACIVSA-N -1 1 341.373 4.453 20 0 EIADMM Cc1ccc(C[C@H]2CCCN2C(=O)c2ncc3ccccc3c2[O-])cc1 ZINC001146420521 1049024340 /nfs/dbraw/zinc/02/43/40/1049024340.db2.gz SRIWWYIOIGZIOA-GOSISDBHSA-N -1 1 346.430 4.096 20 0 EIADMM Cc1ccc(CCNC(=O)c2ccc(C(F)(F)F)cc2[O-])cc1C ZINC001146587660 1049035182 /nfs/dbraw/zinc/03/51/82/1049035182.db2.gz UEGXQMGMQNAISP-UHFFFAOYSA-N -1 1 337.341 4.000 20 0 EIADMM O=C(Nc1nc2c(s1)c(Cl)ccc2F)c1ccc(F)c([O-])c1 ZINC001171284738 1049054538 /nfs/dbraw/zinc/05/45/38/1049054538.db2.gz MOBCHIDTZOAADE-UHFFFAOYSA-N -1 1 340.738 4.186 20 0 EIADMM O=C(N[C@H](c1cccs1)C1CC1)c1ccc(C(F)(F)F)c([O-])c1 ZINC001136056630 1049058065 /nfs/dbraw/zinc/05/80/65/1049058065.db2.gz VOPCQJXQWCVRKC-AWEZNQCLSA-N -1 1 341.354 4.354 20 0 EIADMM O=C(CCc1cscn1)Nc1cc(Cl)c([O-])c2ccccc12 ZINC001148253791 1049289003 /nfs/dbraw/zinc/28/90/03/1049289003.db2.gz WENKHFPKGAQMIZ-UHFFFAOYSA-N -1 1 332.812 4.227 20 0 EIADMM C[C@H](NC(=O)c1cccc([O-])c1F)c1ccccc1C(F)(F)F ZINC001148256988 1049290489 /nfs/dbraw/zinc/29/04/89/1049290489.db2.gz JRYUQDTWQBXJMI-VIFPVBQESA-N -1 1 327.277 4.041 20 0 EIADMM CC1(C)C[C@@]1(CNC(=O)Cc1ccc([O-])c(Cl)c1)c1ccccc1 ZINC001148588945 1049342736 /nfs/dbraw/zinc/34/27/36/1049342736.db2.gz ZPDXLWLXIVCWFE-HXUWFJFHSA-N -1 1 343.854 4.072 20 0 EIADMM O=C(c1cccc(-c2ccccc2)c1[O-])N1CCC(=O)[C@H]2CCCC[C@H]21 ZINC001148860903 1049390693 /nfs/dbraw/zinc/39/06/93/1049390693.db2.gz APCVSYONGQQLOW-PKOBYXMFSA-N -1 1 349.430 4.033 20 0 EIADMM O=C(Nc1ccc2oncc2c1)c1cccc(-c2ccccc2)c1[O-] ZINC001148870545 1049391945 /nfs/dbraw/zinc/39/19/45/1049391945.db2.gz YXHALRSBKKARGR-UHFFFAOYSA-N -1 1 330.343 4.453 20 0 EIADMM CC(C)Oc1cccc(CNC(=O)c2cc3ccccc3cc2[O-])c1 ZINC001136292173 1049399449 /nfs/dbraw/zinc/39/94/49/1049399449.db2.gz ZSUOYXHUFZLMTG-UHFFFAOYSA-N -1 1 335.403 4.263 20 0 EIADMM CCOC(=O)c1c(C)c(C)sc1NC(=O)c1ccc(CC)cc1[O-] ZINC001136346438 1049517675 /nfs/dbraw/zinc/51/76/75/1049517675.db2.gz KGLWXHIJIAKAQN-UHFFFAOYSA-N -1 1 347.436 4.062 20 0 EIADMM Cc1cccc(C)c1Oc1ccccc1NC(=O)c1cncc([O-])c1 ZINC001136354988 1049523106 /nfs/dbraw/zinc/52/31/06/1049523106.db2.gz GOBGOEVWNXDRBQ-UHFFFAOYSA-N -1 1 334.375 4.449 20 0 EIADMM O=C(c1c([O-])cccc1Cl)N(Cc1ccccc1)CC1CCC1 ZINC001136379790 1049561282 /nfs/dbraw/zinc/56/12/82/1049561282.db2.gz MQCOQBOJRKYFAB-UHFFFAOYSA-N -1 1 329.827 4.488 20 0 EIADMM Cc1ccc(C(=O)[O-])cc1NCc1cc(Cl)cc(Cl)c1O ZINC000037087658 1049657864 /nfs/dbraw/zinc/65/78/64/1049657864.db2.gz HRIVAZBMGIAMDI-UHFFFAOYSA-N -1 1 326.179 4.318 20 0 EIADMM CSc1ccc([O-])c(C(=O)Nc2cn(C)nc2C2CCCCC2)c1 ZINC000615466109 1049700322 /nfs/dbraw/zinc/70/03/22/1049700322.db2.gz VIBCUKRDPNEGCV-UHFFFAOYSA-N -1 1 345.468 4.148 20 0 EIADMM O=C(Nc1cccc(-c2ccc3ccccc3c2)n1)c1ccc([O-])cn1 ZINC001136528285 1049723406 /nfs/dbraw/zinc/72/34/06/1049723406.db2.gz DEPLFWTZUNNVPO-UHFFFAOYSA-N -1 1 341.370 4.255 20 0 EIADMM CCCc1ccc([C@H](NC(=O)C(=O)c2ccc([O-])cc2)C(C)C)cc1 ZINC001136558839 1049742110 /nfs/dbraw/zinc/74/21/10/1049742110.db2.gz FBJUOJIJLDOUSD-LJQANCHMSA-N -1 1 339.435 4.041 20 0 EIADMM O=C(Nc1cccc(-c2ncc[nH]2)c1)c1ccc(C(F)(F)F)cc1[O-] ZINC001136613931 1049784786 /nfs/dbraw/zinc/78/47/86/1049784786.db2.gz LWVAZWTWWQUZHO-UHFFFAOYSA-N -1 1 347.296 4.053 20 0 EIADMM C[C@@H](NC(=O)c1ccc([O-])cn1)c1ccc(Cl)c(Cl)c1Cl ZINC001136714920 1049844324 /nfs/dbraw/zinc/84/43/24/1049844324.db2.gz ZHKCJNAIRZPSCM-SSDOTTSWSA-N -1 1 345.613 4.238 20 0 EIADMM O=C(N=c1cc(-c2cccs2)[n-][nH]1)c1cc2cc(Cl)ccc2o1 ZINC000617365279 1049982553 /nfs/dbraw/zinc/98/25/53/1049982553.db2.gz DOZYYJIQVDIZEY-UHFFFAOYSA-N -1 1 343.795 4.212 20 0 EIADMM O=C(NCCc1cnc2ccccc2c1)c1ccc2ccccc2c1[O-] ZINC001177310519 1050187967 /nfs/dbraw/zinc/18/79/67/1050187967.db2.gz BLXCCHLYLWJXHD-UHFFFAOYSA-N -1 1 342.398 4.066 20 0 EIADMM O=C(Nc1cccc(C(F)(F)F)c1[O-])[C@@H]1C[C@H]1c1cccs1 ZINC001177543981 1050248791 /nfs/dbraw/zinc/24/87/91/1050248791.db2.gz FBDSSFDKXALMNI-RKDXNWHRSA-N -1 1 327.327 4.215 20 0 EIADMM CN(C(=O)c1ccc([O-])c(F)c1)C(c1ccccc1)c1ccccc1 ZINC001186201989 1050259131 /nfs/dbraw/zinc/25/91/31/1050259131.db2.gz FGFQYSUAMRPSMG-UHFFFAOYSA-N -1 1 335.378 4.393 20 0 EIADMM COc1cc(C(=O)N2CC[C@@H](C3CCCCC3)C2)cc(Cl)c1[O-] ZINC000618182447 1050300177 /nfs/dbraw/zinc/30/01/77/1050300177.db2.gz IDLLAIVLDCLTGE-CYBMUJFWSA-N -1 1 337.847 4.097 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2csc3ccccc32)c(Cl)n1 ZINC001186454610 1050321194 /nfs/dbraw/zinc/32/11/94/1050321194.db2.gz HUKQPXJNZDJSBG-UHFFFAOYSA-N -1 1 338.841 4.059 20 0 EIADMM O=S(=O)([N-]c1c(O)cccc1Cl)c1csc2ccccc21 ZINC001186495527 1050338985 /nfs/dbraw/zinc/33/89/85/1050338985.db2.gz PYMAFLAGHIRIMM-UHFFFAOYSA-N -1 1 339.825 4.061 20 0 EIADMM CN1CCN(c2cccc(Nc3c([S-])cccc3Cl)c2)CC1 ZINC001212717178 1050381476 /nfs/dbraw/zinc/38/14/76/1050381476.db2.gz QTCRHERDBQPSMG-UHFFFAOYSA-N -1 1 333.888 4.124 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N(Cc1cccc(F)c1)C1CCC1 ZINC001178251523 1050411193 /nfs/dbraw/zinc/41/11/93/1050411193.db2.gz GVQHWROSIWLMGF-UHFFFAOYSA-N -1 1 333.790 4.380 20 0 EIADMM Cc1nocc1Nc1ccc(C([O-])(C(F)(F)F)C(F)(F)F)cc1 ZINC001212722250 1050415368 /nfs/dbraw/zinc/41/53/68/1050415368.db2.gz VWZZWXSOXQMHRL-UHFFFAOYSA-N -1 1 340.223 4.039 20 0 EIADMM COc1ccc(Cl)cc1NC(=O)Nc1cc([O-])c(Cl)cc1F ZINC001187926036 1050650807 /nfs/dbraw/zinc/65/08/07/1050650807.db2.gz ZRPGCSVCKLFLNQ-UHFFFAOYSA-N -1 1 345.157 4.491 20 0 EIADMM Cc1c(Br)cncc1NC(=O)c1ccc(C(C)C)cc1[O-] ZINC001179328702 1050675064 /nfs/dbraw/zinc/67/50/64/1050675064.db2.gz DYPQSBKYKSKUJN-UHFFFAOYSA-N -1 1 349.228 4.234 20 0 EIADMM CCN(CC)C(=O)c1ccc(Nc2cc([O-])c(Cl)cc2F)cc1 ZINC001174064370 1050700260 /nfs/dbraw/zinc/70/02/60/1050700260.db2.gz DTLVWULSFBGRFB-UHFFFAOYSA-N -1 1 336.794 4.410 20 0 EIADMM O=C([N-]c1cc(Cl)cc2ncoc21)c1ncsc1C(F)(F)F ZINC001188216419 1050729405 /nfs/dbraw/zinc/72/94/05/1050729405.db2.gz IVFGCPGOQHDVKA-UHFFFAOYSA-N -1 1 347.705 4.209 20 0 EIADMM COc1cccc(C(C)(C)C(=O)Nc2cc(F)c([O-])cc2Cl)c1 ZINC001179660588 1050741174 /nfs/dbraw/zinc/74/11/74/1050741174.db2.gz XWLTVRCWNPLWMA-UHFFFAOYSA-N -1 1 337.778 4.110 20 0 EIADMM COc1ccc(NC(=O)Nc2cccc([O-])c2Cl)cc1Cl ZINC001188474137 1050782873 /nfs/dbraw/zinc/78/28/73/1050782873.db2.gz COZHTPVIPAUDPV-UHFFFAOYSA-N -1 1 327.167 4.352 20 0 EIADMM COc1cc(C)c(NC(=O)c2ccc([O-])c(C(F)(F)F)c2)cc1C ZINC001188589041 1050811436 /nfs/dbraw/zinc/81/14/36/1050811436.db2.gz LSERCWFWSVDAEB-UHFFFAOYSA-N -1 1 339.313 4.289 20 0 EIADMM Cc1ccc(Cl)cc1CNC(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC001179943236 1050826054 /nfs/dbraw/zinc/82/60/54/1050826054.db2.gz HFKYVJUCTUPAOP-UHFFFAOYSA-N -1 1 343.732 4.303 20 0 EIADMM [O-]c1c(Br)ccc(Cl)c1Nc1ccc2n[nH]cc2c1 ZINC001174275711 1050877057 /nfs/dbraw/zinc/87/70/57/1050877057.db2.gz FBVKZFSGIMKHOV-UHFFFAOYSA-N -1 1 338.592 4.428 20 0 EIADMM CC(=O)NCc1cccc(Nc2ccc(Cl)c(Cl)c2[O-])c1 ZINC001174370511 1050935200 /nfs/dbraw/zinc/93/52/00/1050935200.db2.gz LXTVNEAFKXUNAA-UHFFFAOYSA-N -1 1 325.195 4.079 20 0 EIADMM CCCCOc1ccc(NC(=O)Nc2cc(F)cc(F)c2[O-])cc1 ZINC001189315542 1050962353 /nfs/dbraw/zinc/96/23/53/1050962353.db2.gz BDLIDAHEGOMUTK-UHFFFAOYSA-N -1 1 336.338 4.493 20 0 EIADMM CCCCOc1ccc(NC(=O)Nc2c(F)cc([O-])cc2F)cc1 ZINC001189316368 1050962456 /nfs/dbraw/zinc/96/24/56/1050962456.db2.gz PVJVJCVGHFPKNO-UHFFFAOYSA-N -1 1 336.338 4.493 20 0 EIADMM CCCCOc1ccc(NC(=O)Nc2cc(F)c([O-])c(F)c2)cc1 ZINC001189315016 1050962698 /nfs/dbraw/zinc/96/26/98/1050962698.db2.gz JDMZHTYOQRRFRS-UHFFFAOYSA-N -1 1 336.338 4.493 20 0 EIADMM CC(C)(C)OC(=O)N1CC=C(Nc2cc([O-])c(Cl)cc2F)CC1 ZINC001174441337 1050974069 /nfs/dbraw/zinc/97/40/69/1050974069.db2.gz HXAXYQFUFAUJRN-UHFFFAOYSA-N -1 1 342.798 4.121 20 0 EIADMM COc1cccc([N-]S(=O)(=O)c2ccc(F)c3ccccc32)c1C ZINC001189385990 1050975205 /nfs/dbraw/zinc/97/52/05/1050975205.db2.gz ROIJJXZFWSRIFV-UHFFFAOYSA-N -1 1 345.395 4.097 20 0 EIADMM C=Cc1cccc([N-]S(=O)(=O)c2ccc(F)c3ccccc32)c1 ZINC001189387913 1050977305 /nfs/dbraw/zinc/97/73/05/1050977305.db2.gz DBCBDUOVBIJWJH-UHFFFAOYSA-N -1 1 327.380 4.423 20 0 EIADMM O=c1cc(C(F)F)nc(SCCc2c(F)cccc2Cl)[n-]1 ZINC001189477095 1050992098 /nfs/dbraw/zinc/99/20/98/1050992098.db2.gz VNVNTPFTESMRHA-UHFFFAOYSA-N -1 1 334.750 4.247 20 0 EIADMM COc1cc(CCC(=O)Nc2ccc([O-])c(Cl)c2)ccc1Cl ZINC000153456128 1051046812 /nfs/dbraw/zinc/04/68/12/1051046812.db2.gz GFWRXEDXVPEVHV-UHFFFAOYSA-N -1 1 340.206 4.279 20 0 EIADMM Cc1cccc(C)c1OCCSc1nc(C)c(C2CC2)c(=O)[n-]1 ZINC001189885106 1051074295 /nfs/dbraw/zinc/07/42/95/1051074295.db2.gz PUNUWDATNRGMPU-UHFFFAOYSA-N -1 1 330.453 4.156 20 0 EIADMM O=C(NCc1ccc(Cl)cc1Cl)Nc1ccc(F)cc1[O-] ZINC001190093401 1051111813 /nfs/dbraw/zinc/11/18/13/1051111813.db2.gz NPEDUEYIPYELEF-UHFFFAOYSA-N -1 1 329.158 4.160 20 0 EIADMM COc1ccc(C(F)(F)F)cc1Nc1ccc(-n2ccc(=O)[n-]2)cc1 ZINC001174778464 1051171064 /nfs/dbraw/zinc/17/10/64/1051171064.db2.gz MDRRAOSAWXZUOF-UHFFFAOYSA-N -1 1 349.312 4.349 20 0 EIADMM O=S(=O)([N-]c1ccc(C(F)(F)F)cc1)c1ccc(C2CC2)cc1 ZINC001190464282 1051191279 /nfs/dbraw/zinc/19/12/79/1051191279.db2.gz QLCQCUNIEJTCEN-UHFFFAOYSA-N -1 1 341.354 4.384 20 0 EIADMM COc1cc([N-]S(=O)(=O)c2ccc(C3CC3)cc2)ccc1Cl ZINC001190500129 1051196316 /nfs/dbraw/zinc/19/63/16/1051196316.db2.gz NJZJJZVBUWFMQO-UHFFFAOYSA-N -1 1 337.828 4.027 20 0 EIADMM COc1cc(C(=O)Nc2ccc(Cl)c(F)c2)cc(Cl)c1[O-] ZINC000153598837 1051202733 /nfs/dbraw/zinc/20/27/33/1051202733.db2.gz DANWAGNJWAUBQX-UHFFFAOYSA-N -1 1 330.142 4.099 20 0 EIADMM O=S(=O)([N-]c1ccc(-c2cccc(Cl)c2)cc1)c1ccncc1 ZINC001190896982 1051302291 /nfs/dbraw/zinc/30/22/91/1051302291.db2.gz ZBLPDJBCQMFJLY-UHFFFAOYSA-N -1 1 344.823 4.203 20 0 EIADMM CC(C)c1cc(C(=O)[N-]c2nnc(-c3ccccc3Cl)s2)no1 ZINC000154662284 1051321391 /nfs/dbraw/zinc/32/13/91/1051321391.db2.gz DNHKECXDHFFAIY-UHFFFAOYSA-N -1 1 348.815 4.222 20 0 EIADMM COc1cc(C(=O)Nc2ccc(-n3cccc3)cc2)cc(Cl)c1[O-] ZINC001191129839 1051354431 /nfs/dbraw/zinc/35/44/31/1051354431.db2.gz UOVFAPMJPOKRJA-UHFFFAOYSA-N -1 1 342.782 4.097 20 0 EIADMM COc1ncc([N-]c2cc(-c3ccc(OC(F)F)cc3)no2)s1 ZINC001175387568 1051567757 /nfs/dbraw/zinc/56/77/57/1051567757.db2.gz XINNYGOYCKVWJV-UHFFFAOYSA-N -1 1 339.323 4.152 20 0 EIADMM C=Cc1cccc([N-]S(=O)(=O)c2ccc3cc(OC)ccc3c2)c1 ZINC001191969184 1051604015 /nfs/dbraw/zinc/60/40/15/1051604015.db2.gz KAQCSWSMCGTBNK-UHFFFAOYSA-N -1 1 339.416 4.292 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1CC2(CCC2)[C@H]1c1ccncc1 ZINC000621164700 1051706996 /nfs/dbraw/zinc/70/69/96/1051706996.db2.gz GBGXUBGEORHGRE-HXUWFJFHSA-N -1 1 344.414 4.308 20 0 EIADMM O=C(NCc1cccc(-c2cccs2)c1)c1c(F)ccc([O-])c1F ZINC001192551852 1051756189 /nfs/dbraw/zinc/75/61/89/1051756189.db2.gz GRTWKEAYKZXHFJ-UHFFFAOYSA-N -1 1 345.370 4.329 20 0 EIADMM Nc1ccc(-c2ccc(NC(=O)c3c(F)ccc([O-])c3F)cc2)cc1 ZINC001192540247 1051764740 /nfs/dbraw/zinc/76/47/40/1051764740.db2.gz KYSNNVSMIHMNMC-UHFFFAOYSA-N -1 1 340.329 4.172 20 0 EIADMM CCC(F)(F)C[N-]S(=O)(=O)Cc1ccc(C2CCCCC2)cc1 ZINC001192602574 1051773476 /nfs/dbraw/zinc/77/34/76/1051773476.db2.gz YWQOQUPAZWXTCJ-UHFFFAOYSA-N -1 1 345.455 4.199 20 0 EIADMM CC(C)(C)c1cc(C(=O)Nc2nc(Cl)ccc2[O-])cc(Cl)n1 ZINC001183218869 1051808173 /nfs/dbraw/zinc/80/81/73/1051808173.db2.gz QEXFDNRIUGYKOQ-UHFFFAOYSA-N -1 1 340.210 4.039 20 0 EIADMM O=C(CCc1ccc2ccccc2c1)Nc1nc(Cl)ccc1[O-] ZINC001183210093 1051811705 /nfs/dbraw/zinc/81/17/05/1051811705.db2.gz QXRKDJLNRCVWCY-UHFFFAOYSA-N -1 1 326.783 4.165 20 0 EIADMM [O-]C(c1ccc(Nc2cscn2)cc1)(C(F)(F)F)C(F)(F)F ZINC001175942928 1051835212 /nfs/dbraw/zinc/83/52/12/1051835212.db2.gz ACPKVWYZSMDUEH-UHFFFAOYSA-N -1 1 342.264 4.199 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N1CCCSC[C@H]1c1ccccc1 ZINC001176162545 1051950537 /nfs/dbraw/zinc/95/05/37/1051950537.db2.gz FWBMAGUYDCHXAN-INIZCTEOSA-N -1 1 347.867 4.366 20 0 EIADMM CCOc1cc(-c2nc([C@H](C)c3ccco3)no2)cc(Cl)c1[O-] ZINC000621795778 1051955201 /nfs/dbraw/zinc/95/52/01/1051955201.db2.gz PPCAMKRCAQUMPB-SECBINFHSA-N -1 1 334.759 4.239 20 0 EIADMM CSc1cc([N-]S(=O)(=O)c2ccc(C)c3ccccc32)ccn1 ZINC001193834917 1052010090 /nfs/dbraw/zinc/01/00/90/1052010090.db2.gz VRUBXSMXURTVCK-UHFFFAOYSA-N -1 1 344.461 4.066 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc([C@H](C)O)cc2)c2ccccc12 ZINC001193857018 1052014742 /nfs/dbraw/zinc/01/47/42/1052014742.db2.gz KLXIQIBCTDHXFU-AWEZNQCLSA-N -1 1 341.432 4.002 20 0 EIADMM O=C(Nc1ccc([O-])c(Br)c1)Oc1ccc(Cl)cc1 ZINC001194055523 1052063455 /nfs/dbraw/zinc/06/34/55/1052063455.db2.gz FVVZMYOBMDTJMQ-UHFFFAOYSA-N -1 1 342.576 4.419 20 0 EIADMM CC1(C)[C@@H](c2ccc(F)c(F)c2)CCN1C(=O)c1ccc(F)c([O-])c1 ZINC001176417096 1052067466 /nfs/dbraw/zinc/06/74/66/1052067466.db2.gz XSMVQUWGVNTHKU-CYBMUJFWSA-N -1 1 349.352 4.218 20 0 EIADMM Nc1ccc(OC(F)(F)F)c(Nc2c(F)cc(F)c([O-])c2F)c1 ZINC001176670635 1052157476 /nfs/dbraw/zinc/15/74/76/1052157476.db2.gz IVSQQGPWEAMMEG-UHFFFAOYSA-N -1 1 338.207 4.034 20 0 EIADMM Cc1cc(Nc2c(F)cc(F)c([O-])c2F)cnc1Br ZINC001176663881 1052157501 /nfs/dbraw/zinc/15/75/01/1052157501.db2.gz NGJLQJAAHOPNLD-UHFFFAOYSA-N -1 1 333.107 4.019 20 0 EIADMM CCN(CC)C(=O)c1ccccc1Nc1c(F)cc(F)c([O-])c1F ZINC001176674863 1052161642 /nfs/dbraw/zinc/16/16/42/1052161642.db2.gz YZMCYFXWIDWMSQ-UHFFFAOYSA-N -1 1 338.329 4.035 20 0 EIADMM COC(=O)c1oc2ccccc2c1Nc1c(F)cc(F)c([O-])c1F ZINC001176663078 1052173263 /nfs/dbraw/zinc/17/32/63/1052173263.db2.gz AVGRZZVQZGUSOV-UHFFFAOYSA-N -1 1 337.253 4.086 20 0 EIADMM Cc1ccc(N)cc1S(=O)(=O)[N-]c1ccc(C2CCCCC2)cc1 ZINC001176730713 1052175899 /nfs/dbraw/zinc/17/58/99/1052175899.db2.gz MERDVPFQFLHARM-UHFFFAOYSA-N -1 1 344.480 4.426 20 0 EIADMM Cc1cccc(C)c1S(=O)(=O)[N-]c1cnc(CC(C)C)cc1C ZINC001194616546 1052189998 /nfs/dbraw/zinc/18/99/98/1052189998.db2.gz UYRIXLJNHQIRNJ-UHFFFAOYSA-N -1 1 332.469 4.006 20 0 EIADMM CCN(Cc1ccccc1C)C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000622299210 1052192909 /nfs/dbraw/zinc/19/29/09/1052192909.db2.gz OFBRPDNNJFNXAQ-UHFFFAOYSA-N -1 1 337.341 4.382 20 0 EIADMM C/C(=C/c1cccc(Cl)c1)C(=O)NCc1ccc([O-])c(Cl)c1 ZINC001176988895 1052212001 /nfs/dbraw/zinc/21/20/01/1052212001.db2.gz UFLRFXOTPOTOEO-XFFZJAGNSA-N -1 1 336.218 4.419 20 0 EIADMM O=C(NCc1ccc([O-])c(Cl)c1)c1ccc(-c2ccc(F)cc2)o1 ZINC001176987689 1052213945 /nfs/dbraw/zinc/21/39/45/1052213945.db2.gz CDRGADKVFCWDAB-UHFFFAOYSA-N -1 1 345.757 4.375 20 0 EIADMM O=S(=O)([N-]c1c(F)cccc1OC1CCCC1)c1ccsc1 ZINC001185391997 1052228657 /nfs/dbraw/zinc/22/86/57/1052228657.db2.gz HAMJEEDWKDEAQF-UHFFFAOYSA-N -1 1 341.429 4.009 20 0 EIADMM COc1cc([N-]S(=O)(=O)c2ccc(Cl)c(C)c2)ccc1Cl ZINC001185524173 1052255311 /nfs/dbraw/zinc/25/53/11/1052255311.db2.gz CVLOWTSLYLKPDC-UHFFFAOYSA-N -1 1 346.235 4.111 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N(Cc1ccc(F)cc1)C1CC1 ZINC000622675169 1052384556 /nfs/dbraw/zinc/38/45/56/1052384556.db2.gz LTTFEUQRLDPYGI-UHFFFAOYSA-N -1 1 335.378 4.489 20 0 EIADMM CC(C)(C)c1ccncc1CNC(=O)c1cc2ccccc2cc1[O-] ZINC000622704182 1052388885 /nfs/dbraw/zinc/38/88/85/1052388885.db2.gz RKWBDCGNWYLSFQ-UHFFFAOYSA-N -1 1 334.419 4.168 20 0 EIADMM CN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1ccc(Cl)cc1[O-] ZINC000623327086 1052621952 /nfs/dbraw/zinc/62/19/52/1052621952.db2.gz QETKZOLKPMAKKX-UHFFFAOYSA-N -1 1 343.732 4.337 20 0 EIADMM CC(C)Cn1ccnc1CN[C@H](C)c1ccc(Cl)c(Cl)c1[O-] ZINC000185546342 1052635528 /nfs/dbraw/zinc/63/55/28/1052635528.db2.gz PPSYWVKUFSVUMF-LLVKDONJSA-N -1 1 342.270 4.402 20 0 EIADMM Cc1csc(-c2nc(=O)c3c(C)c(-c4ccccc4)sc3[n-]2)n1 ZINC000183642477 1052980658 /nfs/dbraw/zinc/98/06/58/1052980658.db2.gz HNHJMWNCCWDERR-UHFFFAOYSA-N -1 1 339.445 4.392 20 0 EIADMM Cc1ccc(/C=C\S(=O)(=O)[N-]c2ccccc2OC(F)F)cc1 ZINC000213568227 1053124449 /nfs/dbraw/zinc/12/44/49/1053124449.db2.gz JIKRNUCYXCSKTF-KHPPLWFESA-N -1 1 339.363 4.009 20 0 EIADMM CC(C)(C)c1csc(CN[C@@H](CCC(=O)[O-])c2ccccc2)n1 ZINC000864511923 1053298576 /nfs/dbraw/zinc/29/85/76/1053298576.db2.gz RMPFVSAPNTZPTR-AWEZNQCLSA-N -1 1 332.469 4.136 20 0 EIADMM O=C([O-])CCc1cccc(CNCc2ccsc2C(F)(F)F)c1 ZINC000864518544 1053299318 /nfs/dbraw/zinc/29/93/18/1053299318.db2.gz MPJCAAIKPCLKRD-UHFFFAOYSA-N -1 1 343.370 4.074 20 0 EIADMM CC(C)c1cccc(S(=O)(=O)[N-]c2ccc3cccnc3c2)c1 ZINC001195152585 1053305332 /nfs/dbraw/zinc/30/53/32/1053305332.db2.gz GIHGFFHIVBRZEX-UHFFFAOYSA-N -1 1 326.421 4.159 20 0 EIADMM CC(C)c1cccc(S(=O)(=O)Nc2cc([O-])c(Cl)cc2F)c1 ZINC001195156464 1053309929 /nfs/dbraw/zinc/30/99/29/1053309929.db2.gz NKPDEXYJIPIQTJ-UHFFFAOYSA-N -1 1 343.807 4.109 20 0 EIADMM O=C(c1ccc(C(F)(F)F)cc1[O-])N(CCc1ccccc1)C1CC1 ZINC000776490158 1053349527 /nfs/dbraw/zinc/34/95/27/1053349527.db2.gz FYTOEITTWNUHCW-UHFFFAOYSA-N -1 1 349.352 4.258 20 0 EIADMM Cc1nc(SCCC(Cl)(Cl)Cl)[n-]c(=O)c1C1CC1 ZINC000865373484 1053486357 /nfs/dbraw/zinc/48/63/57/1053486357.db2.gz WGLGDCKRMNUTJZ-UHFFFAOYSA-N -1 1 327.664 4.220 20 0 EIADMM Cc1cc(CSc2nc(C)c(C3CC3)c(=O)[n-]2)ccc1N(C)C ZINC000865373267 1053486822 /nfs/dbraw/zinc/48/68/22/1053486822.db2.gz MNCRMEVIXRWLEK-UHFFFAOYSA-N -1 1 329.469 4.035 20 0 EIADMM CC(C)(C)Cc1cc([N-]C(=O)c2snc(Cl)c2Cl)on1 ZINC001196334159 1053641842 /nfs/dbraw/zinc/64/18/42/1053641842.db2.gz PEDDTDHRFKPRON-UHFFFAOYSA-N -1 1 334.228 4.279 20 0 EIADMM Cc1c(O)cccc1[N-]S(=O)(=O)c1ccc2cc(Cl)ccc2c1 ZINC001196434504 1053659987 /nfs/dbraw/zinc/65/99/87/1053659987.db2.gz CTMNXYMJMRWQMD-UHFFFAOYSA-N -1 1 347.823 4.308 20 0 EIADMM C[C@@H]([N-]C(=O)C(F)(F)c1ccccc1F)c1ccc(F)c(F)c1 ZINC000765545077 1053664021 /nfs/dbraw/zinc/66/40/21/1053664021.db2.gz OEDGWSXELSYPQW-SECBINFHSA-N -1 1 329.268 4.073 20 0 EIADMM Cc1nc(CC(C)C)c(C(=O)Nc2cc(F)c([O-])cc2Cl)s1 ZINC000885675788 1053795847 /nfs/dbraw/zinc/79/58/47/1053795847.db2.gz AXKDPCVLXBWYTB-UHFFFAOYSA-N -1 1 342.823 4.400 20 0 EIADMM [O-]c1c(NC(=S)Nc2ccc(F)cc2)cccc1C(F)(F)F ZINC001196948820 1053811880 /nfs/dbraw/zinc/81/18/80/1053811880.db2.gz KZMBQCKCBNYLMT-UHFFFAOYSA-N -1 1 330.306 4.359 20 0 EIADMM O=C(CSc1nccn1-c1cccc(Cl)c1)c1ccc([O-])cc1 ZINC000026047969 1053932355 /nfs/dbraw/zinc/93/23/55/1053932355.db2.gz UAFAHRPYUDBBDX-UHFFFAOYSA-N -1 1 344.823 4.206 20 0 EIADMM O=S(=O)(Cc1c(F)cccc1F)[N-]c1cccc2sccc21 ZINC001197602610 1053954448 /nfs/dbraw/zinc/95/44/48/1053954448.db2.gz CMAOPKWVMMGKAX-UHFFFAOYSA-N -1 1 339.388 4.121 20 0 EIADMM COc1ccc(C(=O)Nc2ccc(OC(C)C)c(Cl)c2)c([O-])c1 ZINC000029800797 1054022302 /nfs/dbraw/zinc/02/23/02/1054022302.db2.gz SLVRXQSAFCYHKJ-UHFFFAOYSA-N -1 1 335.787 4.094 20 0 EIADMM Cc1ccc(NC(=S)Nc2ccc(-n3ccc(=O)[n-]3)cc2)c(C)c1 ZINC001198001395 1054043333 /nfs/dbraw/zinc/04/33/33/1054043333.db2.gz CYXKDWHFIRUTQV-UHFFFAOYSA-N -1 1 338.436 4.004 20 0 EIADMM Cc1ccc(-c2ocnc2C(=O)[N-]c2nc(C(C)(C)C)ns2)cc1 ZINC000265996490 1054051424 /nfs/dbraw/zinc/05/14/24/1054051424.db2.gz DJMSSAVASRKVPW-UHFFFAOYSA-N -1 1 342.424 4.051 20 0 EIADMM [O-]c1cnc(Cl)cc1NC(=S)Nc1cccc(C(F)(F)F)c1 ZINC001198035154 1054061360 /nfs/dbraw/zinc/06/13/60/1054061360.db2.gz LNKKGQAQODECTO-UHFFFAOYSA-N -1 1 347.749 4.268 20 0 EIADMM O=C([O-])CC[C@H](NCc1cncs1)c1ccc(Cl)c(Cl)c1 ZINC000871066261 1054152934 /nfs/dbraw/zinc/15/29/34/1054152934.db2.gz PRDVNSUQIALGLR-ZDUSSCGKSA-N -1 1 345.251 4.146 20 0 EIADMM CC[C@@H]([N-]C(=O)C(F)(F)c1ccccc1F)c1cc(F)ccc1F ZINC000857453392 1054251046 /nfs/dbraw/zinc/25/10/46/1054251046.db2.gz LFZHESZHRBHZOX-OAHLLOKOSA-N -1 1 343.295 4.463 20 0 EIADMM O=C([N-][C@@H](C1CCCCC1)C(F)(F)F)C(F)(F)c1ccccc1 ZINC000857462538 1054253571 /nfs/dbraw/zinc/25/35/71/1054253571.db2.gz IMJZMRCQSOBVLE-ZDUSSCGKSA-N -1 1 335.316 4.406 20 0 EIADMM Cn1ccc2c1cccc2NC(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC001626502519 1054308858 /nfs/dbraw/zinc/30/88/58/1054308858.db2.gz YWUYFIGFHQFUTB-UHFFFAOYSA-N -1 1 334.297 4.155 20 0 EIADMM C[C@H]1C[C@@H](c2ccccc2F)N(C(=O)Cc2ccc([O-])c(Cl)c2)C1 ZINC001137070305 1054524064 /nfs/dbraw/zinc/52/40/64/1054524064.db2.gz AKFIDWNELDKMGG-SJCJKPOMSA-N -1 1 347.817 4.337 20 0 EIADMM C[C@H](c1ccco1)N(C(=O)NCc1ccc([O-])c(Cl)c1)C1CC1 ZINC000876394377 1054894320 /nfs/dbraw/zinc/89/43/20/1054894320.db2.gz UMZVNIUIKIACMB-LLVKDONJSA-N -1 1 334.803 4.074 20 0 EIADMM Cc1c(C)c(C)c(S(=O)(=O)[N-]c2ccc3ncoc3c2)c(C)c1C ZINC001201791888 1054906838 /nfs/dbraw/zinc/90/68/38/1054906838.db2.gz CPENIQJJGCPBKP-UHFFFAOYSA-N -1 1 344.436 4.171 20 0 EIADMM O=C(Nc1ccccc1Cl)Nc1cccc([O-])c1Br ZINC001202064436 1055005581 /nfs/dbraw/zinc/00/55/81/1055005581.db2.gz DDCQLWVYGICLAB-UHFFFAOYSA-N -1 1 341.592 4.452 20 0 EIADMM Cc1c(=O)[n-]c(SCc2cnc(Cl)s2)nc1-c1ccccc1 ZINC000118949166 1055070121 /nfs/dbraw/zinc/07/01/21/1055070121.db2.gz BPZFXKWAAXYOJA-UHFFFAOYSA-N -1 1 349.868 4.148 20 0 EIADMM Cc1cccc(C)c1NC(=O)Nc1cccc([O-])c1Br ZINC001202209197 1055086319 /nfs/dbraw/zinc/08/63/19/1055086319.db2.gz FGGFUIJWYIKHPR-UHFFFAOYSA-N -1 1 335.201 4.416 20 0 EIADMM CC(C)(CC(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)CC(F)(F)F ZINC000878219466 1055210803 /nfs/dbraw/zinc/21/08/03/1055210803.db2.gz MMMVDPOPFRUBLS-UHFFFAOYSA-N -1 1 341.333 4.090 20 0 EIADMM O=C(CCOc1ccc(F)cc1Cl)Nc1ccc([O-])c(Cl)c1 ZINC000111668302 1055226563 /nfs/dbraw/zinc/22/65/63/1055226563.db2.gz YHJNCTXRUOROOP-UHFFFAOYSA-N -1 1 344.169 4.246 20 0 EIADMM CCCCc1nc(C(=O)OCC)c(NC(=O)[C@H]2CCCCC2(C)C)[nH]1 ZINC001128072952 1055715201 /nfs/dbraw/zinc/71/52/01/1055715201.db2.gz BMAHBHHHNUKLIF-CYBMUJFWSA-N -1 1 349.475 4.084 20 0 EIADMM CC(=O)c1cc(-c2nc(-c3ccccc3-c3ccc(C)cc3)no2)n[n-]1 ZINC001212430061 1055936256 /nfs/dbraw/zinc/93/62/56/1055936256.db2.gz YCOZKNHRDYBZQB-UHFFFAOYSA-N -1 1 344.374 4.305 20 0 EIADMM CC(=O)c1cc(-c2nc(-c3ccccc3-c3ccc(C)cc3)no2)[n-]n1 ZINC001212430061 1055936267 /nfs/dbraw/zinc/93/62/67/1055936267.db2.gz YCOZKNHRDYBZQB-UHFFFAOYSA-N -1 1 344.374 4.305 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1cscc1Br ZINC000404813686 1056299150 /nfs/dbraw/zinc/29/91/50/1056299150.db2.gz ORPRGGCDMDDQQF-UHFFFAOYSA-N -1 1 332.606 4.122 20 0 EIADMM CC(=O)c1cccc(OCCCC(=O)Nc2ccc([O-])c(Cl)c2)c1 ZINC000111667009 1056812676 /nfs/dbraw/zinc/81/26/76/1056812676.db2.gz NHLOFCRXTMYKJR-UHFFFAOYSA-N -1 1 347.798 4.046 20 0 EIADMM C[C@H]1CCCC[C@@H]1OCc1nc(=O)c2c3ccccc3sc2[n-]1 ZINC000063580094 1056822104 /nfs/dbraw/zinc/82/21/04/1056822104.db2.gz BBRHKMDRCNTJNF-AAEUAGOBSA-N -1 1 328.437 4.233 20 0 EIADMM Cc1c(F)cccc1S(=O)(=O)[N-]c1cccc(SC(F)F)c1 ZINC000743257833 1058893820 /nfs/dbraw/zinc/89/38/20/1058893820.db2.gz IMLMTXRSCMHMQE-UHFFFAOYSA-N -1 1 347.383 4.250 20 0 EIADMM O=C(Nc1ccc(-n2ccc(=O)[n-]2)cc1)[C@@H]1CCC[C@@H]1c1ccccc1 ZINC001168915528 1060516360 /nfs/dbraw/zinc/51/63/60/1060516360.db2.gz XTNBNVZOBLPVOS-RTBURBONSA-N -1 1 347.418 4.100 20 0 EIADMM CC[C@@H](CC(=O)Nc1ccc(-n2ccc(=O)[n-]2)cc1)c1ccc(C)cc1 ZINC001168915285 1060516613 /nfs/dbraw/zinc/51/66/13/1060516613.db2.gz UKJXEJHSXJGMEC-INIZCTEOSA-N -1 1 349.434 4.409 20 0 EIADMM COc1cc(C(=O)N[C@@H]2CCCCC23CCCC3)cc(Cl)c1[O-] ZINC000428567461 1032068527 /nfs/dbraw/zinc/06/85/27/1032068527.db2.gz BAIFXFSKJXHHAO-OAHLLOKOSA-N -1 1 337.847 4.287 20 0 EIADMM Cc1c(Cl)cccc1OCC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000532748428 1032285696 /nfs/dbraw/zinc/28/56/96/1032285696.db2.gz QJXICNWHUWYGQB-UHFFFAOYSA-N -1 1 326.179 4.025 20 0 EIADMM O=C([O-])[C@H](c1cccc(Cl)c1Cl)N1CCCC(F)(F)CC1 ZINC000629368023 1032473630 /nfs/dbraw/zinc/47/36/30/1032473630.db2.gz HBAULNBKZBDFPC-LBPRGKRZSA-N -1 1 338.181 4.240 20 0 EIADMM Cc1ccc(Cl)c([N-]S(=O)(=O)c2cc(F)c(C)cc2F)c1 ZINC000475738185 1032545686 /nfs/dbraw/zinc/54/56/86/1032545686.db2.gz PBMXBOMFJINGQJ-UHFFFAOYSA-N -1 1 331.771 4.036 20 0 EIADMM CC1(C)Cc2cccc(NC(=O)Nc3ccc([O-])c(Cl)c3)c2O1 ZINC000683083009 1018796727 /nfs/dbraw/zinc/79/67/27/1018796727.db2.gz OUBQTZUIZPOEBN-UHFFFAOYSA-N -1 1 332.787 4.403 20 0 EIADMM CCCc1nc(-c2nc3sc4c(c3c(=O)[n-]2)CC[C@H](C)C4)co1 ZINC000579759850 1018865211 /nfs/dbraw/zinc/86/52/11/1018865211.db2.gz POBMUHIDZLPCEM-VIFPVBQESA-N -1 1 329.425 4.129 20 0 EIADMM COc1cc(C(=O)N2CCCC[C@@H]2c2ccccc2)cc(Cl)c1[O-] ZINC000467776396 1019342211 /nfs/dbraw/zinc/34/22/11/1019342211.db2.gz KULTUOWVWWMTAS-MRXNPFEDSA-N -1 1 345.826 4.422 20 0 EIADMM COc1cc([N-]S(=O)(=O)c2cccc3ccccc32)ccc1Cl ZINC000391472634 1032844176 /nfs/dbraw/zinc/84/41/76/1032844176.db2.gz HXJGQFKZCDISDH-UHFFFAOYSA-N -1 1 347.823 4.303 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2cc(Cl)cc(Cl)c2)c(C)c1O ZINC000047383649 1019897395 /nfs/dbraw/zinc/89/73/95/1019897395.db2.gz PGGUVQSVGNAHKX-UHFFFAOYSA-N -1 1 346.235 4.117 20 0 EIADMM O=C(N[C@@H](c1ccsc1)c1ccc(Cl)cc1)c1cncc([O-])c1 ZINC000339833410 1019899649 /nfs/dbraw/zinc/89/96/49/1019899649.db2.gz GFMDUWCNHZEUFB-MRXNPFEDSA-N -1 1 344.823 4.022 20 0 EIADMM CN(C)[C@@H](C/N=C/c1cc(Cl)cc(Cl)c1[O-])c1ccsc1 ZINC000075580883 1020009546 /nfs/dbraw/zinc/00/95/46/1020009546.db2.gz HXLPQGUXIVOSAC-AVWXOPBPSA-N -1 1 343.279 4.482 20 0 EIADMM [O-]c1c(Br)cccc1CNc1cccc(-c2ncco2)c1 ZINC000160273135 1020386325 /nfs/dbraw/zinc/38/63/25/1020386325.db2.gz KEWZPLUQTWLEQY-UHFFFAOYSA-N -1 1 345.196 4.422 20 0 EIADMM CC(=O)c1cc(F)c([N-]C(=O)c2scnc2C(C)C)c(F)c1F ZINC000410646554 1032913894 /nfs/dbraw/zinc/91/38/94/1032913894.db2.gz ZUAOYNLNTABBHG-UHFFFAOYSA-N -1 1 342.342 4.139 20 0 EIADMM Cc1ccccc1[C@H](CC(F)(F)F)NC(=O)c1ccc([O-])c(F)c1 ZINC000683520164 1020862247 /nfs/dbraw/zinc/86/22/47/1020862247.db2.gz LWPRQJJCIYVALF-AWEZNQCLSA-N -1 1 341.304 4.263 20 0 EIADMM Cc1nc2ccccc2c(C)c1Cc1nc(-c2ccc([O-])cc2F)no1 ZINC000683592233 1020946414 /nfs/dbraw/zinc/94/64/14/1020946414.db2.gz VBMIXMBREYXMLU-UHFFFAOYSA-N -1 1 349.365 4.337 20 0 EIADMM Cc1ccc(Cl)c(OCc2nc(-c3ccc([O-])c(F)c3)no2)c1 ZINC000683593991 1020952766 /nfs/dbraw/zinc/95/27/66/1020952766.db2.gz RZUGTPUGSPBDFI-UHFFFAOYSA-N -1 1 334.734 4.122 20 0 EIADMM FC(F)(F)n1cc([N-]c2nc3cc(Br)ccc3o2)cn1 ZINC001210357663 1021043883 /nfs/dbraw/zinc/04/38/83/1021043883.db2.gz KOHQLZVYYXXCKH-UHFFFAOYSA-N -1 1 347.094 4.007 20 0 EIADMM C[C@@H]([N-]c1nc(-c2ccccc2)no1)c1nc(C(F)(F)F)cs1 ZINC000683758241 1021346176 /nfs/dbraw/zinc/34/61/76/1021346176.db2.gz DVMVRIGVVQEEFT-MRVPVSSYSA-N -1 1 340.330 4.385 20 0 EIADMM CCCc1ccc(S(=O)(=O)[N-]c2ccccc2N2CCCC2)cc1 ZINC000612796958 1021380766 /nfs/dbraw/zinc/38/07/66/1021380766.db2.gz NIBZYXHFWMYXQR-UHFFFAOYSA-N -1 1 344.480 4.040 20 0 EIADMM Cc1ccc(C)c([N-]S(=O)(=O)c2cccc(OC(F)(F)F)c2)c1 ZINC000024218891 1021431118 /nfs/dbraw/zinc/43/11/18/1021431118.db2.gz DEZDOEAGCALRLE-UHFFFAOYSA-N -1 1 345.342 4.003 20 0 EIADMM CC1(C)CN(C(=O)c2ccc(C(F)(F)F)c([O-])c2)[C@@H]2CCC[C@@H]21 ZINC000647497181 1021592823 /nfs/dbraw/zinc/59/28/23/1021592823.db2.gz VHJVEEYWPRMDBO-WCQYABFASA-N -1 1 327.346 4.062 20 0 EIADMM CCc1ccc(CN[C@H](CC(=O)[O-])c2cccc(C(F)(F)F)c2)o1 ZINC000340680705 1021938204 /nfs/dbraw/zinc/93/82/04/1021938204.db2.gz PAUCIPUDJFBSHG-OAHLLOKOSA-N -1 1 341.329 4.166 20 0 EIADMM O=C([N-]c1nnc(-c2ccc(Cl)cc2)s1)c1sccc1F ZINC000479223382 1022031973 /nfs/dbraw/zinc/03/19/73/1022031973.db2.gz WHPVFPKLDLVLSZ-UHFFFAOYSA-N -1 1 339.804 4.311 20 0 EIADMM CCCc1sc(C(=O)Nc2cc([O-])c(F)cc2F)cc1CC ZINC001625893725 1022173025 /nfs/dbraw/zinc/17/30/25/1022173025.db2.gz KZYNWDYQSQQAQX-UHFFFAOYSA-N -1 1 325.380 4.499 20 0 EIADMM O=S(=O)([N-]c1cc(F)ccc1Cl)c1c(F)cccc1Cl ZINC000125965232 1022240611 /nfs/dbraw/zinc/24/06/11/1022240611.db2.gz LMWDCXWTQKHAQF-UHFFFAOYSA-N -1 1 338.162 4.072 20 0 EIADMM COc1ccccc1CSc1nc(-c2ccccc2)c(C)c(=O)[n-]1 ZINC000467206203 1023042013 /nfs/dbraw/zinc/04/20/13/1023042013.db2.gz LHNOCGYKEXEWSX-UHFFFAOYSA-N -1 1 338.432 4.459 20 0 EIADMM COc1cc(-c2nc(=O)c3sc(C)cc3[n-]2)ccc1OC(C)C ZINC000656491015 1023041982 /nfs/dbraw/zinc/04/19/82/1023041982.db2.gz JFXVQDYFJZZJKQ-UHFFFAOYSA-N -1 1 330.409 4.168 20 0 EIADMM CS[C@H]1CCCC[N@H+]([C@@H](C(=O)[O-])c2ccc(Cl)cc2Cl)C1 ZINC000584637769 1023138335 /nfs/dbraw/zinc/13/83/35/1023138335.db2.gz BUZFEGLIFGBYFW-SMDDNHRTSA-N -1 1 348.295 4.337 20 0 EIADMM O=S(=O)([N-]c1ccc(-c2ccccc2)cc1F)c1ccccc1F ZINC000031721647 1023180011 /nfs/dbraw/zinc/18/00/11/1023180011.db2.gz ANERXWLHHJJTNF-UHFFFAOYSA-N -1 1 345.370 4.433 20 0 EIADMM CC[C@@H](NC(=O)c1ccc(Br)c([O-])c1)c1cccs1 ZINC000179146951 1023208431 /nfs/dbraw/zinc/20/84/31/1023208431.db2.gz NPEKDITYCGBCLS-LLVKDONJSA-N -1 1 340.242 4.097 20 0 EIADMM CC(C)(C)c1nc2cc(NC(=O)c3ccc([O-])cc3F)ccc2o1 ZINC000181121948 1023232263 /nfs/dbraw/zinc/23/22/63/1023232263.db2.gz ISLRJHLOZZSXMT-UHFFFAOYSA-N -1 1 328.343 4.222 20 0 EIADMM O=C(Nc1ccc(-n2cnc3ccccc32)cc1)c1ccc([O-])cc1F ZINC000181086095 1023236447 /nfs/dbraw/zinc/23/64/47/1023236447.db2.gz IRLVSIUSLWFSMV-UHFFFAOYSA-N -1 1 347.349 4.123 20 0 EIADMM O=c1cc(C2CC2)nc(SCc2ncc(-c3cccs3)o2)[n-]1 ZINC000188143129 1023293501 /nfs/dbraw/zinc/29/35/01/1023293501.db2.gz SPLSWRWEXKPWIT-UHFFFAOYSA-N -1 1 331.422 4.068 20 0 EIADMM O=C([O-])C[C@H](NCc1ccc(Cl)o1)c1cccc(C(F)(F)F)c1 ZINC000417575394 1023366306 /nfs/dbraw/zinc/36/63/06/1023366306.db2.gz FTVGJAYOMGBPSP-LBPRGKRZSA-N -1 1 347.720 4.257 20 0 EIADMM CC1(c2ccc(Cl)cc2)CCN(C(=O)c2ccc([O-])c(F)c2)CC1 ZINC000684322502 1023394117 /nfs/dbraw/zinc/39/41/17/1023394117.db2.gz BHPGUVOWBBJJTI-UHFFFAOYSA-N -1 1 347.817 4.379 20 0 EIADMM CCOc1cc(C(=O)N(C)[C@H](C)C2CCCCC2)cc(Cl)c1[O-] ZINC000549167426 1023412153 /nfs/dbraw/zinc/41/21/53/1023412153.db2.gz VKBIVZSSSMXFMV-GFCCVEGCSA-N -1 1 339.863 4.485 20 0 EIADMM Cc1nc2cc([N-]S(=O)(=O)c3cccc(C(C)C)c3)ccc2o1 ZINC000460436889 1023544297 /nfs/dbraw/zinc/54/42/97/1023544297.db2.gz LLSMPYBXNOBUCK-UHFFFAOYSA-N -1 1 330.409 4.060 20 0 EIADMM Cc1nc(-c2ccc(NC[C@H]3CCCC3(C)C)nc2)[n-]c(=O)c1C ZINC000549246361 1023547538 /nfs/dbraw/zinc/54/75/38/1023547538.db2.gz HFDNBMWITFYQCG-OAHLLOKOSA-N -1 1 326.444 4.099 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2ccccc2C(C)(C)C)c(C)c1O ZINC000460439059 1023548221 /nfs/dbraw/zinc/54/82/21/1023548221.db2.gz WXQDYNALIKKVJW-UHFFFAOYSA-N -1 1 333.453 4.107 20 0 EIADMM Cc1ccccc1[N-]S(=O)(=O)c1ccc(C)c(C(F)(F)F)c1 ZINC000500293654 1023668825 /nfs/dbraw/zinc/66/88/25/1023668825.db2.gz XOZPVILIZKAMKG-UHFFFAOYSA-N -1 1 329.343 4.123 20 0 EIADMM Cc1nc2cc([N-]S(=O)(=O)c3ccc(C(C)C)cc3)ccc2o1 ZINC000008110052 1023685495 /nfs/dbraw/zinc/68/54/95/1023685495.db2.gz WQZZOVDEJGEEID-UHFFFAOYSA-N -1 1 330.409 4.060 20 0 EIADMM Cc1ccc(Cl)cc1[N-]S(=O)(=O)c1cccc(C(F)F)c1 ZINC000780366045 1023811613 /nfs/dbraw/zinc/81/16/13/1023811613.db2.gz PWFUXAJYIUTFPS-UHFFFAOYSA-N -1 1 331.771 4.387 20 0 EIADMM CC1(NC(=O)c2ccc(C(F)(F)F)c([O-])c2)CCC(F)(F)CC1 ZINC000628612933 1023825900 /nfs/dbraw/zinc/82/59/00/1023825900.db2.gz QKMLRMAUXSNUIW-UHFFFAOYSA-N -1 1 337.288 4.109 20 0 EIADMM CCc1ccc(CN(Cc2nc(=O)c3sccc3[n-]2)C2CC2)cc1 ZINC000083823659 1023855511 /nfs/dbraw/zinc/85/55/11/1023855511.db2.gz PMSDWJZCXVFPSL-UHFFFAOYSA-N -1 1 339.464 4.124 20 0 EIADMM CC(C)n1ncc2cc(/C=C/C(=O)c3ccc([O-])cc3)c(Cl)nc21 ZINC000027542520 1024327138 /nfs/dbraw/zinc/32/71/38/1024327138.db2.gz AQICXBXVGXFPSF-VMPITWQZSA-N -1 1 341.798 4.267 20 0 EIADMM C[C@@H](c1cccs1)N(C)C(=O)c1ccc(Br)c([O-])c1 ZINC000133162517 1024830879 /nfs/dbraw/zinc/83/08/79/1024830879.db2.gz ZFSKECWRUAAMBS-VIFPVBQESA-N -1 1 340.242 4.049 20 0 EIADMM O=C([O-])CC[C@H]1CCCN(Cc2cc(-c3ccccc3Cl)on2)C1 ZINC000652496181 1024855115 /nfs/dbraw/zinc/85/51/15/1024855115.db2.gz NEDQFZXHGVZIJZ-CYBMUJFWSA-N -1 1 348.830 4.072 20 0 EIADMM Cc1c(F)cncc1Nc1cc(Br)cc(Cl)c1[O-] ZINC001216196385 1024959883 /nfs/dbraw/zinc/95/98/83/1024959883.db2.gz QMHVSFMJYCJYMR-UHFFFAOYSA-N -1 1 331.572 4.394 20 0 EIADMM [O-]c1ccc(F)cc1-c1nc(-c2ccc(Oc3ccccc3)nc2)no1 ZINC000184851900 1024982615 /nfs/dbraw/zinc/98/26/15/1024982615.db2.gz VGDXUGSXTFZBKH-UHFFFAOYSA-N -1 1 349.321 4.436 20 0 EIADMM O=C([N-]c1nc(-c2ccc(F)cc2)ns1)c1ccc(C(F)F)o1 ZINC001126236964 1025139493 /nfs/dbraw/zinc/13/94/93/1025139493.db2.gz RKMDLXXHGXZLDS-UHFFFAOYSA-N -1 1 339.298 4.127 20 0 EIADMM CCO[C@@H](C)c1ncc(C(=O)[N-]c2c(F)cc(Cl)cc2F)s1 ZINC000342078848 1025145304 /nfs/dbraw/zinc/14/53/04/1025145304.db2.gz XJBRMJXQYFGDAM-ZETCQYMHSA-N -1 1 346.786 4.425 20 0 EIADMM Cc1c(C(=O)N=c2cc(-c3ccc(Cl)s3)[n-][nH]2)ccn1C(C)C ZINC000343902684 1025214944 /nfs/dbraw/zinc/21/49/44/1025214944.db2.gz YGYZYADJJMTIHY-UHFFFAOYSA-N -1 1 348.859 4.157 20 0 EIADMM CSc1cccc(C)c1[N-]S(=O)(=O)c1ccc(Cl)cc1 ZINC000471991782 1025230766 /nfs/dbraw/zinc/23/07/66/1025230766.db2.gz KQRYNISPGBVFNK-UHFFFAOYSA-N -1 1 327.858 4.171 20 0 EIADMM C/C=C/c1ccc(OCC(=O)Nc2ccc([O-])c(Cl)c2)c(OC)c1 ZINC000067739023 1025234850 /nfs/dbraw/zinc/23/48/50/1025234850.db2.gz HFVVYULVMFVKLI-ONEGZZNKSA-N -1 1 347.798 4.105 20 0 EIADMM CCCOc1c(OC)cc(C(=O)[O-])cc1-c1ccc2n[nH]c(C)c2c1 ZINC000657203198 1025276018 /nfs/dbraw/zinc/27/60/18/1025276018.db2.gz LCKQTEYKVAKGAW-UHFFFAOYSA-N -1 1 340.379 4.034 20 0 EIADMM Cc1noc(-c2ccccc2)c1[N-]C(=O)c1noc2c1CCCCC2 ZINC000157718457 1026022367 /nfs/dbraw/zinc/02/23/67/1026022367.db2.gz JEKBANUAMYCNPQ-UHFFFAOYSA-N -1 1 337.379 4.159 20 0 EIADMM Cc1cc(Cl)ccc1[N-]S(=O)(=O)c1ccc(Cl)cc1C ZINC000048652592 1026026926 /nfs/dbraw/zinc/02/69/26/1026026926.db2.gz WSHLQZYZZUCPOV-UHFFFAOYSA-N -1 1 330.236 4.411 20 0 EIADMM Cc1ccc(-c2csc3[n-]c(-c4cscn4)nc(=O)c23)cc1 ZINC000432518871 1026275788 /nfs/dbraw/zinc/27/57/88/1026275788.db2.gz LUNSWBOTCDLEAI-UHFFFAOYSA-N -1 1 325.418 4.496 20 0 EIADMM Cc1noc2nc(C3CC3)cc(C(=O)Nc3ccc([O-])c(Cl)c3)c12 ZINC000111666711 1026313573 /nfs/dbraw/zinc/31/35/73/1026313573.db2.gz TURNWHNBYHYXFI-UHFFFAOYSA-N -1 1 343.770 4.020 20 0 EIADMM COc1ccc(C(=O)CCCC(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000111667917 1026314068 /nfs/dbraw/zinc/31/40/68/1026314068.db2.gz NPGMBHLBYRRFCD-UHFFFAOYSA-N -1 1 347.798 4.046 20 0 EIADMM O=C([O-])[C@@H](NCc1cccc(Cl)c1F)c1ccc(Cl)c(F)c1 ZINC000426764495 1026529944 /nfs/dbraw/zinc/52/99/44/1026529944.db2.gz XCLODADBAYVZQQ-AWEZNQCLSA-N -1 1 346.160 4.187 20 0 EIADMM O=C([O-])[C@@H](NCc1cccc(Cl)c1Cl)c1ccc(F)cc1 ZINC000426763262 1026530557 /nfs/dbraw/zinc/53/05/57/1026530557.db2.gz AEQCQTYJPGYRRN-AWEZNQCLSA-N -1 1 328.170 4.048 20 0 EIADMM COc1cc(C(=O)N[C@@H]2CCCc3ccc(C)cc32)cc(Cl)c1[O-] ZINC000344697728 1026548655 /nfs/dbraw/zinc/54/86/55/1026548655.db2.gz XTHVPKAAODFBMW-MRXNPFEDSA-N -1 1 345.826 4.170 20 0 EIADMM Cc1ccc([C@H](CC(=O)[O-])NCc2ccc(C(F)(F)F)cc2C)o1 ZINC000426776751 1026553010 /nfs/dbraw/zinc/55/30/10/1026553010.db2.gz HLOXHAUTESUHSS-AWEZNQCLSA-N -1 1 341.329 4.221 20 0 EIADMM O=C([O-])C[C@H](NCc1cc(F)cc(Cl)c1)c1ccc(F)cc1F ZINC000426837308 1026585794 /nfs/dbraw/zinc/58/57/94/1026585794.db2.gz WTGVGESVIVZGPQ-HNNXBMFYSA-N -1 1 343.732 4.063 20 0 EIADMM COc1c(Br)cc(F)cc1[N-]c1noc(C(C)(C)C)n1 ZINC001211708438 1026622051 /nfs/dbraw/zinc/62/20/51/1026622051.db2.gz SMRMYFIOFKXQHI-UHFFFAOYSA-N -1 1 344.184 4.021 20 0 EIADMM COc1ccc(Cl)cc1NC(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684868968 1026623116 /nfs/dbraw/zinc/62/31/16/1026623116.db2.gz LWRZKZLIIREVRZ-UHFFFAOYSA-N -1 1 345.704 4.325 20 0 EIADMM O=C(N[C@H](c1ccccc1)C1CC1)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684870731 1026633462 /nfs/dbraw/zinc/63/34/62/1026633462.db2.gz MNPKGHQOZXOQHY-MRXNPFEDSA-N -1 1 335.325 4.292 20 0 EIADMM [O-]c1cccc(CN2CCc3[nH]c4ccc(F)cc4c3C2)c1Cl ZINC000507493347 1026816327 /nfs/dbraw/zinc/81/63/27/1026816327.db2.gz TUAIBFQXKJGWPE-UHFFFAOYSA-N -1 1 330.790 4.224 20 0 EIADMM CCOc1cc(-c2noc(-c3cc(C4CC4)on3)n2)cc(Cl)c1[O-] ZINC000277794981 1026956265 /nfs/dbraw/zinc/95/62/65/1026956265.db2.gz FKDZUUYUNSQVBR-UHFFFAOYSA-N -1 1 347.758 4.027 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2ccc(C)c(-c3ncco3)c2)c(C)s1 ZINC000164660958 1027082480 /nfs/dbraw/zinc/08/24/80/1027082480.db2.gz JLLREGDIYKEWGD-UHFFFAOYSA-N -1 1 348.449 4.129 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1ncoc1-c1ccc(F)cc1 ZINC000474516094 1027169747 /nfs/dbraw/zinc/16/97/47/1027169747.db2.gz SHDBMXILSYFRLW-UHFFFAOYSA-N -1 1 332.718 4.092 20 0 EIADMM CCOc1cc(-c2nc([C@@H]3CC3(Cl)Cl)no2)cc(Cl)c1[O-] ZINC000896812123 1027876566 /nfs/dbraw/zinc/87/65/66/1027876566.db2.gz XNOQKNAXRIMYOX-ZETCQYMHSA-N -1 1 349.601 4.156 20 0 EIADMM COc1cc(C(=O)N2CCCC3(CCCCC3)C2)cc(Cl)c1[O-] ZINC000153810971 1027976932 /nfs/dbraw/zinc/97/69/32/1027976932.db2.gz RNJVOTRCRRFZPO-UHFFFAOYSA-N -1 1 337.847 4.241 20 0 EIADMM COc1cc(C(=O)N2CC[C@H](C)C[C@@H]2c2ccco2)cc(Cl)c1[O-] ZINC000153928219 1028064763 /nfs/dbraw/zinc/06/47/63/1028064763.db2.gz XMHDYIGAPMTWEH-SMDDNHRTSA-N -1 1 349.814 4.261 20 0 EIADMM O=C([O-])[C@@H](NCc1cccc(-c2ccccc2)c1)c1ccccc1F ZINC000426780451 1028075046 /nfs/dbraw/zinc/07/50/46/1028075046.db2.gz RWJSVGQUPJWYQM-FQEVSTJZSA-N -1 1 335.378 4.408 20 0 EIADMM CCc1ccc([C@H](C)CC(=O)Nc2ccc(-c3cc(=O)[nH][n-]3)cc2)cc1 ZINC000523426356 1028083483 /nfs/dbraw/zinc/08/34/83/1028083483.db2.gz FUPATLBBQRCRAV-CQSZACIVSA-N -1 1 349.434 4.477 20 0 EIADMM O=C(c1ccc([O-])cc1F)N1CCC[C@@H]1c1nc2ccccc2s1 ZINC000154767080 1028284085 /nfs/dbraw/zinc/28/40/85/1028284085.db2.gz KUQAEJFZFAQRBN-OAHLLOKOSA-N -1 1 342.395 4.118 20 0 EIADMM O=C([O-])c1sccc1CN1CCC[C@H]1c1nc2ccccc2s1 ZINC000583268155 1028378723 /nfs/dbraw/zinc/37/87/23/1028378723.db2.gz LLCXLFOAFNIOIB-ZDUSSCGKSA-N -1 1 344.461 4.393 20 0 EIADMM CCC[C@H](C)c1nc(-c2cc(Br)c([O-])c(OC)c2)no1 ZINC000445393862 1028509495 /nfs/dbraw/zinc/50/94/95/1028509495.db2.gz PWMPDDCVEWNLOZ-QMMMGPOBSA-N -1 1 341.205 4.117 20 0 EIADMM CC/C=C(/C)c1nc(-c2cc(Br)c([O-])c(OC)c2)no1 ZINC000445400509 1028514156 /nfs/dbraw/zinc/51/41/56/1028514156.db2.gz DYTLREQHPUYWFJ-YVMONPNESA-N -1 1 339.189 4.027 20 0 EIADMM CCOc1cc(C(=O)NC(C)(C)CC(C)(C)C)cc(Cl)c1[O-] ZINC000546583682 1028525226 /nfs/dbraw/zinc/52/52/26/1028525226.db2.gz HVPZUMBQERKBQK-UHFFFAOYSA-N -1 1 327.852 4.389 20 0 EIADMM CCOc1cc(-c2noc(/C=C/c3cccnc3)n2)cc(Cl)c1[O-] ZINC000445427070 1028527291 /nfs/dbraw/zinc/52/72/91/1028527291.db2.gz NNVRKAOSGVFASL-AATRIKPKSA-N -1 1 343.770 4.060 20 0 EIADMM Cc1cccc(C)c1OCc1nc(-c2ccc([O-])cc2Cl)no1 ZINC000445448304 1028537854 /nfs/dbraw/zinc/53/78/54/1028537854.db2.gz RQFUSYAZBMRHFI-UHFFFAOYSA-N -1 1 330.771 4.291 20 0 EIADMM COc1cccc([C@H](C)Cc2nc(-c3ccc([O-])cc3Cl)no2)c1 ZINC000445445214 1028577636 /nfs/dbraw/zinc/57/76/36/1028577636.db2.gz IIMWPINNCCNQMX-LLVKDONJSA-N -1 1 344.798 4.450 20 0 EIADMM COc1cccc([C@@H](C)Cc2nc(-c3ccc([O-])cc3Cl)no2)c1 ZINC000445445215 1028579135 /nfs/dbraw/zinc/57/91/35/1028579135.db2.gz IIMWPINNCCNQMX-NSHDSACASA-N -1 1 344.798 4.450 20 0 EIADMM Cc1ccccc1NCCc1nc(-c2ccc([O-])cc2Cl)no1 ZINC000445447396 1028582582 /nfs/dbraw/zinc/58/25/82/1028582582.db2.gz ORONQCNCGAGEQS-UHFFFAOYSA-N -1 1 329.787 4.059 20 0 EIADMM CCc1nc(SCc2c(C)cc(C)c(C(C)=O)c2C)[n-]c(=O)c1C ZINC000566498650 1028585801 /nfs/dbraw/zinc/58/58/01/1028585801.db2.gz FICNLOARPHSMBZ-UHFFFAOYSA-N -1 1 344.480 4.473 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cc(Br)cs3)n2)c(F)c1 ZINC000445465746 1028587920 /nfs/dbraw/zinc/58/79/20/1028587920.db2.gz VBNMCEUBBVFWPI-UHFFFAOYSA-N -1 1 341.161 4.072 20 0 EIADMM [O-]c1ccc(-c2noc(CCCc3c[nH]c4ccccc34)n2)cc1F ZINC000445470894 1028597958 /nfs/dbraw/zinc/59/79/58/1028597958.db2.gz LQYXUOSBKHNOTD-UHFFFAOYSA-N -1 1 337.354 4.238 20 0 EIADMM Cc1ccc(-c2cc(-c3nc(-c4ccc([O-])cc4F)no3)on2)cc1 ZINC000445462735 1028617642 /nfs/dbraw/zinc/61/76/42/1028617642.db2.gz FRWXUFAHIHXJSW-UHFFFAOYSA-N -1 1 337.310 4.212 20 0 EIADMM [O-]c1ccc(-c2noc(CCSc3ccccc3F)n2)cc1F ZINC000445480669 1028627384 /nfs/dbraw/zinc/62/73/84/1028627384.db2.gz MPJMIALJUZOPKC-UHFFFAOYSA-N -1 1 334.347 4.055 20 0 EIADMM C[C@H](Cc1nc(-c2ccc([O-])c(F)c2)no1)c1ccc(F)cc1F ZINC000445480804 1028627937 /nfs/dbraw/zinc/62/79/37/1028627937.db2.gz KQFMCCWPITXRCV-SECBINFHSA-N -1 1 334.297 4.206 20 0 EIADMM [O-]c1ccc(-c2noc([C@H]3C[C@@]34CCCc3ccccc34)n2)cc1F ZINC000445482649 1028630235 /nfs/dbraw/zinc/63/02/35/1028630235.db2.gz SXLSZTIEEKKONR-FOIQADDNSA-N -1 1 336.366 4.343 20 0 EIADMM CCOc1ccc(SCc2nc(-c3ccc([O-])c(F)c3)no2)cc1 ZINC000445483545 1028632463 /nfs/dbraw/zinc/63/24/63/1028632463.db2.gz SHSVWEGTTHGCDY-UHFFFAOYSA-N -1 1 346.383 4.272 20 0 EIADMM [O-]c1ccc(-c2noc([C@@H]3C[C@@H]3c3cccc(F)c3F)n2)cc1F ZINC000445484160 1028634264 /nfs/dbraw/zinc/63/42/64/1028634264.db2.gz WICNIOQGYPJKCJ-GHMZBOCLSA-N -1 1 332.281 4.131 20 0 EIADMM COc1cc(Br)cc(C)c1Nc1cc(F)c([O-])c(F)c1 ZINC001213384469 1028730849 /nfs/dbraw/zinc/73/08/49/1028730849.db2.gz NXEDAEWFZZYTFV-UHFFFAOYSA-N -1 1 344.155 4.494 20 0 EIADMM COc1ccc(-c2nc(Cc3ccc(Cl)cc3C)no2)c([O-])c1 ZINC000445589234 1028754091 /nfs/dbraw/zinc/75/40/91/1028754091.db2.gz QVUKVYHDUMPXNB-UHFFFAOYSA-N -1 1 330.771 4.003 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1CCc2c1cc(F)cc2F ZINC000192612705 1028758521 /nfs/dbraw/zinc/75/85/21/1028758521.db2.gz RLTRLYABIZBLGU-UHFFFAOYSA-N -1 1 325.314 4.027 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2c(Cl)cccc2Cl)c(F)c1 ZINC000016147256 1028860143 /nfs/dbraw/zinc/86/01/43/1028860143.db2.gz FKGFSOBSGCOVMM-UHFFFAOYSA-N -1 1 334.199 4.242 20 0 EIADMM Cc1ccc(-c2noc(-c3ccc([O-])cc3F)n2)cc1N1CCCC1 ZINC000445814703 1028908361 /nfs/dbraw/zinc/90/83/61/1028908361.db2.gz BJNVWIHPFZWEPS-UHFFFAOYSA-N -1 1 339.370 4.157 20 0 EIADMM C[C@@H](Sc1nc(C(F)F)cc(=O)[n-]1)C(=O)c1cccc(Cl)c1 ZINC000583623434 1028950985 /nfs/dbraw/zinc/95/09/85/1028950985.db2.gz KFDPWFUGOYTIQB-SSDOTTSWSA-N -1 1 344.770 4.137 20 0 EIADMM Cc1ccsc1S(=O)(=O)[N-]c1ccc2nc(C3CCC3)[nH]c2c1 ZINC000343466406 1029304401 /nfs/dbraw/zinc/30/44/01/1029304401.db2.gz KKFONFSQZFEDIT-UHFFFAOYSA-N -1 1 347.465 4.001 20 0 EIADMM CCOc1cc(C(=O)Nc2c(C)cccc2OC)cc(Cl)c1[O-] ZINC000192950034 1029652678 /nfs/dbraw/zinc/65/26/78/1029652678.db2.gz BJATYTWACVDMKY-UHFFFAOYSA-N -1 1 335.787 4.014 20 0 EIADMM Cc1ccc(Cl)c([N-]S(=O)(=O)c2ccc(Cl)s2)c1C ZINC000446963845 1029653568 /nfs/dbraw/zinc/65/35/68/1029653568.db2.gz CVWMFDZJWGDNTL-UHFFFAOYSA-N -1 1 336.265 4.473 20 0 EIADMM CCN(CCOc1ccccc1C)Cc1cc(C(=O)[O-])ccc1Cl ZINC000584243762 1029690548 /nfs/dbraw/zinc/69/05/48/1029690548.db2.gz ZDFKSCJQVZZNPF-UHFFFAOYSA-N -1 1 347.842 4.248 20 0 EIADMM CCc1cccc(S(=O)(=O)[N-]c2cccc(-c3ncc(C)o3)c2)c1 ZINC000080940101 1029764677 /nfs/dbraw/zinc/76/46/77/1029764677.db2.gz APGWCEDAKNWEPT-UHFFFAOYSA-N -1 1 342.420 4.013 20 0 EIADMM Cc1nc(-c2ccc(NCC3(CC(C)C)CCC3)nc2)[n-]c(=O)c1C ZINC000301606215 1029770981 /nfs/dbraw/zinc/77/09/81/1029770981.db2.gz MZIQAAXPMSWNHV-UHFFFAOYSA-N -1 1 340.471 4.489 20 0 EIADMM CCCCCC(C)(C)C(=O)N1CCC(C(=O)c2ccc([O-])cc2)CC1 ZINC000084622202 1029830413 /nfs/dbraw/zinc/83/04/13/1029830413.db2.gz JALAISWXBWFZKE-UHFFFAOYSA-N -1 1 345.483 4.420 20 0 EIADMM Cc1nc(-c2ccc(N[C@@H]3CC[C@@H]4CCC[C@H]4C3)nc2)[n-]c(=O)c1C ZINC000525706932 1029941357 /nfs/dbraw/zinc/94/13/57/1029941357.db2.gz LTRFLBKLPXPZGF-YQQAZPJKSA-N -1 1 338.455 4.242 20 0 EIADMM C[C@@H]1CN(C(=O)c2cc3ccccc3cc2[O-])C[C@@H](c2ccccc2)O1 ZINC000143491240 1030070494 /nfs/dbraw/zinc/07/04/94/1030070494.db2.gz ICWOPYVAMVCCRW-VFNWGFHPSA-N -1 1 347.414 4.148 20 0 EIADMM COc1cc(C(=O)N[C@@H]2CC[C@@H]3CCCC[C@@H]3C2)cc(Cl)c1[O-] ZINC000525953756 1030122005 /nfs/dbraw/zinc/12/20/05/1030122005.db2.gz SNWNINXHEUFWBW-OUCADQQQSA-N -1 1 337.847 4.143 20 0 EIADMM O=C(c1cc(Cl)ccc1[O-])N1CCC(F)(c2ccccc2)CC1 ZINC000447606467 1030226615 /nfs/dbraw/zinc/22/66/15/1030226615.db2.gz DOZKQLLCEMXNRF-UHFFFAOYSA-N -1 1 333.790 4.147 20 0 EIADMM CCOc1cc(C(=O)N2CCCC[C@@H]2C(C)C)cc(Cl)c1[O-] ZINC000186817304 1030308453 /nfs/dbraw/zinc/30/84/53/1030308453.db2.gz YNIFUUWJRIMICC-CQSZACIVSA-N -1 1 325.836 4.095 20 0 EIADMM Cc1cc(C(=O)Nc2ccc([O-])c(Cl)c2)c2c(n1)onc2C(C)C ZINC000171881335 1030420798 /nfs/dbraw/zinc/42/07/98/1030420798.db2.gz CRTYTEPVNQBPBF-UHFFFAOYSA-N -1 1 345.786 4.266 20 0 EIADMM Cc1noc(-c2ccccc2)c1[N-]C(=O)c1oc(CC2CC2)nc1C ZINC000530504358 1030484316 /nfs/dbraw/zinc/48/43/16/1030484316.db2.gz PXEOLOGFALMLFC-UHFFFAOYSA-N -1 1 337.379 4.151 20 0 EIADMM O=c1cc(C(F)F)nc(S[C@H]2CCCc3ccc(F)cc32)[n-]1 ZINC000685575268 1030536335 /nfs/dbraw/zinc/53/63/35/1030536335.db2.gz BHGSUVSQPNSVDR-LBPRGKRZSA-N -1 1 326.343 4.429 20 0 EIADMM COc1cc(C(=O)Nc2nc3c(cccc3C)s2)cc(Cl)c1[O-] ZINC000527195603 1030563802 /nfs/dbraw/zinc/56/38/02/1030563802.db2.gz PZPBMPKHKJIDDX-UHFFFAOYSA-N -1 1 348.811 4.225 20 0 EIADMM Cc1ccccc1[C@@H](CC(F)(F)F)NCc1ccc(C(=O)[O-])cc1 ZINC000263415747 1030856879 /nfs/dbraw/zinc/85/68/79/1030856879.db2.gz NECCSDRTIXIQEW-MRXNPFEDSA-N -1 1 337.341 4.477 20 0 EIADMM COc1cc(C(=O)N[C@H]2CCCc3c(F)cccc32)cc(Cl)c1[O-] ZINC000452572986 1031144788 /nfs/dbraw/zinc/14/47/88/1031144788.db2.gz JSMBFWFSNALKIY-HNNXBMFYSA-N -1 1 349.789 4.001 20 0 EIADMM CSc1cccc([N-]S(=O)(=O)c2cccc3ccccc32)c1 ZINC000389560247 1031500758 /nfs/dbraw/zinc/50/07/58/1031500758.db2.gz BIKVZPOQXKEPDT-UHFFFAOYSA-N -1 1 329.446 4.363 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2cc(-c3ncco3)ccc2C)cc1C ZINC000134678323 1032009943 /nfs/dbraw/zinc/00/99/43/1032009943.db2.gz NVHKGOVUCSEWPK-UHFFFAOYSA-N -1 1 342.420 4.068 20 0 EIADMM Cc1cc(F)c(S(=O)(=O)[N-]c2c(C)c(F)ccc2Cl)cc1F ZINC000433141145 1033917982 /nfs/dbraw/zinc/91/79/82/1033917982.db2.gz MKECEJYFSUCQOE-UHFFFAOYSA-N -1 1 349.761 4.175 20 0 EIADMM CCC(=O)c1cccc([N-]S(=O)(=O)c2ccc(C)c(Cl)c2)c1 ZINC000433607744 1034843359 /nfs/dbraw/zinc/84/33/59/1034843359.db2.gz XYSUTFWTJMGSQE-UHFFFAOYSA-N -1 1 337.828 4.042 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)Nc1c2c(ccc1Cl)OCC2 ZINC000433803342 1034933059 /nfs/dbraw/zinc/93/30/59/1034933059.db2.gz CPWLJCWOLMWHDE-UHFFFAOYSA-N -1 1 339.178 4.278 20 0 EIADMM CCCC[C@H](NCc1ccc(-c2nc3ccccc3s2)o1)C(=O)[O-] ZINC000262696996 1034966890 /nfs/dbraw/zinc/96/68/90/1034966890.db2.gz IOFPTSLQKBGJQE-AWEZNQCLSA-N -1 1 344.436 4.289 20 0 EIADMM CC(C)(CC(=O)Nc1c([O-])cccc1F)CC(=O)c1ccccc1 ZINC000669612465 1036227394 /nfs/dbraw/zinc/22/73/94/1036227394.db2.gz VQDJHIUOSTVTRW-UHFFFAOYSA-N -1 1 329.371 4.159 20 0 EIADMM CO[C@@H](C)c1cccc([N-]S(=O)(=O)c2ccc(C(C)C)cc2)c1 ZINC000588833865 1036543905 /nfs/dbraw/zinc/54/39/05/1036543905.db2.gz VIXSSPSYAWVSMH-AWEZNQCLSA-N -1 1 333.453 4.318 20 0 EIADMM CN(C)c1c(Cl)cccc1NC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000486251038 1036587207 /nfs/dbraw/zinc/58/72/07/1036587207.db2.gz CBQOOIBJKNZPBO-UHFFFAOYSA-N -1 1 340.210 4.409 20 0 EIADMM Cc1ccc(-c2nnco2)cc1NC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000486905080 1036890063 /nfs/dbraw/zinc/89/00/63/1036890063.db2.gz BNFIOIZPAFTKEL-UHFFFAOYSA-N -1 1 344.758 4.048 20 0 EIADMM O=C(Nc1ccc(OCC2CC2)cc1)Nc1ccc([O-])c(Cl)c1 ZINC000486931247 1036894949 /nfs/dbraw/zinc/89/49/49/1036894949.db2.gz APHGLRGSUVRPQW-UHFFFAOYSA-N -1 1 332.787 4.478 20 0 EIADMM CCCCCCO[C@@H](C)C(=O)Nc1cccc([O-])c1Br ZINC000908708462 1036919851 /nfs/dbraw/zinc/91/98/51/1036919851.db2.gz XQIBVOLFHRRNRC-NSHDSACASA-N -1 1 344.249 4.079 20 0 EIADMM Cc1ccccc1CN(C)Cn1c(CCC2CCCC2)n[n-]c1=S ZINC000058204924 1037586143 /nfs/dbraw/zinc/58/61/43/1037586143.db2.gz DAXJBEOCCRKATL-UHFFFAOYSA-N -1 1 344.528 4.461 20 0 EIADMM CC(C)C(=O)c1ccc([C@@H](C)C(=O)Nc2cc(F)cc(F)c2[O-])cc1 ZINC000910985979 1037596181 /nfs/dbraw/zinc/59/61/81/1037596181.db2.gz DJWLIIMQNRPVIU-LLVKDONJSA-N -1 1 347.361 4.251 20 0 EIADMM Cc1cccc(-c2n[n-]c(=S)n2Cc2nc(-c3ccccc3)no2)c1 ZINC000171777993 1037652210 /nfs/dbraw/zinc/65/22/10/1037652210.db2.gz KQOCMDIFCLQFGH-UHFFFAOYSA-N -1 1 349.419 4.014 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1CCS[C@@H](c2ccccc2)C1 ZINC000605108509 1037676732 /nfs/dbraw/zinc/67/67/32/1037676732.db2.gz WVAINOZXUXQFRL-HXUWFJFHSA-N -1 1 349.455 4.476 20 0 EIADMM CC(C)N(CC(=O)[O-])Cc1ccc(-c2ccc(C(F)(F)F)cc2)o1 ZINC000414656374 1037685929 /nfs/dbraw/zinc/68/59/29/1037685929.db2.gz KUGSAUNCKBBTRW-UHFFFAOYSA-N -1 1 341.329 4.260 20 0 EIADMM CC(=O)c1ccc(-c2ccc(C(=O)Nc3c([O-])cccc3F)o2)cc1 ZINC000605438264 1037788215 /nfs/dbraw/zinc/78/82/15/1037788215.db2.gz DNDOOPFOSAVTPX-UHFFFAOYSA-N -1 1 339.322 4.246 20 0 EIADMM CCc1cccc(CC)c1S(=O)(=O)[N-]c1ccc2[nH]ccc2c1 ZINC000605495436 1037823395 /nfs/dbraw/zinc/82/33/95/1037823395.db2.gz BZWROHGZYJNFSP-UHFFFAOYSA-N -1 1 328.437 4.094 20 0 EIADMM COc1ccc2nc(-c3nc4ccc(C(C)C)cc4c(=O)[n-]3)ccc2c1 ZINC000489179711 1037888753 /nfs/dbraw/zinc/88/87/53/1037888753.db2.gz ZUORAYCIKKNSBW-UHFFFAOYSA-N -1 1 345.402 4.270 20 0 EIADMM O=C([O-])CCC1CCN(CCc2cc(Cl)cc(Cl)c2)CC1 ZINC000574405864 1038209744 /nfs/dbraw/zinc/20/97/44/1038209744.db2.gz FJNHPCZXRVYGGD-UHFFFAOYSA-N -1 1 330.255 4.113 20 0 EIADMM CCc1ccc(S(=O)(=O)[N-]c2ccc(CC(F)(F)F)cc2)cc1 ZINC000607615652 1038240367 /nfs/dbraw/zinc/24/03/67/1038240367.db2.gz INUIWXNGWOPDGA-UHFFFAOYSA-N -1 1 343.370 4.155 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1ccc(F)c(Br)c1 ZINC000173378861 1038300166 /nfs/dbraw/zinc/30/01/66/1038300166.db2.gz NHAOEEPIDOQGPQ-UHFFFAOYSA-N -1 1 344.567 4.200 20 0 EIADMM CCCCCc1nnc([N-]C(=O)c2cnc(-c3ccco3)s2)s1 ZINC000504438445 1038364006 /nfs/dbraw/zinc/36/40/06/1038364006.db2.gz LAILRHOIHXBXGB-UHFFFAOYSA-N -1 1 348.453 4.240 20 0 EIADMM O=C(N=c1cc(-c2ccc(Cl)s2)[n-][nH]1)c1sccc1C1CC1 ZINC000534552784 1039555785 /nfs/dbraw/zinc/55/57/85/1039555785.db2.gz JUSVJGBMXYPBJN-UHFFFAOYSA-N -1 1 349.868 4.405 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cc(-c4cccc(F)c4)no3)n2)cc1F ZINC000556003441 1039857732 /nfs/dbraw/zinc/85/77/32/1039857732.db2.gz NWXLUFSBBUKGDO-UHFFFAOYSA-N -1 1 341.273 4.042 20 0 EIADMM Cc1oc([C@H](C)[N@H+]2CC[C@@H](C(F)(F)F)C3(CCC3)C2)cc1C(=O)[O-] ZINC000518201344 1040084979 /nfs/dbraw/zinc/08/49/79/1040084979.db2.gz WNZILTIDIOPEED-IINYFYTJSA-N -1 1 345.361 4.402 20 0 EIADMM Cc1oc([C@H](C)N2CC[C@@H](C(F)(F)F)C3(CCC3)C2)cc1C(=O)[O-] ZINC000518201344 1040084991 /nfs/dbraw/zinc/08/49/91/1040084991.db2.gz WNZILTIDIOPEED-IINYFYTJSA-N -1 1 345.361 4.402 20 0 EIADMM CC(=O)c1ccc([N-]S(=O)(=O)c2cccc(C(C)C)c2)cc1C ZINC000535342012 1040204299 /nfs/dbraw/zinc/20/42/99/1040204299.db2.gz TYNFADDMEQVSOM-UHFFFAOYSA-N -1 1 331.437 4.122 20 0 EIADMM CCOc1cc(C(=O)N[C@H]2CCCC[C@H]2CC)cc(Cl)c1[O-] ZINC000567977221 1040265246 /nfs/dbraw/zinc/26/52/46/1040265246.db2.gz IFBMXIDBTNDRSS-RISCZKNCSA-N -1 1 325.836 4.143 20 0 EIADMM Cc1ccc([C@@H](C)N(C)C(=O)c2ccc(Br)c([O-])c2)cc1 ZINC000482517278 1040313993 /nfs/dbraw/zinc/31/39/93/1040313993.db2.gz ARLBRQSZANWAPK-GFCCVEGCSA-N -1 1 348.240 4.296 20 0 EIADMM CCc1cc(C)c(C(=O)Nc2cc(C)cc(Br)c2[O-])o1 ZINC000482599088 1040384017 /nfs/dbraw/zinc/38/40/17/1040384017.db2.gz DQSAGWLPKHGWJJ-UHFFFAOYSA-N -1 1 338.201 4.179 20 0 EIADMM COc1cc(C)c([N-]S(=O)(=O)c2cccc(C(C)C)c2)cc1F ZINC000479574351 1040485842 /nfs/dbraw/zinc/48/58/42/1040485842.db2.gz DOLRDGWBBWKONE-UHFFFAOYSA-N -1 1 337.416 4.067 20 0 EIADMM COc1cc(C(=O)N2CCC(c3ccccc3)CC2)cc(Cl)c1[O-] ZINC000483109154 1040705641 /nfs/dbraw/zinc/70/56/41/1040705641.db2.gz PTFUTZNANDPHNT-UHFFFAOYSA-N -1 1 345.826 4.074 20 0 EIADMM CSc1cc(Cl)ccc1[N-]C(=O)c1snnc1C(C)C ZINC001121132827 1040759523 /nfs/dbraw/zinc/75/95/23/1040759523.db2.gz GLJFXZOWRAIXTJ-UHFFFAOYSA-N -1 1 327.862 4.289 20 0 EIADMM CC(C)OCc1cccc([N-]S(=O)(=O)c2cccc(Cl)c2)c1 ZINC000063849372 1040803495 /nfs/dbraw/zinc/80/34/95/1040803495.db2.gz JLRWCGPANODPKQ-UHFFFAOYSA-N -1 1 339.844 4.066 20 0 EIADMM Cc1ccc2c(CCc3nc(-c4ccc([O-])cc4F)no3)c[nH]c2c1 ZINC000445457591 1040808017 /nfs/dbraw/zinc/80/80/17/1040808017.db2.gz TVPWFGBRBLXWQO-UHFFFAOYSA-N -1 1 337.354 4.156 20 0 EIADMM Cc1cccc(CSCc2nc(-c3ccc([O-])cc3F)no2)c1 ZINC000445461116 1040847224 /nfs/dbraw/zinc/84/72/24/1040847224.db2.gz FMTRWFKDPPVDEL-UHFFFAOYSA-N -1 1 330.384 4.323 20 0 EIADMM CCc1ccccc1S(=O)(=O)[N-]c1cccc(C(C)(F)F)c1 ZINC000436159431 1040914305 /nfs/dbraw/zinc/91/43/05/1040914305.db2.gz FJAKWPIYYBOZJG-UHFFFAOYSA-N -1 1 325.380 4.162 20 0 EIADMM Cc1cc2cc[nH]c2cc1[N-]S(=O)(=O)c1cccc2ccccc21 ZINC000436182167 1040950166 /nfs/dbraw/zinc/95/01/66/1040950166.db2.gz ZZAOBIMVHWLFNR-UHFFFAOYSA-N -1 1 336.416 4.430 20 0 EIADMM CCc1cc(=O)[n-]c(SCc2csc(-c3ccc(C)o3)n2)n1 ZINC000436208902 1040960191 /nfs/dbraw/zinc/96/01/91/1040960191.db2.gz JVPUTZGINRQZDK-UHFFFAOYSA-N -1 1 333.438 4.062 20 0 EIADMM Cc1nc(-c2ccc(N[C@H]3CCC[C@H](C(C)C)C3)nc2)[n-]c(=O)c1C ZINC000462828812 1040985129 /nfs/dbraw/zinc/98/51/29/1040985129.db2.gz QPQLWQDCHBYXFF-RDJZCZTQSA-N -1 1 340.471 4.488 20 0 EIADMM CCCCCc1nnc([N-]C(=O)c2cc(F)c(F)c(F)c2F)s1 ZINC000014714470 1041082553 /nfs/dbraw/zinc/08/25/53/1041082553.db2.gz QLQITTKFBCAUCS-UHFFFAOYSA-N -1 1 347.337 4.080 20 0 EIADMM Cc1cccc(F)c1[N-]S(=O)(=O)c1ccc(C(C)(C)C)s1 ZINC000461115274 1041245549 /nfs/dbraw/zinc/24/55/49/1041245549.db2.gz STLRKCDUNJIDMV-UHFFFAOYSA-N -1 1 327.446 4.294 20 0 EIADMM CCOc1cc(NC(=O)c2ccc3ccccc3c2[O-])ccc1OC ZINC000436520508 1041301723 /nfs/dbraw/zinc/30/17/23/1041301723.db2.gz GVOUOXBNNBTBOW-UHFFFAOYSA-N -1 1 337.375 4.205 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1CC[C@@H](Cc2ccc(F)cc2)C1 ZINC000436528438 1041313729 /nfs/dbraw/zinc/31/37/29/1041313729.db2.gz LPQZQAPCGALMNX-INIZCTEOSA-N -1 1 349.405 4.389 20 0 EIADMM COC(=O)c1cnc(S[C@H](c2ccccc2)c2ccccc2C)[n-]1 ZINC000484552808 1041324174 /nfs/dbraw/zinc/32/41/74/1041324174.db2.gz ABMYHLLJTFCTNG-QGZVFWFLSA-N -1 1 338.432 4.386 20 0 EIADMM COC(=O)c1c[n-]c(S[C@H](c2ccccc2)c2ccccc2C)n1 ZINC000484552808 1041324182 /nfs/dbraw/zinc/32/41/82/1041324182.db2.gz ABMYHLLJTFCTNG-QGZVFWFLSA-N -1 1 338.432 4.386 20 0 EIADMM O=C(c1cc(Cl)ccc1[O-])N1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000436554312 1041328050 /nfs/dbraw/zinc/32/80/50/1041328050.db2.gz KCVCREOSVHSWLL-GFCCVEGCSA-N -1 1 336.218 4.329 20 0 EIADMM CCS[C@H]1CCCCN(C(=O)c2ccc3ccccc3c2[O-])C1 ZINC000436551437 1041329476 /nfs/dbraw/zinc/32/94/76/1041329476.db2.gz YYJSGSRAEFKUNX-HNNXBMFYSA-N -1 1 329.465 4.293 20 0 EIADMM CN(Cc1cc(Cl)cc(Cl)c1)C(=O)c1cc(F)ccc1[O-] ZINC000436561315 1041343234 /nfs/dbraw/zinc/34/32/34/1041343234.db2.gz FSFLCHWTPRBWNR-UHFFFAOYSA-N -1 1 328.170 4.110 20 0 EIADMM CC[C@@H](C)[C@@H](C)N(C(=O)c1ccc(Br)cc1[O-])C1CC1 ZINC000436563047 1041343529 /nfs/dbraw/zinc/34/35/29/1041343529.db2.gz CJOMSGFUBGJPID-GHMZBOCLSA-N -1 1 340.261 4.194 20 0 EIADMM CC[C@@H](NC(=O)c1ccc2ccccc2c1[O-])c1nc(C)cs1 ZINC000436564835 1041344669 /nfs/dbraw/zinc/34/46/69/1041344669.db2.gz HVXWXXVVKDNOSQ-OAHLLOKOSA-N -1 1 326.421 4.191 20 0 EIADMM C[C@H]1CN(C(=O)c2cc(Cl)ccc2[O-])CC[C@@H]1c1ccccc1 ZINC000436592114 1041351983 /nfs/dbraw/zinc/35/19/83/1041351983.db2.gz ZOYZSBRDFWMXCX-BBRMVZONSA-N -1 1 329.827 4.311 20 0 EIADMM Cn1cccc1[C@H]1CCCCN1C(=O)c1ccc2ccccc2c1[O-] ZINC000436578427 1041357101 /nfs/dbraw/zinc/35/71/01/1041357101.db2.gz WSZOPSSKCZQCMO-LJQANCHMSA-N -1 1 334.419 4.251 20 0 EIADMM O=C(c1ccc([O-])cc1F)N(CCC(F)(F)F)Cc1ccccc1 ZINC000436580796 1041358746 /nfs/dbraw/zinc/35/87/46/1041358746.db2.gz DHSNNTCSUOKEDA-UHFFFAOYSA-N -1 1 341.304 4.126 20 0 EIADMM COc1c(F)cc(F)cc1NC(=O)c1ccc2ccccc2c1[O-] ZINC000436582799 1041360656 /nfs/dbraw/zinc/36/06/56/1041360656.db2.gz CBCPAPOANSTMAF-UHFFFAOYSA-N -1 1 329.302 4.085 20 0 EIADMM C[C@@H]([C@@H]1Cc2ccccc2O1)N(C)C(=O)c1cc2ccccc2cc1[O-] ZINC000436609211 1041370301 /nfs/dbraw/zinc/37/03/01/1041370301.db2.gz VRHAVKUAADJBFI-QKKBWIMNSA-N -1 1 347.414 4.010 20 0 EIADMM Cc1ccccc1[C@@H]1CCN(C(=O)c2cc3ccccc3cc2[O-])C1 ZINC000436623815 1041390208 /nfs/dbraw/zinc/39/02/08/1041390208.db2.gz JEIUHJQTODYJBL-GOSISDBHSA-N -1 1 331.415 4.484 20 0 EIADMM O=C(N[C@H](c1ccco1)c1ccccc1)c1ccc(Cl)cc1[O-] ZINC000436654296 1041396761 /nfs/dbraw/zinc/39/67/61/1041396761.db2.gz IETQAPKREHZGMB-KRWDZBQOSA-N -1 1 327.767 4.158 20 0 EIADMM Cc1cccc(CO[N-]C(=O)[C@@H](C)c2ccc(Cl)c(Cl)c2)n1 ZINC000898934451 1041415349 /nfs/dbraw/zinc/41/53/49/1041415349.db2.gz OJSHNWIXBHEBNI-NSHDSACASA-N -1 1 339.222 4.048 20 0 EIADMM O=C(NCc1ccc2ccccc2n1)c1ccc2ccccc2c1[O-] ZINC000436705347 1041435006 /nfs/dbraw/zinc/43/50/06/1041435006.db2.gz MTFWJUDKFNPIPO-UHFFFAOYSA-N -1 1 328.371 4.024 20 0 EIADMM O=C(NC1CCC(c2ccc(F)cc2)CC1)c1ccc([O-])cc1F ZINC000436726153 1041435767 /nfs/dbraw/zinc/43/57/67/1041435767.db2.gz WOZONZRJCNPCON-UHFFFAOYSA-N -1 1 331.362 4.127 20 0 EIADMM O=C(Nc1ncc(-c2ccccc2F)s1)c1ccc([O-])cc1F ZINC000436714922 1041438342 /nfs/dbraw/zinc/43/83/42/1041438342.db2.gz JUYCLFXOPUMRKY-UHFFFAOYSA-N -1 1 332.331 4.046 20 0 EIADMM CC1(C)CN(C(=O)c2ccc(C(F)(F)F)cc2[O-])[C@H]2CCC[C@H]21 ZINC000436738637 1041448036 /nfs/dbraw/zinc/44/80/36/1041448036.db2.gz UAWPPYFYTKOQRE-OLZOCXBDSA-N -1 1 327.346 4.062 20 0 EIADMM O=C(N[C@H]1CCCc2sc(Cl)cc21)c1ccc([O-])cc1F ZINC000436738710 1041448452 /nfs/dbraw/zinc/44/84/52/1041448452.db2.gz OTMRGKUOEQQRAM-LBPRGKRZSA-N -1 1 325.792 4.054 20 0 EIADMM C[C@H](c1cc(F)ccc1F)N(C)C(=O)c1ccc(Cl)cc1[O-] ZINC000436759884 1041458182 /nfs/dbraw/zinc/45/81/82/1041458182.db2.gz HVLJKHARSJCMME-SECBINFHSA-N -1 1 325.742 4.157 20 0 EIADMM CN(Cc1ccc(Cl)s1)C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436763879 1041459718 /nfs/dbraw/zinc/45/97/18/1041459718.db2.gz MTGNBOTTYARZLF-UHFFFAOYSA-N -1 1 349.761 4.398 20 0 EIADMM C[C@H](NC(=O)c1ccc([O-])cc1F)c1ccc(F)c2ccccc21 ZINC000436748806 1041461294 /nfs/dbraw/zinc/46/12/94/1041461294.db2.gz HHNBNTKLSXDEEA-NSHDSACASA-N -1 1 327.330 4.315 20 0 EIADMM C[C@H]1C[C@H](c2ccccc2)CCN1C(=O)c1cc(Cl)ccc1[O-] ZINC000436749599 1041461504 /nfs/dbraw/zinc/46/15/04/1041461504.db2.gz KLRIWJIGPPNREE-DZGCQCFKSA-N -1 1 329.827 4.454 20 0 EIADMM O=C(Nc1ccccc1-c1c(F)cccc1F)c1ccc(O)cc1[O-] ZINC000436751805 1041463179 /nfs/dbraw/zinc/46/31/79/1041463179.db2.gz UYKBKMLODMBVNC-UHFFFAOYSA-N -1 1 341.313 4.295 20 0 EIADMM CCS[C@H]1CC[C@@H](N(C)C(=O)c2ccc(C(F)(F)F)cc2[O-])C1 ZINC000436752309 1041464841 /nfs/dbraw/zinc/46/48/41/1041464841.db2.gz QYKDWZSSOMKVAK-NEPJUHHUSA-N -1 1 347.402 4.157 20 0 EIADMM COc1cc(-c2nc(-c3occc3C(C)C)no2)cc(Cl)c1[O-] ZINC000436774921 1041468801 /nfs/dbraw/zinc/46/88/01/1041468801.db2.gz OINKJYAANAAKFE-UHFFFAOYSA-N -1 1 334.759 4.488 20 0 EIADMM CCN(C(=O)c1ccc(C(F)(F)F)cc1[O-])c1ccc(F)cc1 ZINC000436790917 1041484124 /nfs/dbraw/zinc/48/41/24/1041484124.db2.gz JRABLRZFJBBSTA-UHFFFAOYSA-N -1 1 327.277 4.217 20 0 EIADMM CC1(C)CN(C(=O)c2ccc3ccccc3c2[O-])CC2(CCCC2)O1 ZINC000436795329 1041484877 /nfs/dbraw/zinc/48/48/77/1041484877.db2.gz FGOLGYFAIPLDAE-UHFFFAOYSA-N -1 1 339.435 4.109 20 0 EIADMM C[C@@H](c1ccc(F)cc1)N(C)C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436796222 1041485614 /nfs/dbraw/zinc/48/56/14/1041485614.db2.gz VBXPFEYHVLGFCK-JTQLQIEISA-N -1 1 341.304 4.383 20 0 EIADMM CC1(C)CN(C(=O)c2cc3ccccc3cc2[O-])CC2(CCCC2)O1 ZINC000436795073 1041485722 /nfs/dbraw/zinc/48/57/22/1041485722.db2.gz DWBNMFAWKKYIEN-UHFFFAOYSA-N -1 1 339.435 4.109 20 0 EIADMM O=C(NCc1csc(-c2ccccc2)n1)c1cc(Cl)ccc1[O-] ZINC000436802559 1041489492 /nfs/dbraw/zinc/48/94/92/1041489492.db2.gz DIOBJEZRJCLXOP-UHFFFAOYSA-N -1 1 344.823 4.099 20 0 EIADMM Cc1ccccc1[C@H](CC(F)(F)F)NC(=O)c1c([O-])cccc1F ZINC000436812211 1041490976 /nfs/dbraw/zinc/49/09/76/1041490976.db2.gz ALUWBUKNUSSQPP-ZDUSSCGKSA-N -1 1 341.304 4.263 20 0 EIADMM Cc1cc(Br)c([O-])c(NC(=O)c2ccoc2C(C)C)c1 ZINC000480732613 1041494637 /nfs/dbraw/zinc/49/46/37/1041494637.db2.gz SSEUTPYJRYLMQR-UHFFFAOYSA-N -1 1 338.201 4.432 20 0 EIADMM CC[C@H]1CN(C(=O)c2ccc([O-])cc2F)c2cccc(Cl)c2O1 ZINC000436828345 1041496494 /nfs/dbraw/zinc/49/64/94/1041496494.db2.gz HTUBAOPUFKNLQY-NSHDSACASA-N -1 1 335.762 4.003 20 0 EIADMM CN(Cc1ccc(Cl)c(Cl)c1)C(=O)c1ccc([O-])cc1F ZINC000436861110 1041519482 /nfs/dbraw/zinc/51/94/82/1041519482.db2.gz IXGPCFPIUZLDGT-UHFFFAOYSA-N -1 1 328.170 4.110 20 0 EIADMM C[C@H](NC(=O)c1ccc([O-])cc1F)C(c1ccccc1)c1ccccc1 ZINC000436862142 1041520118 /nfs/dbraw/zinc/52/01/18/1041520118.db2.gz MZMNMQWMDJLKSD-HNNXBMFYSA-N -1 1 349.405 4.482 20 0 EIADMM CCOc1cc(-c2noc(C(C)(C)C(F)F)n2)cc(Cl)c1[O-] ZINC000436870761 1041529970 /nfs/dbraw/zinc/52/99/70/1041529970.db2.gz IIVZTPCKKWRLOQ-UHFFFAOYSA-N -1 1 332.734 4.037 20 0 EIADMM [O-]c1ccc(-c2noc(/C=C/c3cc(F)c(F)c(F)c3)n2)c(F)c1 ZINC000436877526 1041537934 /nfs/dbraw/zinc/53/79/34/1041537934.db2.gz HAQDQLKEFPXNJS-DAFODLJHSA-N -1 1 336.244 4.169 20 0 EIADMM COc1cc(-c2nc(Cc3ccc(C)s3)no2)cc(Cl)c1[O-] ZINC000436887901 1041542714 /nfs/dbraw/zinc/54/27/14/1041542714.db2.gz RJXZLALJHQZTSP-UHFFFAOYSA-N -1 1 336.800 4.065 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1CCc2c1c(F)ccc2F ZINC000436902679 1041547266 /nfs/dbraw/zinc/54/72/66/1041547266.db2.gz FXWGSBGTIZCOBA-UHFFFAOYSA-N -1 1 325.314 4.027 20 0 EIADMM Cc1ccc(-c2ncc[nH]2)cc1NC(=O)c1cc2ccccc2cc1[O-] ZINC000436908709 1041548901 /nfs/dbraw/zinc/54/89/01/1041548901.db2.gz JENGSBLTYRJUKI-UHFFFAOYSA-N -1 1 343.386 4.496 20 0 EIADMM O=C(Nc1ccc(OC(F)F)c(Cl)c1)c1c(F)ccc([O-])c1F ZINC000538820772 1041551334 /nfs/dbraw/zinc/55/13/34/1041551334.db2.gz CUQWUOYSCSMYCY-UHFFFAOYSA-N -1 1 349.667 4.178 20 0 EIADMM C[C@@H]1C[C@@H](c2ccccc2)[C@@H](C)N1C(=O)c1ccc(Cl)cc1[O-] ZINC000436927848 1041561958 /nfs/dbraw/zinc/56/19/58/1041561958.db2.gz AAWQBWMIUQFTKN-PBFPGSCMSA-N -1 1 329.827 4.452 20 0 EIADMM CCC(C)(C)OCc1ccccc1NC(=O)c1ccc(O)cc1[O-] ZINC000436937592 1041566647 /nfs/dbraw/zinc/56/66/47/1041566647.db2.gz GJVDJYPAYRHGPQ-UHFFFAOYSA-N -1 1 329.396 4.055 20 0 EIADMM [O-]c1c(-c2nc(-c3ccc4nc[nH]c4c3)no2)ccc2ccccc21 ZINC000436942121 1041568529 /nfs/dbraw/zinc/56/85/29/1041568529.db2.gz UIGXDKNEUGKYRX-UHFFFAOYSA-N -1 1 328.331 4.139 20 0 EIADMM O=C(Nc1ccc(SC2CCCC2)cc1)C(=O)c1ccc([O-])cc1 ZINC000437007557 1041591371 /nfs/dbraw/zinc/59/13/71/1041591371.db2.gz VLVQQPAPCMTMKH-UHFFFAOYSA-N -1 1 341.432 4.248 20 0 EIADMM Cc1ccc(C(=O)[C@@H](C)Sc2nc(C(F)F)cc(=O)[n-]2)cc1C ZINC000516688265 1041710188 /nfs/dbraw/zinc/71/01/88/1041710188.db2.gz YLLXSMINJPCFRP-SNVBAGLBSA-N -1 1 338.379 4.100 20 0 EIADMM C[C@H](Sc1nc(C(F)F)cc(=O)[n-]1)c1ncc(C(C)(C)C)o1 ZINC000289303108 1041739851 /nfs/dbraw/zinc/73/98/51/1041739851.db2.gz BTTSVZAUYCWVRA-ZETCQYMHSA-N -1 1 329.372 4.259 20 0 EIADMM O=C([N-]c1c(F)cc(Cl)cc1F)c1ccoc1C(F)(F)F ZINC000464287299 1041933354 /nfs/dbraw/zinc/93/33/54/1041933354.db2.gz POTKOAXKHNRCJH-UHFFFAOYSA-N -1 1 325.620 4.482 20 0 EIADMM CC(C)c1cccc(S(=O)(=O)[N-]c2ccc3c(c2)C(=O)CCC3)c1 ZINC000425958806 1042085268 /nfs/dbraw/zinc/08/52/68/1042085268.db2.gz PHWBPRLKXOLSCI-UHFFFAOYSA-N -1 1 343.448 4.130 20 0 EIADMM Cc1ccc(C(=O)N=c2cc(-c3cccs3)[n-][nH]2)c(Cl)c1C ZINC000542170506 1042315936 /nfs/dbraw/zinc/31/59/36/1042315936.db2.gz GKINWQZEDOYVLZ-UHFFFAOYSA-N -1 1 331.828 4.083 20 0 EIADMM CCCCN1CCc2ccc(NC(=O)c3c(F)ccc([O-])c3F)cc21 ZINC000438881525 1042405738 /nfs/dbraw/zinc/40/57/38/1042405738.db2.gz KOUTZXDBLDHFIT-UHFFFAOYSA-N -1 1 346.377 4.085 20 0 EIADMM O=C(c1ccc([O-])c(F)c1)N1[C@@H]2CC[C@H]1C[C@@H](c1ccccc1)C2 ZINC000669936852 1042466418 /nfs/dbraw/zinc/46/64/18/1042466418.db2.gz CZQGAMPMKMYCSC-BJWYYQGGSA-N -1 1 325.383 4.082 20 0 EIADMM Cc1ccc(C)c(S(=O)(=O)[N-]c2ccccc2CC(F)(F)F)c1 ZINC000172901606 1042511914 /nfs/dbraw/zinc/51/19/14/1042511914.db2.gz NSNYGEJUUMZNBV-UHFFFAOYSA-N -1 1 343.370 4.209 20 0 EIADMM COc1ccc(C(=O)Nc2ccc(COC3CCCC3)cc2)c([O-])c1 ZINC000303887765 1042525838 /nfs/dbraw/zinc/52/58/38/1042525838.db2.gz ZEPIWELDXRWUPY-UHFFFAOYSA-N -1 1 341.407 4.112 20 0 EIADMM CCC[C@@H](C)[C@@H]1CCCN1C(=O)c1ccc(Br)c([O-])c1 ZINC000492031906 1042538439 /nfs/dbraw/zinc/53/84/39/1042538439.db2.gz DMZIKZWOEBNQAU-RISCZKNCSA-N -1 1 340.261 4.196 20 0 EIADMM Cc1cn(C2CCCCC2)nc1NC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000519054145 1042805233 /nfs/dbraw/zinc/80/52/33/1042805233.db2.gz YJDZTXBEFQIUJT-UHFFFAOYSA-N -1 1 348.834 4.122 20 0 EIADMM Cc1ccc(Cl)cc1S(=O)(=O)[N-]c1ccc2ncsc2c1 ZINC000520700788 1043011717 /nfs/dbraw/zinc/01/17/17/1043011717.db2.gz PPVCUYAPUYESSQ-UHFFFAOYSA-N -1 1 338.841 4.059 20 0 EIADMM Cc1c(C(=O)Nc2ccc([O-])c(Cl)c2)[nH]c2c1C(=O)CC(C)(C)C2 ZINC000182871990 1043035223 /nfs/dbraw/zinc/03/52/23/1043035223.db2.gz QWYQRNCLAZUDJO-UHFFFAOYSA-N -1 1 346.814 4.090 20 0 EIADMM Cc1cc(Br)c([O-])c(NC(=O)CCc2cccs2)c1 ZINC000182911562 1043035431 /nfs/dbraw/zinc/03/54/31/1043035431.db2.gz IREZHAXXNWPAKY-UHFFFAOYSA-N -1 1 340.242 4.096 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@@H]1C[C@@H]1c1cc(F)c(F)c(F)c1 ZINC000184001957 1043072417 /nfs/dbraw/zinc/07/24/17/1043072417.db2.gz LTVKRLCOQGTFQA-NXEZZACHSA-N -1 1 341.716 4.205 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)[C@H]1C[C@]12CCCc1ccccc12 ZINC000509153324 1043081483 /nfs/dbraw/zinc/08/14/83/1043081483.db2.gz GILRYDZOUHIQGL-BEFAXECRSA-N -1 1 327.811 4.278 20 0 EIADMM O=c1nc(CN2CCCC[C@@H]2c2ccccc2)[n-]c2ccsc21 ZINC000273872395 1043110965 /nfs/dbraw/zinc/11/09/65/1043110965.db2.gz QKAGUFAOQDEHNK-OAHLLOKOSA-N -1 1 325.437 4.124 20 0 EIADMM O=C(CCc1ccnc2ccccc12)Nc1ccc([O-])c(Cl)c1 ZINC000509169744 1043164011 /nfs/dbraw/zinc/16/40/11/1043164011.db2.gz SITYSTPUXSMCJQ-UHFFFAOYSA-N -1 1 326.783 4.165 20 0 EIADMM CCOc1cc(C(=O)N[C@@H](C)CCc2ccccc2)cc(Cl)c1[O-] ZINC000215949715 1043200334 /nfs/dbraw/zinc/20/03/34/1043200334.db2.gz ACXROJCEDKPIJE-ZDUSSCGKSA-N -1 1 347.842 4.195 20 0 EIADMM CCc1cccc2cc(CN[C@H](C(=O)[O-])[C@@H](C)c3ccccc3)oc21 ZINC000656570338 1043232850 /nfs/dbraw/zinc/23/28/50/1043232850.db2.gz XPXLWDAGBYEKES-LIRRHRJNSA-N -1 1 337.419 4.342 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc(F)cc2C(F)(F)F)c(C)c1 ZINC000442113531 1043499457 /nfs/dbraw/zinc/49/94/57/1043499457.db2.gz XFJIQXBLAMZUDX-UHFFFAOYSA-N -1 1 347.333 4.262 20 0 EIADMM Cc1ccc(F)c(C(=O)[N-]c2nnc(-c3ccsc3)s2)c1F ZINC000499633877 1043539610 /nfs/dbraw/zinc/53/96/10/1043539610.db2.gz SYTBFHFHOIFKMW-UHFFFAOYSA-N -1 1 337.376 4.106 20 0 EIADMM Cc1ccc(C)c(S(=O)(=O)[N-]c2ccc(COC(C)(C)C)cc2)c1 ZINC000674646471 1043825274 /nfs/dbraw/zinc/82/52/74/1043825274.db2.gz CTMDMMMEHRKJLE-UHFFFAOYSA-N -1 1 347.480 4.419 20 0 EIADMM CCc1cccc2c(CCNC(=O)c3c([O-])cccc3Cl)c[nH]c21 ZINC000732301427 1043895428 /nfs/dbraw/zinc/89/54/28/1043895428.db2.gz CTPIBXIEEPVTFY-UHFFFAOYSA-N -1 1 342.826 4.062 20 0 EIADMM COc1cc(-c2nc(Cc3cc(C)ccc3C)no2)cc(Cl)c1[O-] ZINC000443213772 1044085198 /nfs/dbraw/zinc/08/51/98/1044085198.db2.gz IDOSQILCCIVYTN-UHFFFAOYSA-N -1 1 344.798 4.312 20 0 EIADMM COc1cc(-c2nc(C[C@H](C)c3ccccc3)no2)cc(Cl)c1[O-] ZINC000443212052 1044085280 /nfs/dbraw/zinc/08/52/80/1044085280.db2.gz GLZLPCAFDWYAKG-NSHDSACASA-N -1 1 344.798 4.450 20 0 EIADMM CCOc1cc(-c2nc(Cc3cccc(C)c3)no2)cc(Cl)c1[O-] ZINC000443206486 1044095927 /nfs/dbraw/zinc/09/59/27/1044095927.db2.gz WULROKWYRMEMSV-UHFFFAOYSA-N -1 1 344.798 4.394 20 0 EIADMM COc1cc(-c2nc(-c3ccc(F)cc3C)no2)cc(Cl)c1[O-] ZINC000443209500 1044099648 /nfs/dbraw/zinc/09/96/48/1044099648.db2.gz GBHCVPWGKOJJHS-UHFFFAOYSA-N -1 1 334.734 4.219 20 0 EIADMM Cc1ccc(-c2cc(=NC(=O)c3sc(C(C)C)nc3C)[nH][n-]2)s1 ZINC000522168365 1044292282 /nfs/dbraw/zinc/29/22/82/1044292282.db2.gz UPZQBWZIQDOKEJ-UHFFFAOYSA-N -1 1 346.481 4.009 20 0 EIADMM Cc1ccsc1S(=O)(=O)[N-]c1cc(Cl)c(C)cc1Cl ZINC000443460531 1044318505 /nfs/dbraw/zinc/31/85/05/1044318505.db2.gz AHJDNNDQJIINHO-UHFFFAOYSA-N -1 1 336.265 4.473 20 0 EIADMM C[C@H]([N-]c1nc(-c2cc(Cl)cc(Cl)c2)no1)c1ccon1 ZINC000673442944 1044357442 /nfs/dbraw/zinc/35/74/42/1044357442.db2.gz BSPQLOMPUCBWST-ZETCQYMHSA-N -1 1 325.155 4.205 20 0 EIADMM O=C(Nc1c([O-])cccc1F)c1ccc(COc2ccccc2)cc1 ZINC000608367366 1044371050 /nfs/dbraw/zinc/37/10/50/1044371050.db2.gz XKMDQGVOPRIURM-UHFFFAOYSA-N -1 1 337.350 4.363 20 0 EIADMM C[C@H](c1cccs1)N(Cc1ccccc1)C(=O)c1ncccc1[O-] ZINC000494828853 1044408834 /nfs/dbraw/zinc/40/88/34/1044408834.db2.gz IWQAXRLUINKYAT-CQSZACIVSA-N -1 1 338.432 4.252 20 0 EIADMM C[C@H](NC(=O)c1ccc(Cl)cc1[O-])c1nc2ccccc2s1 ZINC000734112816 1044489209 /nfs/dbraw/zinc/48/92/09/1044489209.db2.gz BGUXQMCZVATRDY-VIFPVBQESA-N -1 1 332.812 4.146 20 0 EIADMM C[C@@H](Oc1ccc(F)cc1Cl)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000113460988 1044607523 /nfs/dbraw/zinc/60/75/23/1044607523.db2.gz MRGAJXLUIBUPST-MRVPVSSYSA-N -1 1 344.169 4.244 20 0 EIADMM C[C@@H](c1ccc2ccccc2c1)N(C(=O)c1ncccc1[O-])C1CC1 ZINC000495137448 1044711570 /nfs/dbraw/zinc/71/15/70/1044711570.db2.gz KJBAXBGNIPOEOI-AWEZNQCLSA-N -1 1 332.403 4.306 20 0 EIADMM CC(C)c1cc(C(=O)[N-]c2nc(Sc3ccccc3)ns2)no1 ZINC000495162435 1044737243 /nfs/dbraw/zinc/73/72/43/1044737243.db2.gz YGRCNKMGYKPXTP-UHFFFAOYSA-N -1 1 346.437 4.053 20 0 EIADMM O=C(Nc1c([O-])cccc1F)c1ccc(SC(F)(F)F)cc1 ZINC000735924535 1044879309 /nfs/dbraw/zinc/87/93/09/1044879309.db2.gz BKQIRVKXEATEBY-UHFFFAOYSA-N -1 1 331.290 4.396 20 0 EIADMM CC[C@H]([N-]C(=O)C(F)(F)c1ccc(F)cc1)c1ccc(F)cc1F ZINC000737645129 1045016415 /nfs/dbraw/zinc/01/64/15/1045016415.db2.gz LRJHKEFYEWBYJN-HNNXBMFYSA-N -1 1 343.295 4.463 20 0 EIADMM C[C@@H](CCNC(=O)c1ccc(C(F)(F)F)c([O-])c1)c1ccccc1 ZINC001626267299 1045021429 /nfs/dbraw/zinc/02/14/29/1045021429.db2.gz DKTZAOHWFUEGFS-LBPRGKRZSA-N -1 1 337.341 4.335 20 0 EIADMM Cc1ccsc1S(=O)(=O)[N-]c1cccc(C(F)F)c1Cl ZINC000543661849 1045081164 /nfs/dbraw/zinc/08/11/64/1045081164.db2.gz HDDJQPHAPXUPHX-UHFFFAOYSA-N -1 1 337.800 4.448 20 0 EIADMM C[C@H](c1noc(-c2ccc(NC(=O)OC(C)(C)C)cc2[O-])n1)C1CC1 ZINC000495438084 1045117319 /nfs/dbraw/zinc/11/73/19/1045117319.db2.gz LBXHYIGZGZHENY-JTQLQIEISA-N -1 1 345.399 4.303 20 0 EIADMM CC(C)(C)OC(=O)Nc1ccc(C(=O)NCCC2CCCC2)c([O-])c1 ZINC000740922786 1045244949 /nfs/dbraw/zinc/24/49/49/1045244949.db2.gz XJBUWSFGRPGXOD-UHFFFAOYSA-N -1 1 348.443 4.049 20 0 EIADMM CC[C@H]([N-]C(=O)C(F)(F)c1cc(F)cc(F)c1)c1ccc(F)cc1 ZINC001127373867 1045353914 /nfs/dbraw/zinc/35/39/14/1045353914.db2.gz UDBCYQBIDCDUNN-HNNXBMFYSA-N -1 1 343.295 4.463 20 0 EIADMM COc1ccc(-c2nc(-c3ccc(Cl)c(Cl)c3)no2)c([O-])c1 ZINC000316937783 1045460291 /nfs/dbraw/zinc/46/02/91/1045460291.db2.gz ZGFFQYYEQFNLQK-UHFFFAOYSA-N -1 1 337.162 4.425 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1csc(Cc2ccccc2)n1 ZINC000533540730 1045558384 /nfs/dbraw/zinc/55/83/84/1045558384.db2.gz RBIBBOAYNBARGY-UHFFFAOYSA-N -1 1 344.823 4.345 20 0 EIADMM Cc1cccc([C@@H]2CCC[N@H+]2Cc2nc(=O)c3sccc3[n-]2)c1 ZINC000055910917 1045759535 /nfs/dbraw/zinc/75/95/35/1045759535.db2.gz AFZAYKBKUJQSEX-HNNXBMFYSA-N -1 1 325.437 4.042 20 0 EIADMM Cc1cccc([C@@H]2CCCN2Cc2nc(=O)c3sccc3[n-]2)c1 ZINC000055910917 1045759551 /nfs/dbraw/zinc/75/95/51/1045759551.db2.gz AFZAYKBKUJQSEX-HNNXBMFYSA-N -1 1 325.437 4.042 20 0 EIADMM O=C(c1c([O-])cccc1Cl)N(Cc1ccco1)Cc1ccccc1 ZINC000769663558 1046043025 /nfs/dbraw/zinc/04/30/25/1046043025.db2.gz JALFWGTYPIDHOZ-UHFFFAOYSA-N -1 1 341.794 4.481 20 0 EIADMM O=C(N[C@H](c1nccs1)c1ccccc1)c1c([O-])cccc1Cl ZINC000769765517 1046060252 /nfs/dbraw/zinc/06/02/52/1046060252.db2.gz MGGZVDPKZIQVPQ-HNNXBMFYSA-N -1 1 344.823 4.022 20 0 EIADMM CCC[C@H](NCc1ccc(-c2cccc(C(F)(F)F)c2)o1)C(=O)[O-] ZINC000262714149 1046217373 /nfs/dbraw/zinc/21/73/73/1046217373.db2.gz QYUFUHDRIWZBRB-AWEZNQCLSA-N -1 1 341.329 4.308 20 0 EIADMM COc1ccc2cc(/C=C/C(=O)Nc3c([O-])cccc3F)ccc2c1 ZINC000770860420 1046275672 /nfs/dbraw/zinc/27/56/72/1046275672.db2.gz DFIDMJKQLHJDMR-UXBLZVDNSA-N -1 1 337.350 4.345 20 0 EIADMM Cc1coc(-c2cccc([N-]S(=O)(=O)c3cccc(Cl)c3)c2)n1 ZINC000126801171 1046553775 /nfs/dbraw/zinc/55/37/75/1046553775.db2.gz ZFYZAWLXANHTTA-UHFFFAOYSA-N -1 1 348.811 4.104 20 0 EIADMM Cc1coc(-c2cccc([N-]S(=O)(=O)c3ccc(Cl)cc3)c2)n1 ZINC000126819642 1046567201 /nfs/dbraw/zinc/56/72/01/1046567201.db2.gz YVARXZDAOUSNQD-UHFFFAOYSA-N -1 1 348.811 4.104 20 0 EIADMM CC[C@@](C)(NC(=O)c1cc(Cl)c([O-])c(OC)c1)c1ccccc1 ZINC000785583432 1046713262 /nfs/dbraw/zinc/71/32/62/1046713262.db2.gz LMIUGHLGXLJWNK-GOSISDBHSA-N -1 1 333.815 4.109 20 0 EIADMM C[C@H](CNC(=O)c1cc2ccccc2cc1[O-])c1nc2ccccc2o1 ZINC000746569283 1046790041 /nfs/dbraw/zinc/79/00/41/1046790041.db2.gz XWTALKSWYINHQW-CYBMUJFWSA-N -1 1 346.386 4.220 20 0 EIADMM O=C(c1ccc(Br)c([O-])c1)N1CCCC12CCCCC2 ZINC000497419143 1046802342 /nfs/dbraw/zinc/80/23/42/1046802342.db2.gz SAXJWIFZYWZQPB-UHFFFAOYSA-N -1 1 338.245 4.094 20 0 EIADMM Cc1c(=O)[n-]c(SC[C@H]2CC[C@H](C3CC3)O2)nc1-c1ccccc1 ZINC000917467629 1046911037 /nfs/dbraw/zinc/91/10/37/1046911037.db2.gz FWWOSRXHMYOTDA-HZPDHXFCSA-N -1 1 342.464 4.207 20 0 EIADMM C[C@H](NC(=O)c1c(F)ccc([O-])c1F)c1cccc(Cl)c1Cl ZINC000537233299 1047047794 /nfs/dbraw/zinc/04/77/94/1047047794.db2.gz ZRHJSXRDAJTKTA-ZETCQYMHSA-N -1 1 346.160 4.468 20 0 EIADMM Cc1nc(-c2ccccc2)c(C(=O)Nc2nc(Cl)ccc2[O-])s1 ZINC000788158087 1047126961 /nfs/dbraw/zinc/12/69/61/1047126961.db2.gz AZTQHADQDQQJNB-UHFFFAOYSA-N -1 1 345.811 4.125 20 0 EIADMM Cc1ccc(OC2CCN(C(=O)c3ccc(Cl)cc3[O-])CC2)cc1 ZINC000116654657 1047264360 /nfs/dbraw/zinc/26/43/60/1047264360.db2.gz FWYTZVDMTVJHEU-UHFFFAOYSA-N -1 1 345.826 4.038 20 0 EIADMM CC(C)Cc1nsc([N-]C(=O)c2cc(-c3ccccc3)ns2)n1 ZINC001130845251 1047412743 /nfs/dbraw/zinc/41/27/43/1047412743.db2.gz BUEUVTNHVHIIFP-UHFFFAOYSA-N -1 1 344.465 4.112 20 0 EIADMM Cc1ccc(-c2nc(C)c(C(=O)Nc3nc(Cl)ccc3[O-])s2)o1 ZINC000789930157 1047486876 /nfs/dbraw/zinc/48/68/76/1047486876.db2.gz CHBPEHZQQHPZJK-UHFFFAOYSA-N -1 1 349.799 4.026 20 0 EIADMM Cc1cc2cc([N-]S(=O)(=O)c3cc(C)c(F)c(C)c3)ccc2[nH]1 ZINC000460428392 1047806213 /nfs/dbraw/zinc/80/62/13/1047806213.db2.gz RQCHYNWTYIQTPU-UHFFFAOYSA-N -1 1 332.400 4.033 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cc(F)c(F)cc3F)n2)c(Cl)c1 ZINC000445446034 1047823385 /nfs/dbraw/zinc/82/33/85/1047823385.db2.gz KRTQDVHCEBOYSQ-UHFFFAOYSA-N -1 1 326.661 4.180 20 0 EIADMM O=C(N[C@H]1CCC[C@@H]1Cc1ccccc1)c1c([O-])cccc1Cl ZINC001136901142 1047888939 /nfs/dbraw/zinc/88/89/39/1047888939.db2.gz DPTQMMYOEDNUHV-ZBFHGGJFSA-N -1 1 329.827 4.187 20 0 EIADMM C[C@H]1c2c(F)cccc2CCN1C(=O)c1ccc2ccccc2c1[O-] ZINC001136939375 1047929597 /nfs/dbraw/zinc/92/95/97/1047929597.db2.gz XNSGXEAOMFUCIS-ZDUSSCGKSA-N -1 1 335.378 4.444 20 0 EIADMM C[C@H]1C[C@@H](c2cccc(F)c2)N(C(=O)c2c([O-])cccc2Cl)C1 ZINC001137014974 1048066889 /nfs/dbraw/zinc/06/68/89/1048066889.db2.gz RURIHXOZQNBVFM-NHYWBVRUSA-N -1 1 333.790 4.408 20 0 EIADMM COc1ccc(NCc2cccc([O-])c2Cl)c(Br)c1 ZINC000815133590 1048360270 /nfs/dbraw/zinc/36/02/70/1048360270.db2.gz NYUCJTBTHMWCFR-UHFFFAOYSA-N -1 1 342.620 4.429 20 0 EIADMM CCCC[C@H](NC(=O)c1c([O-])cccc1F)c1ccc(OC)cc1 ZINC001144144547 1048449837 /nfs/dbraw/zinc/44/98/37/1048449837.db2.gz YBXGVDIRNXNSCW-INIZCTEOSA-N -1 1 331.387 4.201 20 0 EIADMM Cc1ccc(-n2ccc(NC(=O)c3cc4ccccc4cc3[O-])n2)cc1 ZINC001144260298 1048540364 /nfs/dbraw/zinc/54/03/64/1048540364.db2.gz JVCNWNXDEGZKEF-UHFFFAOYSA-N -1 1 343.386 4.292 20 0 EIADMM O=c1cc(C(F)F)nc(SCc2ccc(Cl)nc2Cl)[n-]1 ZINC000809987475 1048589288 /nfs/dbraw/zinc/58/92/88/1048589288.db2.gz ZHIKRCPFEITMHB-UHFFFAOYSA-N -1 1 338.166 4.114 20 0 EIADMM COc1ccc([C@@H](NC(=O)c2ccc3ccccc3c2[O-])C2CC2)cc1 ZINC001135223339 1048608103 /nfs/dbraw/zinc/60/81/03/1048608103.db2.gz GLCMFPYUWJTTDL-FQEVSTJZSA-N -1 1 347.414 4.435 20 0 EIADMM CSc1nc2ccc(NC(=O)c3ccc(F)c([O-])c3)cc2s1 ZINC001135341825 1048671822 /nfs/dbraw/zinc/67/18/22/1048671822.db2.gz KQAGFOTXWJRQNH-UHFFFAOYSA-N -1 1 334.397 4.115 20 0 EIADMM C[C@@H]([N-]C(=O)C(F)(F)c1cccc(Cl)c1Cl)c1ccccn1 ZINC001135342151 1048673276 /nfs/dbraw/zinc/67/32/76/1048673276.db2.gz XEGTUDVVDLZWMT-SECBINFHSA-N -1 1 345.176 4.358 20 0 EIADMM O=C(c1ncc2ccccc2c1[O-])N1CCC(Cc2ccccc2)CC1 ZINC001135399482 1048701126 /nfs/dbraw/zinc/70/11/26/1048701126.db2.gz XYMCYOUHOCIGTA-UHFFFAOYSA-N -1 1 346.430 4.035 20 0 EIADMM O=C(Nc1ccccc1-c1nc2ccccc2[nH]1)c1cccc([O-])c1F ZINC001144634414 1048768236 /nfs/dbraw/zinc/76/82/36/1048768236.db2.gz PQMRCDRXJHASKT-UHFFFAOYSA-N -1 1 347.349 4.327 20 0 EIADMM [O-]c1cc(F)c(CN2CCn3cccc3[C@H]2c2ccccc2)cc1F ZINC001144646650 1048769177 /nfs/dbraw/zinc/76/91/77/1048769177.db2.gz FQXHGRMSDQZSTO-HXUWFJFHSA-N -1 1 340.373 4.077 20 0 EIADMM CN(Cc1cccc(OC(F)(F)F)c1)Cc1cc(F)c([O-])cc1F ZINC001144664070 1048780993 /nfs/dbraw/zinc/78/09/93/1048780993.db2.gz TYUIGKBBIAUZBJ-UHFFFAOYSA-N -1 1 347.283 4.201 20 0 EIADMM CCN(Cc1cc(F)c([O-])cc1F)Cc1c(F)cccc1Cl ZINC001144659725 1048795330 /nfs/dbraw/zinc/79/53/30/1048795330.db2.gz PXQGTOJDQWBXBK-UHFFFAOYSA-N -1 1 329.749 4.485 20 0 EIADMM C[C@H]([N-]C(=O)C(F)(F)c1ccc(F)cc1)c1ccc(F)c(F)c1 ZINC000920840658 1048800879 /nfs/dbraw/zinc/80/08/79/1048800879.db2.gz JPTAQQZFUKFUAN-VIFPVBQESA-N -1 1 329.268 4.073 20 0 EIADMM Cc1ccc2cccc([N-]S(=O)(=O)/C=C\c3ccc(F)cc3)c2n1 ZINC000747612821 1048827123 /nfs/dbraw/zinc/82/71/23/1048827123.db2.gz XVXWUOIIZWZCIU-QXMHVHEDSA-N -1 1 342.395 4.095 20 0 EIADMM C[C@H]1CC/C(=C/C(=O)Nc2c([O-])cc(Br)cc2Cl)C1 ZINC000816590697 1048832817 /nfs/dbraw/zinc/83/28/17/1048832817.db2.gz JDCFAUGSPVCZQL-HXOPTJOXSA-N -1 1 344.636 4.493 20 0 EIADMM O=c1cc(CN2CC[C@@H]2c2ccc(Cl)cc2)c2ccc([O-])cc2o1 ZINC000747620076 1048832845 /nfs/dbraw/zinc/83/28/45/1048832845.db2.gz VADQEKQDRSAWSM-QGZVFWFLSA-N -1 1 341.794 4.099 20 0 EIADMM C/C(=C\CN1Cc2cc(Cl)ccc2C[C@@H]1c1ccccc1)C(=O)[O-] ZINC000846254028 1048850370 /nfs/dbraw/zinc/85/03/70/1048850370.db2.gz BEQCFVCGGJYJQC-CECLQJIQSA-N -1 1 341.838 4.470 20 0 EIADMM C[C@H]1CCc2nc(NC(=O)c3ccc4ccccc4c3[O-])sc2C1 ZINC001135684468 1048856819 /nfs/dbraw/zinc/85/68/19/1048856819.db2.gz ZUGZGRVOCXPRLK-NSHDSACASA-N -1 1 338.432 4.379 20 0 EIADMM O=C(N[C@@H]1CC[C@H]2CCCC[C@@H]2C1)c1c([O-])cnc2c(F)cccc21 ZINC001135794396 1048887812 /nfs/dbraw/zinc/88/78/12/1048887812.db2.gz KAJNRMMEVFXELL-MGPQQGTHSA-N -1 1 342.414 4.168 20 0 EIADMM CCCN(CCc1cccc(F)c1)C(=O)c1ccc(Cl)cc1[O-] ZINC001145062981 1048987521 /nfs/dbraw/zinc/98/75/21/1048987521.db2.gz DLVNQJAAKOSGOT-UHFFFAOYSA-N -1 1 335.806 4.280 20 0 EIADMM Cc1cc(NC(=O)c2ccc(Nc3ccncc3)cc2)ccc1C(=O)[O-] ZINC000237834967 1048991867 /nfs/dbraw/zinc/99/18/67/1048991867.db2.gz HCRXQEMFPZOXQY-UHFFFAOYSA-N -1 1 347.374 4.084 20 0 EIADMM COc1cc(C)c(C)cc1NC(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC001147064727 1049085036 /nfs/dbraw/zinc/08/50/36/1049085036.db2.gz JHTRZPKWEFLNOG-UHFFFAOYSA-N -1 1 339.313 4.289 20 0 EIADMM CCO[C@H]1C[C@H](NC(=O)c2cc3ccccc3cc2[O-])C1(CC)CC ZINC001148354793 1049303379 /nfs/dbraw/zinc/30/33/79/1049303379.db2.gz JQPBETNWPCGGES-OALUTQOASA-N -1 1 341.451 4.259 20 0 EIADMM O=C(Nc1ccc(OC(F)(F)F)cc1Cl)c1cccc([O-])c1F ZINC001148369315 1049305497 /nfs/dbraw/zinc/30/54/97/1049305497.db2.gz ZXJHAQNXAWCPPZ-UHFFFAOYSA-N -1 1 349.667 4.336 20 0 EIADMM COc1cc(NC(=O)c2cccc(-c3ccccc3)c2[O-])c(C)cn1 ZINC001148867270 1049390716 /nfs/dbraw/zinc/39/07/16/1049390716.db2.gz NTROQHPMNXFFBW-UHFFFAOYSA-N -1 1 334.375 4.024 20 0 EIADMM Cc1cc2c(cn1)[C@@H](NC(=O)c1cccc(-c3ccccc3)c1[O-])CC2 ZINC001148872943 1049393169 /nfs/dbraw/zinc/39/31/69/1049393169.db2.gz METPSKCAERTKCS-FQEVSTJZSA-N -1 1 344.414 4.180 20 0 EIADMM COc1cccc([O-])c1C(=O)Nc1cccc(COc2ccccc2)c1 ZINC001136350049 1049521656 /nfs/dbraw/zinc/52/16/56/1049521656.db2.gz WKKHUKYVIHQVEY-UHFFFAOYSA-N -1 1 349.386 4.232 20 0 EIADMM COc1cccc([O-])c1C(=O)Nc1ccc2nc(C(C)C)sc2c1 ZINC001136467595 1049657155 /nfs/dbraw/zinc/65/71/55/1049657155.db2.gz HCSSZUVNPPYRGT-UHFFFAOYSA-N -1 1 342.420 4.386 20 0 EIADMM O=C(N[C@@H]1CCSc2ccc(Cl)cc21)c1cc(F)ccc1[O-] ZINC001136483794 1049677911 /nfs/dbraw/zinc/67/79/11/1049677911.db2.gz BYWKMTWSNHNQQT-CYBMUJFWSA-N -1 1 337.803 4.152 20 0 EIADMM CSc1ccc([O-])c(C(=O)Nc2ccc(OC3CCCC3)nc2)c1 ZINC001136548230 1049736939 /nfs/dbraw/zinc/73/69/39/1049736939.db2.gz BMVJAAYYGZGRFM-UHFFFAOYSA-N -1 1 344.436 4.083 20 0 EIADMM O=C(NCc1ccc(OC2CCCCC2)cc1)c1ccc([O-])cc1F ZINC001136551796 1049739813 /nfs/dbraw/zinc/73/98/13/1049739813.db2.gz RIVLHJJUTAFCDQ-UHFFFAOYSA-N -1 1 343.398 4.173 20 0 EIADMM O=C(/C=C/c1csc(C(F)(F)F)c1)Nc1cccc(F)c1[O-] ZINC001171637119 1049779416 /nfs/dbraw/zinc/77/94/16/1049779416.db2.gz KMMUGJXOLQBNIR-SNAWJCMRSA-N -1 1 331.290 4.264 20 0 EIADMM O=C(NCC1(c2cccc(Cl)c2)CCC1)c1cccc([O-])c1F ZINC001171824172 1049802467 /nfs/dbraw/zinc/80/24/67/1049802467.db2.gz VJBLJOWSLNESRX-UHFFFAOYSA-N -1 1 333.790 4.036 20 0 EIADMM O=c1cc(CN2CCC(C3CCC3)CC2)c2cc(Cl)c([O-])cc2o1 ZINC001171840122 1049811926 /nfs/dbraw/zinc/81/19/26/1049811926.db2.gz AWBUCLQOBCMUGW-UHFFFAOYSA-N -1 1 347.842 4.164 20 0 EIADMM CC[C@H](NC(=O)c1cc(C)cc(C=O)c1[O-])c1ccc(Cl)s1 ZINC001136806691 1049893792 /nfs/dbraw/zinc/89/37/92/1049893792.db2.gz WRHIPJHWLZNJCO-LBPRGKRZSA-N -1 1 337.828 4.109 20 0 EIADMM O=S(=O)([N-][C@H](C1CCC1)C1CCCC1)c1cc2ccccc2o1 ZINC001212284345 1049901822 /nfs/dbraw/zinc/90/18/22/1049901822.db2.gz WSJAHXOFJJCLDZ-SFHVURJKSA-N -1 1 333.453 4.070 20 0 EIADMM CC(C)Oc1cc(F)ccc1Nc1ccc(-n2ccc(=O)[n-]2)cc1 ZINC001212297952 1049993378 /nfs/dbraw/zinc/99/33/78/1049993378.db2.gz KXCOJEYCPAZNHG-UHFFFAOYSA-N -1 1 327.359 4.248 20 0 EIADMM CCCCn1ncc([N-]c2nn3cc(C4CCCC4)nc3s2)c1C ZINC001185866231 1050181055 /nfs/dbraw/zinc/18/10/55/1050181055.db2.gz REJKZPNAMQFCRR-UHFFFAOYSA-N -1 1 344.488 4.497 20 0 EIADMM Cc1cnc(Nc2c(F)ccc([O-])c2Cl)c(Br)c1 ZINC001250227988 1050229438 /nfs/dbraw/zinc/22/94/38/1050229438.db2.gz GEPMNJFZLGTKJP-UHFFFAOYSA-N -1 1 331.572 4.394 20 0 EIADMM O=C(Nc1cccc2c(Br)c[nH]c21)c1ccc([O-])c(F)c1 ZINC001186237733 1050265530 /nfs/dbraw/zinc/26/55/30/1050265530.db2.gz XVMHFTNPGKBJJY-UHFFFAOYSA-N -1 1 349.159 4.027 20 0 EIADMM O=C(Nc1ccn2cc(-c3ccccc3)nc2c1)c1ccc([O-])cc1F ZINC001186318684 1050284042 /nfs/dbraw/zinc/28/40/42/1050284042.db2.gz PNYQIZGAKFADHI-UHFFFAOYSA-N -1 1 347.349 4.098 20 0 EIADMM CCc1cc(Br)cc(NC(=O)c2ccc([O-])cc2F)c1 ZINC001186328801 1050287278 /nfs/dbraw/zinc/28/72/78/1050287278.db2.gz KEOREYOQLWGVON-UHFFFAOYSA-N -1 1 338.176 4.109 20 0 EIADMM Cc1cnc([N-]S(=O)(=O)c2csc3ccccc32)c(Cl)c1 ZINC001186455722 1050321467 /nfs/dbraw/zinc/32/14/67/1050321467.db2.gz ZTJYRTXCTJYLDB-UHFFFAOYSA-N -1 1 338.841 4.059 20 0 EIADMM CN1CCN(c2cccc(Nc3cc(Cl)ccc3[S-])c2)CC1 ZINC001212713928 1050354686 /nfs/dbraw/zinc/35/46/86/1050354686.db2.gz UWLWDJJZKAGFNR-UHFFFAOYSA-N -1 1 333.888 4.124 20 0 EIADMM CC(C)c1ccnc(CC(=O)Nc2cccc(C(F)(F)F)c2[O-])c1 ZINC001178226325 1050417995 /nfs/dbraw/zinc/41/79/95/1050417995.db2.gz WZKDWWDVFDWBSD-UHFFFAOYSA-N -1 1 338.329 4.111 20 0 EIADMM [O-]c1cnccc1-c1nc(-c2cc(Cl)cc(C(F)(F)F)c2)no1 ZINC001212721415 1050431522 /nfs/dbraw/zinc/43/15/22/1050431522.db2.gz PLKMTAYMWZNPBE-UHFFFAOYSA-N -1 1 341.676 4.176 20 0 EIADMM Cc1cc(C(=O)N(C)C)ccc1Nc1cc(Cl)cc(Cl)c1[O-] ZINC001212731623 1050469038 /nfs/dbraw/zinc/46/90/38/1050469038.db2.gz SXQZEPOROZQAGF-UHFFFAOYSA-N -1 1 339.222 4.453 20 0 EIADMM Cc1oncc1S(=O)(=O)[N-]c1ccc(-c2ccccc2)cc1Cl ZINC001187383300 1050539522 /nfs/dbraw/zinc/53/95/22/1050539522.db2.gz PSHKKNYUJLLBAC-UHFFFAOYSA-N -1 1 348.811 4.104 20 0 EIADMM Cc1csc([N-]S(=O)(=O)CCc2cccc3ccccc32)c1 ZINC001187615691 1050580995 /nfs/dbraw/zinc/58/09/95/1050580995.db2.gz AKPXBZBDPKHRLZ-UHFFFAOYSA-N -1 1 331.462 4.194 20 0 EIADMM [O-]c1c(Br)cc(Nc2cccnc2)cc1Br ZINC001173855438 1050588488 /nfs/dbraw/zinc/58/84/88/1050588488.db2.gz DCDPJGZKXAHFHX-UHFFFAOYSA-N -1 1 344.006 4.056 20 0 EIADMM [O-]c1c(Br)cc(Nc2ccoc2)cc1Br ZINC001173934306 1050655092 /nfs/dbraw/zinc/65/50/92/1050655092.db2.gz AINODAITUIZYBK-UHFFFAOYSA-N -1 1 332.979 4.254 20 0 EIADMM O=C(N[C@H]1CCC[C@@H](c2ccccc2)CC1)c1cc(F)ccc1[O-] ZINC001179337234 1050679646 /nfs/dbraw/zinc/67/96/46/1050679646.db2.gz ZEJZNHYUGVBTCV-WBVHZDCISA-N -1 1 327.399 4.378 20 0 EIADMM CCc1c(Cl)cc(Nc2ccccc2C(N)=O)c([O-])c1Cl ZINC001173981693 1050688904 /nfs/dbraw/zinc/68/89/04/1050688904.db2.gz OXCJSYARAHRDML-UHFFFAOYSA-N -1 1 325.195 4.104 20 0 EIADMM CCCC1(C[N-]S(=O)(=O)c2sc3ccccc3c2Cl)CC1 ZINC001188126845 1050705368 /nfs/dbraw/zinc/70/53/68/1050705368.db2.gz XVSXMJZZYSJNFX-UHFFFAOYSA-N -1 1 343.901 4.413 20 0 EIADMM COc1ccc2cc(Nc3cc4ccc([O-])cc4oc3=O)ccc2c1 ZINC001174031236 1050713716 /nfs/dbraw/zinc/71/37/16/1050713716.db2.gz YCRGKHLNRCVHAL-UHFFFAOYSA-N -1 1 333.343 4.404 20 0 EIADMM COc1cc(F)c(C(=O)Nc2cc(F)c([O-])cc2Cl)c(Cl)c1 ZINC001179659546 1050739857 /nfs/dbraw/zinc/73/98/57/1050739857.db2.gz BFBGSLHGZZEGKV-UHFFFAOYSA-N -1 1 348.132 4.238 20 0 EIADMM O=C(c1cccc(Nc2c([O-])cc(F)cc2F)c1)N1CCCCC1 ZINC001174173962 1050815459 /nfs/dbraw/zinc/81/54/59/1050815459.db2.gz RQZXRRKNTAJHTQ-UHFFFAOYSA-N -1 1 332.350 4.040 20 0 EIADMM CCS[C@@H]1CCC[C@@H](NC(=O)c2ccc(C(F)(F)F)c([O-])c2)C1 ZINC000619582471 1050824979 /nfs/dbraw/zinc/82/49/79/1050824979.db2.gz ILUINLMNCZJKSQ-VXGBXAGGSA-N -1 1 347.402 4.205 20 0 EIADMM O=C(Cc1cc(F)c(F)c(F)c1)Nc1cccc(C(F)(F)F)c1[O-] ZINC001179958472 1050848582 /nfs/dbraw/zinc/84/85/82/1050848582.db2.gz ZSSMOOXEDPUXAT-UHFFFAOYSA-N -1 1 349.230 4.010 20 0 EIADMM Cc1cccnc1[C@H](NC(=O)c1ccc(Cl)cc1[O-])C(C)(C)C ZINC001180183661 1050894375 /nfs/dbraw/zinc/89/43/75/1050894375.db2.gz FPLMRIMZRVELJF-INIZCTEOSA-N -1 1 332.831 4.266 20 0 EIADMM CCOc1ccc(CCN(C)C(=O)c2cc3ccccc3cc2[O-])cc1 ZINC001180239488 1050930465 /nfs/dbraw/zinc/93/04/65/1050930465.db2.gz SVVGZIDOIQYNEI-UHFFFAOYSA-N -1 1 349.430 4.259 20 0 EIADMM Cc1cc(NCc2ccc([O-])c(F)c2F)cnc1N1CCCC[C@@H]1C ZINC001180301644 1050945287 /nfs/dbraw/zinc/94/52/87/1050945287.db2.gz OKPFDFZLBZVRQM-ZDUSSCGKSA-N -1 1 347.409 4.365 20 0 EIADMM O=S(=O)(Cc1cc(F)ccc1F)[N-]c1cccc2sccc21 ZINC001189689558 1051038182 /nfs/dbraw/zinc/03/81/82/1051038182.db2.gz BXQYPBZKCWMBDO-UHFFFAOYSA-N -1 1 339.388 4.121 20 0 EIADMM O=C(NCc1ccc(Cl)cc1Cl)Nc1cc(F)c([O-])c(F)c1 ZINC001190093366 1051112854 /nfs/dbraw/zinc/11/28/54/1051112854.db2.gz MMFXGSWUWGTQCT-UHFFFAOYSA-N -1 1 347.148 4.299 20 0 EIADMM CCc1c(C)cc(Nc2cc(S(=O)(=O)CC)ccc2[O-])cc1C ZINC001174678559 1051117031 /nfs/dbraw/zinc/11/70/31/1051117031.db2.gz AIORBMBEXNRMFP-UHFFFAOYSA-N -1 1 333.453 4.109 20 0 EIADMM CCc1onc(C)c1CSc1nc(-c2ccccc2)cc(=O)[n-]1 ZINC001190201547 1051136975 /nfs/dbraw/zinc/13/69/75/1051136975.db2.gz SYRHVIIUJXKBLZ-UHFFFAOYSA-N -1 1 327.409 4.000 20 0 EIADMM Cc1noc(-c2ccccc2)c1NC(=O)Nc1ccc(F)cc1[O-] ZINC001190365541 1051169979 /nfs/dbraw/zinc/16/99/79/1051169979.db2.gz YBAARVVHKVXWRV-UHFFFAOYSA-N -1 1 327.315 4.139 20 0 EIADMM Cc1noc(-c2ccccc2)c1NC(=O)Nc1cc(F)cc(F)c1[O-] ZINC001190374765 1051172719 /nfs/dbraw/zinc/17/27/19/1051172719.db2.gz QUFSJKZUORBTJH-UHFFFAOYSA-N -1 1 345.305 4.278 20 0 EIADMM Cc1ccc2cc([N-]S(=O)(=O)c3ccc(C4CC4)cc3)ccc2n1 ZINC001190500994 1051195964 /nfs/dbraw/zinc/19/59/64/1051195964.db2.gz UERTUYWWSWPRJN-UHFFFAOYSA-N -1 1 338.432 4.221 20 0 EIADMM O=S(=O)([N-]c1ccc(-c2cnco2)cc1)c1ccc(C2CC2)cc1 ZINC001190500390 1051196075 /nfs/dbraw/zinc/19/60/75/1051196075.db2.gz MJYHNYSGFUEXCY-UHFFFAOYSA-N -1 1 340.404 4.020 20 0 EIADMM CC(C)Oc1cccc(F)c1[N-]S(=O)(=O)c1ccc(C2CC2)cc1 ZINC001190512354 1051200533 /nfs/dbraw/zinc/20/05/33/1051200533.db2.gz NRPQGKGDSWQNPH-UHFFFAOYSA-N -1 1 349.427 4.291 20 0 EIADMM CCc1nc2cc(NC(=O)c3cc(Cl)c([O-])c(OC)c3)ccc2o1 ZINC000153617143 1051203908 /nfs/dbraw/zinc/20/39/08/1051203908.db2.gz CYRGPTVHODPGBM-UHFFFAOYSA-N -1 1 346.770 4.010 20 0 EIADMM [O-]c1c(Br)c(F)ccc1Nc1ccc(F)c(F)c1F ZINC001174971152 1051256230 /nfs/dbraw/zinc/25/62/30/1051256230.db2.gz AQYYQPRZWJWUNT-UHFFFAOYSA-N -1 1 336.082 4.455 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N(Cc1ccco1)Cc1ccco1 ZINC000154141625 1051272325 /nfs/dbraw/zinc/27/23/25/1051272325.db2.gz ADNBJMXISKRZKY-UHFFFAOYSA-N -1 1 331.755 4.074 20 0 EIADMM COc1cc(F)cc(Nc2ccc(F)c(Br)c2[O-])c1 ZINC001175010719 1051294878 /nfs/dbraw/zinc/29/48/78/1051294878.db2.gz OKRUDLUVBWAWEO-UHFFFAOYSA-N -1 1 330.128 4.185 20 0 EIADMM COc1ccc(Br)nc1Nc1cc(Cl)c([O-])cc1F ZINC001250020471 1051295562 /nfs/dbraw/zinc/29/55/62/1051295562.db2.gz VYWVJZXLMKREHT-UHFFFAOYSA-N -1 1 347.571 4.094 20 0 EIADMM Cc1cc(-n2[n-]c(=O)c3ccc(N)cc32)ccc1OCc1ccccc1 ZINC001175036139 1051328406 /nfs/dbraw/zinc/32/84/06/1051328406.db2.gz VSOTWXHRCBXLMS-UHFFFAOYSA-N -1 1 345.402 4.201 20 0 EIADMM COc1cc(C(=O)Nc2ccc3c(C)ccnc3c2)cc(Cl)c1[O-] ZINC001191148012 1051364237 /nfs/dbraw/zinc/36/42/37/1051364237.db2.gz GIWDWSMCTJGGFJ-UHFFFAOYSA-N -1 1 342.782 4.163 20 0 EIADMM COc1cc(C(=O)N[C@H]2C[C@H](C)c3ccccc32)cc(Cl)c1[O-] ZINC001191156416 1051366041 /nfs/dbraw/zinc/36/60/41/1051366041.db2.gz YMMWSEXVLICRFD-BONVTDFDSA-N -1 1 331.799 4.033 20 0 EIADMM O=C(NCCC1=CCCCC1)c1ccccc1C(=O)c1ccc([O-])cc1 ZINC001191509999 1051472911 /nfs/dbraw/zinc/47/29/11/1051472911.db2.gz MUSMALAZLGDEQC-UHFFFAOYSA-N -1 1 349.430 4.244 20 0 EIADMM COc1ccc(C(C)=O)c(Nc2c(F)ccc([O-])c2F)c1Cl ZINC001175268173 1051503904 /nfs/dbraw/zinc/50/39/04/1051503904.db2.gz MHXBBZSLGQCHPA-UHFFFAOYSA-N -1 1 327.714 4.279 20 0 EIADMM Cc1ccc(-c2ccc(S(=O)(=O)[N-]c3cccc(O)c3)cc2)cc1 ZINC001192065476 1051630309 /nfs/dbraw/zinc/63/03/09/1051630309.db2.gz OQFSSXPDSJMNTH-UHFFFAOYSA-N -1 1 339.416 4.168 20 0 EIADMM CC(C)c1cccc(S(=O)(=O)[N-]c2ccc(-c3ncco3)cc2)c1 ZINC000157759106 1051671619 /nfs/dbraw/zinc/67/16/19/1051671619.db2.gz ALBAYTUKYPDHJP-UHFFFAOYSA-N -1 1 342.420 4.266 20 0 EIADMM O=C(Nc1cccc(C(F)(F)F)c1[O-])C(F)(F)c1ccc(F)cc1 ZINC001182890198 1051732174 /nfs/dbraw/zinc/73/21/74/1051732174.db2.gz JEWWPOLIIITFNX-UHFFFAOYSA-N -1 1 349.230 4.281 20 0 EIADMM O=C(N[C@H](c1ccccc1)C1CCCC1)c1c(F)ccc([O-])c1F ZINC001192551263 1051755558 /nfs/dbraw/zinc/75/55/58/1051755558.db2.gz DJXKHUHGCROXEC-GOSISDBHSA-N -1 1 331.362 4.332 20 0 EIADMM Cc1nc2cc(NC(=O)c3cc([O-])cc(F)c3F)c(C)cc2s1 ZINC001192670388 1051786820 /nfs/dbraw/zinc/78/68/20/1051786820.db2.gz IUZOKECPPQAMQO-UHFFFAOYSA-N -1 1 334.347 4.149 20 0 EIADMM O=C(NC1(c2cccc3ccccc32)CC1)c1cc([O-])cc(F)c1F ZINC001192684694 1051793421 /nfs/dbraw/zinc/79/34/21/1051793421.db2.gz TXPZFGFZORPHEG-UHFFFAOYSA-N -1 1 339.341 4.243 20 0 EIADMM Cc1cc(NC(=O)c2cc([O-])cc(F)c2F)cc(C(F)(F)F)c1 ZINC001192665718 1051797045 /nfs/dbraw/zinc/79/70/45/1051797045.db2.gz UWEXTPCIDXVXMC-UHFFFAOYSA-N -1 1 331.240 4.250 20 0 EIADMM CC(C)Nc1cccc(F)c1[N-]S(=O)(=O)c1ccccc1Cl ZINC000158865728 1051797044 /nfs/dbraw/zinc/79/70/44/1051797044.db2.gz ICNHMFOIEWENRT-UHFFFAOYSA-N -1 1 342.823 4.100 20 0 EIADMM O=C(CCCc1ccc2c(c1)CCCC2)Nc1nc(Cl)ccc1[O-] ZINC001183217396 1051805747 /nfs/dbraw/zinc/80/57/47/1051805747.db2.gz CLWZRRMQSPZUDJ-UHFFFAOYSA-N -1 1 344.842 4.281 20 0 EIADMM CCCC[C@@H](C(=O)N1CCC(C(=O)c2ccc([O-])cc2)CC1)C(C)C ZINC000621375151 1051842499 /nfs/dbraw/zinc/84/24/99/1051842499.db2.gz PVMXOACLLRHCMF-LJQANCHMSA-N -1 1 345.483 4.276 20 0 EIADMM Cc1c(Cl)cc(NC(=O)c2ccc(F)c(O)c2F)c([O-])c1Cl ZINC001193789120 1051988830 /nfs/dbraw/zinc/98/88/30/1051988830.db2.gz JCKWYLLDUJMIMN-UHFFFAOYSA-N -1 1 348.132 4.244 20 0 EIADMM O=C(OCc1ccccc1Oc1cccnc1)c1ccc([O-])cc1F ZINC000773567289 1052007638 /nfs/dbraw/zinc/00/76/38/1052007638.db2.gz JEVWXAYMBWDDHU-UHFFFAOYSA-N -1 1 339.322 4.076 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc3cnoc3c2)c2ccccc12 ZINC001193863280 1052018731 /nfs/dbraw/zinc/01/87/31/1052018731.db2.gz JRHZUOAKTYYEMO-UHFFFAOYSA-N -1 1 338.388 4.090 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccccc2[C@@H](C)O)c2ccccc12 ZINC001193864385 1052019915 /nfs/dbraw/zinc/01/99/15/1052019915.db2.gz YNDRSWIAOYGSPA-CQSZACIVSA-N -1 1 341.432 4.002 20 0 EIADMM Cc1cnc([N-]S(=O)(=O)c2ccc(-c3cccs3)cc2)c(F)c1 ZINC001194145305 1052085431 /nfs/dbraw/zinc/08/54/31/1052085431.db2.gz FJPJMNIGUQVVNU-UHFFFAOYSA-N -1 1 348.424 4.058 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2ccc3c(Cl)cccc3c2)cc1O ZINC001194243433 1052115014 /nfs/dbraw/zinc/11/50/14/1052115014.db2.gz RNCDQZJCQHDOLA-UHFFFAOYSA-N -1 1 347.823 4.308 20 0 EIADMM COc1ccc([N-]S(=O)(=O)c2cccc3c(Cl)cccc32)cc1 ZINC001194404504 1052141388 /nfs/dbraw/zinc/14/13/88/1052141388.db2.gz RLBLPOWXRBKWCQ-UHFFFAOYSA-N -1 1 347.823 4.303 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2cccc3c(Cl)nccc32)c(C)c1 ZINC001194454954 1052149059 /nfs/dbraw/zinc/14/90/59/1052149059.db2.gz KDCYPDDEURNMBJ-UHFFFAOYSA-N -1 1 346.839 4.306 20 0 EIADMM COC(=O)c1cc(Cl)cc(Nc2c(F)cc(F)c([O-])c2F)c1C ZINC001176674273 1052161889 /nfs/dbraw/zinc/16/18/89/1052161889.db2.gz TYSWWJRPWWRQJN-UHFFFAOYSA-N -1 1 345.704 4.302 20 0 EIADMM Cc1cccc(C)c1S(=O)(=O)[N-]c1ccnc2cc(Cl)ccc12 ZINC001194609615 1052169673 /nfs/dbraw/zinc/16/96/73/1052169673.db2.gz AUSYLJMXTWDFGU-UHFFFAOYSA-N -1 1 346.839 4.306 20 0 EIADMM Cc1cccc(C)c1S(=O)(=O)[N-]c1cnc2ccc(Cl)cc2c1 ZINC001194610149 1052169748 /nfs/dbraw/zinc/16/97/48/1052169748.db2.gz ZLDXNIQVFGZRIT-UHFFFAOYSA-N -1 1 346.839 4.306 20 0 EIADMM O=C([N-]c1cc(-c2ccc(Cl)s2)on1)c1cnc(C2CC2)o1 ZINC001185196611 1052200551 /nfs/dbraw/zinc/20/05/51/1052200551.db2.gz INLREAWTMBSWOT-UHFFFAOYSA-N -1 1 335.772 4.174 20 0 EIADMM O=C(Nc1cccc(C(F)(F)F)c1[O-])c1ncccc1C1CCC1 ZINC001185284858 1052211697 /nfs/dbraw/zinc/21/16/97/1052211697.db2.gz FPFHHSHTPBTEOE-UHFFFAOYSA-N -1 1 336.313 4.326 20 0 EIADMM CC(C)(C)c1ccc(CC(=O)NCc2ccc([O-])c(Cl)c2)cc1 ZINC001176993962 1052215453 /nfs/dbraw/zinc/21/54/53/1052215453.db2.gz KTACEUKAMSCCDO-UHFFFAOYSA-N -1 1 331.843 4.202 20 0 EIADMM Cc1ccc2cc([N-]S(=O)(=O)c3ccc(Cl)c(C)c3)ccc2n1 ZINC001185524230 1052256358 /nfs/dbraw/zinc/25/63/58/1052256358.db2.gz FDUOUWIQUHOPLC-UHFFFAOYSA-N -1 1 346.839 4.306 20 0 EIADMM CC(C)(C)C1CCC(CNC(=O)c2c(F)ccc([O-])c2F)CC1 ZINC000622445274 1052279072 /nfs/dbraw/zinc/27/90/72/1052279072.db2.gz MIKKLDQAZMZLOF-UHFFFAOYSA-N -1 1 325.399 4.253 20 0 EIADMM CC(C)c1ccc(C(=O)Nc2nc(CC(F)(F)F)cs2)c([O-])c1 ZINC000622624129 1052355706 /nfs/dbraw/zinc/35/57/06/1052355706.db2.gz XGTBVCUNDXIKQM-UHFFFAOYSA-N -1 1 344.358 4.329 20 0 EIADMM C[C@H](NCc1cc(=O)oc2cc([O-])c(Cl)cc12)c1ccsc1 ZINC000794582348 1053197855 /nfs/dbraw/zinc/19/78/55/1053197855.db2.gz MPIVSBUBLFZZBC-VIFPVBQESA-N -1 1 335.812 4.064 20 0 EIADMM CC(C)c1cccc(S(=O)(=O)[N-]c2ccnc(C(F)(F)F)c2)c1 ZINC001195116611 1053280147 /nfs/dbraw/zinc/28/01/47/1053280147.db2.gz QBWVPOBTWMPKQN-UHFFFAOYSA-N -1 1 344.358 4.025 20 0 EIADMM CC(C)c1cccc(S(=O)(=O)[N-]c2ccc3ccc(O)cc3c2)c1 ZINC001195156073 1053308775 /nfs/dbraw/zinc/30/87/75/1053308775.db2.gz GCMVEMNDRKFQPJ-UHFFFAOYSA-N -1 1 341.432 4.470 20 0 EIADMM CC(C)c1cccc(S(=O)(=O)[N-]c2cccc3ccc(O)cc32)c1 ZINC001195156801 1053310472 /nfs/dbraw/zinc/31/04/72/1053310472.db2.gz QVAOOWVYKZEAKW-UHFFFAOYSA-N -1 1 341.432 4.470 20 0 EIADMM COc1ccccc1OC(=O)Nc1cccc(C(F)(F)F)c1[O-] ZINC001195271849 1053355242 /nfs/dbraw/zinc/35/52/42/1053355242.db2.gz HTCKUDJVYDINOB-UHFFFAOYSA-N -1 1 327.258 4.031 20 0 EIADMM C[C@@H]1CC(C)(C)c2cccc(NC(=O)c3cc([O-])cnc3Cl)c21 ZINC001195306615 1053369790 /nfs/dbraw/zinc/36/97/90/1053369790.db2.gz VIARFKXIUDIYQF-SNVBAGLBSA-N -1 1 330.815 4.478 20 0 EIADMM CCOC(=O)NC(=S)[N-]c1ccc(C(C)C)cc1Br ZINC001195485120 1053419455 /nfs/dbraw/zinc/41/94/55/1053419455.db2.gz YINRIANHRYMFBE-UHFFFAOYSA-N -1 1 345.262 4.015 20 0 EIADMM CCOC(=O)NC(=S)[N-]c1ccc(Oc2ccc(F)cc2)cc1 ZINC001195484317 1053420269 /nfs/dbraw/zinc/42/02/69/1053420269.db2.gz LGLUQKNURYWYEZ-UHFFFAOYSA-N -1 1 334.372 4.061 20 0 EIADMM CCOC(=O)NC(=S)[N-]c1cccc(Oc2ccc(C)cc2)c1 ZINC001195492965 1053422701 /nfs/dbraw/zinc/42/27/01/1053422701.db2.gz SUFICZXCGMDWJL-UHFFFAOYSA-N -1 1 330.409 4.230 20 0 EIADMM [O-]c1cc(Cl)c(Cl)cc1NC(=S)NCc1ccc(F)cc1 ZINC001196489447 1053682106 /nfs/dbraw/zinc/68/21/06/1053682106.db2.gz HZBXIKLFKQXILF-UHFFFAOYSA-N -1 1 345.226 4.325 20 0 EIADMM O=C(Nc1c([O-])cc(Br)cc1Cl)[C@@H]1CCC[C@@H]2C[C@@H]21 ZINC000854432419 1053814438 /nfs/dbraw/zinc/81/44/38/1053814438.db2.gz OFTJRYZXZSBJSF-QNSHHTMESA-N -1 1 344.636 4.183 20 0 EIADMM O=C(Nc1cc(F)c([O-])cc1Cl)[C@@H]1CCCC[C@@H]1C(F)(F)F ZINC000885680367 1053816013 /nfs/dbraw/zinc/81/60/13/1053816013.db2.gz PSJFQYUQEUIFGR-SFYZADRCSA-N -1 1 339.716 4.492 20 0 EIADMM CCOc1ccc(C)c(C(=O)Nc2cccc(C(F)(F)F)c2[O-])c1 ZINC001197144756 1053837511 /nfs/dbraw/zinc/83/75/11/1053837511.db2.gz LZBOBFNGENIQEQ-UHFFFAOYSA-N -1 1 339.313 4.370 20 0 EIADMM [O-]c1cc(F)c(NC(=S)Nc2cccc(C(F)(F)F)c2)cc1F ZINC001198059652 1054054683 /nfs/dbraw/zinc/05/46/83/1054054683.db2.gz MMACXLXMOORLRB-UHFFFAOYSA-N -1 1 348.296 4.498 20 0 EIADMM O=S(=O)([N-]c1ccc(F)c(Cl)c1)c1ccc2occc2c1 ZINC001198854474 1054278175 /nfs/dbraw/zinc/27/81/75/1054278175.db2.gz COUUQWIDNTWWCX-UHFFFAOYSA-N -1 1 325.748 4.026 20 0 EIADMM CC(C)(C)Oc1cccc([N-]S(=O)(=O)c2ccc3occc3c2)c1 ZINC001198870723 1054297473 /nfs/dbraw/zinc/29/74/73/1054297473.db2.gz SBLKCCMSAUQALJ-UHFFFAOYSA-N -1 1 345.420 4.411 20 0 EIADMM COc1ccc(S(=O)(=O)[N-]c2cccc3sccc32)c(C)c1 ZINC001198943964 1054318906 /nfs/dbraw/zinc/31/89/06/1054318906.db2.gz VHOFKLUKIWJUSM-UHFFFAOYSA-N -1 1 333.434 4.019 20 0 EIADMM CCCCc1nc(-c2ccc(Oc3cc(Cl)nc(=O)[n-]3)cc2)no1 ZINC000858360913 1054473295 /nfs/dbraw/zinc/47/32/95/1054473295.db2.gz AUONUVLODFOVGE-UHFFFAOYSA-N -1 1 346.774 4.021 20 0 EIADMM CCCCc1nc(-c2cccc(Oc3cc(Cl)nc(=O)[n-]3)c2)no1 ZINC000858363033 1054474871 /nfs/dbraw/zinc/47/48/71/1054474871.db2.gz DLOMWULTXDBCBZ-UHFFFAOYSA-N -1 1 346.774 4.021 20 0 EIADMM Cc1cc(Cl)ccc1S(=O)(=O)[N-]c1cccc(-c2cnco2)c1 ZINC000057119292 1054501537 /nfs/dbraw/zinc/50/15/37/1054501537.db2.gz UQBBJHJJFKAXMQ-UHFFFAOYSA-N -1 1 348.811 4.104 20 0 EIADMM C[C@H]1C[C@H](c2ccccc2F)N(C(=O)Cc2ccc([O-])c(Cl)c2)C1 ZINC001137070307 1054521243 /nfs/dbraw/zinc/52/12/43/1054521243.db2.gz AKFIDWNELDKMGG-YVEFUNNKSA-N -1 1 347.817 4.337 20 0 EIADMM O=S(=O)([N-]c1ccc2nc(C3CC3)sc2c1)c1ccc(F)cc1 ZINC000063879543 1054841255 /nfs/dbraw/zinc/84/12/55/1054841255.db2.gz XVCDHYRIEBRAMU-UHFFFAOYSA-N -1 1 348.424 4.114 20 0 EIADMM Cc1ccccc1[C@H](C)N(C)C(=O)NCc1ccc([O-])c(Cl)c1 ZINC000876394660 1054893923 /nfs/dbraw/zinc/89/39/23/1054893923.db2.gz LYZICJDRKABDEQ-ZDUSSCGKSA-N -1 1 332.831 4.257 20 0 EIADMM O=C(Nc1ccccc1Br)Nc1cccc([O-])c1Cl ZINC001201978727 1054954907 /nfs/dbraw/zinc/95/49/07/1054954907.db2.gz HOOZJPAPZKEASH-UHFFFAOYSA-N -1 1 341.592 4.452 20 0 EIADMM O=C(Nc1cc(F)c([O-])c(F)c1)Nc1ccccc1Br ZINC001201978700 1054955829 /nfs/dbraw/zinc/95/58/29/1054955829.db2.gz WHQYRSIEYNHXJQ-UHFFFAOYSA-N -1 1 343.127 4.077 20 0 EIADMM CC(C)c1nnc([N-]C(=O)c2cnc(-c3ccccc3F)s2)s1 ZINC000067541808 1055041810 /nfs/dbraw/zinc/04/18/10/1055041810.db2.gz XZAIWTWMSRLHGZ-UHFFFAOYSA-N -1 1 348.428 4.176 20 0 EIADMM O=C(/C=C/C1CCOCC1)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000862294506 1055046460 /nfs/dbraw/zinc/04/64/60/1055046460.db2.gz LPNODHGKXUKOTK-AATRIKPKSA-N -1 1 331.799 4.120 20 0 EIADMM O=C(Nc1ccccc1C(F)(F)F)Nc1c(F)cc([O-])cc1F ZINC001202165961 1055063877 /nfs/dbraw/zinc/06/38/77/1055063877.db2.gz JDFPRIRUWCZBHU-UHFFFAOYSA-N -1 1 332.228 4.333 20 0 EIADMM O=C(CSc1ccc(F)c(F)c1)Nc1ccc([O-])c(Cl)c1 ZINC000111667183 1055225782 /nfs/dbraw/zinc/22/57/82/1055225782.db2.gz UYPXVVZHOWZHRA-UHFFFAOYSA-N -1 1 329.755 4.055 20 0 EIADMM COc1ccccc1N[C@@H](C)c1cc(Br)cc(F)c1[O-] ZINC000186236202 1055260580 /nfs/dbraw/zinc/26/05/80/1055260580.db2.gz SHHZYACQPKZRKZ-VIFPVBQESA-N -1 1 340.192 4.476 20 0 EIADMM COc1cc(C(=O)N(C)C(C)(C)c2ccccc2)cc(Cl)c1[O-] ZINC000671891978 1055612438 /nfs/dbraw/zinc/61/24/38/1055612438.db2.gz BCFWTTFVNSUVFU-UHFFFAOYSA-N -1 1 333.815 4.062 20 0 EIADMM CN(C(=O)c1cc(Br)ccc1[O-])C(C)(C)c1ccccc1 ZINC000671893528 1055613065 /nfs/dbraw/zinc/61/30/65/1055613065.db2.gz LDBQQNBXZGXIQO-UHFFFAOYSA-N -1 1 348.240 4.162 20 0 EIADMM Cc1nc(C(C)C)[n-]c(=O)c1C(=O)N1CC[C@@H](C)C2(CCCCC2)C1 ZINC000765845034 1055844086 /nfs/dbraw/zinc/84/40/86/1055844086.db2.gz ZSYGASRORYXMQD-CQSZACIVSA-N -1 1 345.487 4.047 20 0 EIADMM Cc1cc(C)c(C)c(S(=O)(=O)[N-]c2cccc3[nH]ccc32)c1C ZINC000110402659 1056630729 /nfs/dbraw/zinc/63/07/29/1056630729.db2.gz PRSIEXRSNVHBGP-UHFFFAOYSA-N -1 1 328.437 4.202 20 0 EIADMM CC(C)(C)c1cc(C(=O)[N-]c2nnc(C3CCCCC3)s2)no1 ZINC000741898562 1058457329 /nfs/dbraw/zinc/45/73/29/1058457329.db2.gz ZAHDWBAXRWSDET-UHFFFAOYSA-N -1 1 334.445 4.124 20 0 EIADMM CC(=O)c1ccc([O-])c(CCOC(=O)Cc2ccc3ccccc3c2)c1 ZINC000744562433 1059579595 /nfs/dbraw/zinc/57/95/95/1059579595.db2.gz JLJFXJHBRDUUCP-UHFFFAOYSA-N -1 1 348.398 4.076 20 0 EIADMM C[C@H](Sc1nc2ccccc2s1)C(=O)Nc1c([O-])cccc1F ZINC000767170558 1061126069 /nfs/dbraw/zinc/12/60/69/1061126069.db2.gz MKXVWBHBSIWNKF-VIFPVBQESA-N -1 1 348.424 4.260 20 0 EIADMM Cc1cc(C)c(NC(=O)c2cc(Br)ccc2[O-])c(C)c1 ZINC000011639324 211228477 /nfs/dbraw/zinc/22/84/77/211228477.db2.gz WBYPTAPCBXBQKK-UHFFFAOYSA-N -1 1 334.213 4.332 20 0 EIADMM COc1cc(Br)cc(NCc2cccc([O-])c2Cl)c1 ZINC000381388764 1053073598 /nfs/dbraw/zinc/07/35/98/1053073598.db2.gz MFTNEQNDPSVFHM-UHFFFAOYSA-N -1 1 342.620 4.429 20 0 EIADMM CCOc1cc(C(=O)NC[C@@H](CC)c2ccccc2)cc(Cl)c1[O-] ZINC000216507083 1032304117 /nfs/dbraw/zinc/30/41/17/1032304117.db2.gz ZDWVMBWILCTAIG-CYBMUJFWSA-N -1 1 347.842 4.368 20 0 EIADMM CC[C@@H]1C[C@@H](C(=O)Nc2cc(Cl)c([O-])c3ccccc23)CCO1 ZINC000529538817 1032428823 /nfs/dbraw/zinc/42/88/23/1032428823.db2.gz KRPMQNDJAFXDRL-NWDGAFQWSA-N -1 1 333.815 4.343 20 0 EIADMM C[C@H]1O[C@@H](C)[C@H](C)[C@H]1C(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC000529539121 1032428907 /nfs/dbraw/zinc/42/89/07/1032428907.db2.gz PRIQFSXOOQLXKE-ZSYFIWHWSA-N -1 1 333.815 4.197 20 0 EIADMM CC[C@H]1C[C@H](C(=O)Nc2cc(Cl)c([O-])c3ccccc23)CCO1 ZINC000529538816 1032429746 /nfs/dbraw/zinc/42/97/46/1032429746.db2.gz KRPMQNDJAFXDRL-NEPJUHHUSA-N -1 1 333.815 4.343 20 0 EIADMM CCOC1(C(=O)Nc2cc(Cl)c([O-])c3ccccc23)CCCC1 ZINC000529538596 1032444033 /nfs/dbraw/zinc/44/40/33/1032444033.db2.gz GFBJRPRDJBWDNE-UHFFFAOYSA-N -1 1 333.815 4.487 20 0 EIADMM COCc1c2ccccc2oc1C(=O)Nc1ccc(Cl)cc1[O-] ZINC000533159500 1032515085 /nfs/dbraw/zinc/51/50/85/1032515085.db2.gz FGVYARGUIBAQOH-UHFFFAOYSA-N -1 1 331.755 4.191 20 0 EIADMM COc1ccc(C(=O)Nc2cccc(-c3csc(C)n3)c2)c([O-])c1 ZINC000027025097 1018817315 /nfs/dbraw/zinc/81/73/15/1018817315.db2.gz HMGBJLFTDAKCRY-UHFFFAOYSA-N -1 1 340.404 4.085 20 0 EIADMM O=C([O-])[C@@H]1C[C@H](C2CCCCC2)CN1Cc1nc2ccccc2s1 ZINC000579735561 1018845296 /nfs/dbraw/zinc/84/52/96/1018845296.db2.gz FWZHKNUCTNYABS-HOCLYGCPSA-N -1 1 344.480 4.152 20 0 EIADMM CC[C@@H](C)c1nc(C)c(CC(=O)Nc2ccc([O-])c(Cl)c2)c(C)n1 ZINC000654936294 1019029855 /nfs/dbraw/zinc/02/98/55/1019029855.db2.gz VGVBPTMXIQWWIX-SNVBAGLBSA-N -1 1 347.846 4.147 20 0 EIADMM CC(C)CCCCC(=O)N1CCC(C(=O)c2ccc([O-])cc2)CC1 ZINC000655014317 1019159293 /nfs/dbraw/zinc/15/92/93/1019159293.db2.gz SEXIVUFULBXSRB-UHFFFAOYSA-N -1 1 331.456 4.030 20 0 EIADMM Cc1ccsc1C(=O)Nc1cc(C)cc(Br)c1[O-] ZINC000182905487 1020013412 /nfs/dbraw/zinc/01/34/12/1020013412.db2.gz HUTMQZSABIMRGN-UHFFFAOYSA-N -1 1 326.215 4.085 20 0 EIADMM O=c1cc(C(F)(F)F)nc(CNc2cc(Cl)ccc2Cl)[n-]1 ZINC000535626874 1020016075 /nfs/dbraw/zinc/01/60/75/1020016075.db2.gz OBEQSXCXCNIGMP-UHFFFAOYSA-N -1 1 338.116 4.120 20 0 EIADMM CC(C)(C(=O)[O-])[C@@H]1CCCN(Cc2csc(C3CCCC3)n2)C1 ZINC000652499936 1020536592 /nfs/dbraw/zinc/53/65/92/1020536592.db2.gz SQCHQKNRGGZCKO-CQSZACIVSA-N -1 1 336.501 4.124 20 0 EIADMM C[C@@H](c1ccc(Cl)cc1Cl)S(=O)(=O)c1ccc([O-])cc1 ZINC000049488904 1020652022 /nfs/dbraw/zinc/65/20/22/1020652022.db2.gz AXTBDEAUUCLQAO-VIFPVBQESA-N -1 1 331.220 4.234 20 0 EIADMM C[C@@H](c1ccccc1Cl)N(C)CCOc1ccccc1C(=O)[O-] ZINC000237613459 1020821245 /nfs/dbraw/zinc/82/12/45/1020821245.db2.gz WABJLZCSBNLFEK-ZDUSSCGKSA-N -1 1 333.815 4.110 20 0 EIADMM Cc1ccc(Cl)c(OCc2nc(-c3ccc([O-])cc3F)no2)c1 ZINC000683592245 1020946765 /nfs/dbraw/zinc/94/67/65/1020946765.db2.gz VWFMAUJRADWROM-UHFFFAOYSA-N -1 1 334.734 4.122 20 0 EIADMM CCc1ccccc1Cc1noc(-c2cc(Cl)c([O-])c(OC)c2)n1 ZINC000683599583 1020965956 /nfs/dbraw/zinc/96/59/56/1020965956.db2.gz YPDSXAQMUOXNRM-UHFFFAOYSA-N -1 1 344.798 4.257 20 0 EIADMM CC(C)(CNC(=O)c1c(F)ccc([O-])c1F)c1ccc(Cl)cc1 ZINC000580011502 1021115200 /nfs/dbraw/zinc/11/52/00/1021115200.db2.gz HINCFHZBWBWPSV-UHFFFAOYSA-N -1 1 339.769 4.031 20 0 EIADMM CCc1nc(SCc2ccc(Br)cc2)[n-]c(=O)c1C ZINC000580217184 1021770476 /nfs/dbraw/zinc/77/04/76/1021770476.db2.gz VCMIEJAWKQFHSM-UHFFFAOYSA-N -1 1 339.258 4.108 20 0 EIADMM O=C(C[C@H]1C=CCC1)Nc1c([O-])cc(Br)cc1Cl ZINC000556847462 1021872824 /nfs/dbraw/zinc/87/28/24/1021872824.db2.gz WMXRNFOZLUYENK-QMMMGPOBSA-N -1 1 330.609 4.103 20 0 EIADMM Cc1c(C(=O)Nc2cc([O-])c(F)cc2F)sc2nccc(C)c12 ZINC001625892909 1022080613 /nfs/dbraw/zinc/08/06/13/1022080613.db2.gz ABYQWHQQTTXTIZ-UHFFFAOYSA-N -1 1 334.347 4.149 20 0 EIADMM O=C(/C=C/Sc1cc(F)ccc1F)Nc1cc([O-])c(F)cc1F ZINC001625893054 1022081801 /nfs/dbraw/zinc/08/18/01/1022081801.db2.gz DWINNKVXKBCGBJ-ONEGZZNKSA-N -1 1 343.301 4.193 20 0 EIADMM CC(C)=CCOc1cccc(C(=O)Nc2cc([O-])c(F)cc2F)c1 ZINC001625893369 1022142970 /nfs/dbraw/zinc/14/29/70/1022142970.db2.gz IEZVVGKSVGMBLK-UHFFFAOYSA-N -1 1 333.334 4.268 20 0 EIADMM Cc1cccc(S(=O)(=O)[N-]c2cccc(CCC(F)(F)F)c2)c1 ZINC000175673588 1022422151 /nfs/dbraw/zinc/42/21/51/1022422151.db2.gz FMKAXBCTYGDOKO-UHFFFAOYSA-N -1 1 343.370 4.291 20 0 EIADMM CCOc1cc(C(=O)Nc2ccc3[nH]ccc3c2)cc(Cl)c1[O-] ZINC000186445726 1022610224 /nfs/dbraw/zinc/61/02/24/1022610224.db2.gz MASMPLWUWKRBJX-UHFFFAOYSA-N -1 1 330.771 4.178 20 0 EIADMM Cc1cc(C(=O)Nc2cc(Cl)c([O-])c3ccccc23)cc(C)n1 ZINC001167445002 1022821926 /nfs/dbraw/zinc/82/19/26/1022821926.db2.gz QTCPYXKUEVHMJJ-UHFFFAOYSA-N -1 1 326.783 4.463 20 0 EIADMM O=C([N-][C@H]1CCC(F)(F)C1)C(F)(F)c1cccc(Cl)c1Cl ZINC000843565555 1023051104 /nfs/dbraw/zinc/05/11/04/1023051104.db2.gz OQYZINSCBUBVFE-ZETCQYMHSA-N -1 1 344.135 4.389 20 0 EIADMM CC(C)Oc1cc(Nc2ccc(F)c(Br)c2[O-])ccn1 ZINC001215767784 1023143468 /nfs/dbraw/zinc/14/34/68/1023143468.db2.gz BEPNSCHDMANMOJ-UHFFFAOYSA-N -1 1 341.180 4.220 20 0 EIADMM CCOc1cc(C(=O)Nc2ccc3ncsc3c2)cc(Cl)c1[O-] ZINC000186616830 1023149090 /nfs/dbraw/zinc/14/90/90/1023149090.db2.gz GIMKSCXXQGLUTF-UHFFFAOYSA-N -1 1 348.811 4.306 20 0 EIADMM O=C(c1ccc(C(F)(F)F)cc1[O-])N1CC[C@@H](c2ccccc2)C1 ZINC000180461581 1023226505 /nfs/dbraw/zinc/22/65/05/1023226505.db2.gz SXGLCUBUPRLFNP-CYBMUJFWSA-N -1 1 335.325 4.041 20 0 EIADMM C[C@@H](c1cccs1)N(C)C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000180410843 1023228847 /nfs/dbraw/zinc/22/88/47/1023228847.db2.gz CAHFFAQVABGQNN-VIFPVBQESA-N -1 1 329.343 4.306 20 0 EIADMM Cc1nc(-c2ccc(NC(=O)c3ccc([O-])cc3F)cc2)cs1 ZINC000181844991 1023268487 /nfs/dbraw/zinc/26/84/87/1023268487.db2.gz VSSXRASIGGMGJT-UHFFFAOYSA-N -1 1 328.368 4.216 20 0 EIADMM CCOc1ccccc1N(C)C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000182076110 1023289471 /nfs/dbraw/zinc/28/94/71/1023289471.db2.gz KUHMXPKVWZWZHD-UHFFFAOYSA-N -1 1 339.313 4.086 20 0 EIADMM CC(C)CCc1nc(CSc2nc(C(F)F)cc(=O)[n-]2)cs1 ZINC000584811238 1023340972 /nfs/dbraw/zinc/34/09/72/1023340972.db2.gz RSPXBRPMLUJAKZ-UHFFFAOYSA-N -1 1 345.440 4.457 20 0 EIADMM CC(C)=CCSC[C@@H](NCc1c(F)cc(C)cc1Cl)C(=O)[O-] ZINC000417631729 1023382735 /nfs/dbraw/zinc/38/27/35/1023382735.db2.gz WEWMDRITQUSOSY-OAHLLOKOSA-N -1 1 345.867 4.030 20 0 EIADMM CC(C)=CCSC[C@@H](NCc1ccc(C(C)(C)C)s1)C(=O)[O-] ZINC000417632142 1023383029 /nfs/dbraw/zinc/38/30/29/1023383029.db2.gz WIGIFAODWGMPCU-CQSZACIVSA-N -1 1 341.542 4.288 20 0 EIADMM CC(C)Cc1ccc(CNCc2ccc(C(=O)[O-])c(C3CC3)n2)cc1 ZINC000417697305 1023409092 /nfs/dbraw/zinc/40/90/92/1023409092.db2.gz DMJOQLOIAUMDSG-UHFFFAOYSA-N -1 1 338.451 4.146 20 0 EIADMM Cc1c(=O)[n-]c(SCc2ncoc2C2CC2)nc1-c1ccccc1 ZINC000467212871 1023456451 /nfs/dbraw/zinc/45/64/51/1023456451.db2.gz KRQBYYCELIHPLI-UHFFFAOYSA-N -1 1 339.420 4.315 20 0 EIADMM O=C([O-])c1ccc(-c2nc(CN3CCC[C@@H](CCF)C3)cs2)cc1 ZINC000656763117 1023502780 /nfs/dbraw/zinc/50/27/80/1023502780.db2.gz LEXSGCGYFHMDNP-ZDUSSCGKSA-N -1 1 348.443 4.080 20 0 EIADMM COc1ccc(C(C)C)cc1CN1CC[C@H](C(=O)[O-])[C@H]2CCCC[C@@H]21 ZINC000656768009 1023511489 /nfs/dbraw/zinc/51/14/89/1023511489.db2.gz UCYHGTMSBJBPKF-QYZOEREBSA-N -1 1 345.483 4.284 20 0 EIADMM O=C([O-])[C@@H](NCc1cc(C(F)(F)F)ccc1Cl)c1ccccc1 ZINC000426772150 1023786633 /nfs/dbraw/zinc/78/66/33/1023786633.db2.gz IKXADAPOIJVKSP-AWEZNQCLSA-N -1 1 343.732 4.274 20 0 EIADMM CC[C@@H](C)Oc1cccc([N-]S(=O)(=O)c2cc(F)ccc2C)c1 ZINC000511726307 1023839424 /nfs/dbraw/zinc/83/94/24/1023839424.db2.gz HSUGTMZSKOAWNW-CYBMUJFWSA-N -1 1 337.416 4.112 20 0 EIADMM Cc1cc(C(=O)Nc2ccc([O-])c(Cl)c2)c(C)n1[C@H]1CCCOC1 ZINC000626228150 1023900687 /nfs/dbraw/zinc/90/06/87/1023900687.db2.gz ZVMIMTNEZDWNGA-AWEZNQCLSA-N -1 1 348.830 4.068 20 0 EIADMM CC[C@@H](C)c1ccc(S(=O)(=O)[N-]c2cccc3[nH]ccc32)cc1 ZINC000110139179 1033174075 /nfs/dbraw/zinc/17/40/75/1033174075.db2.gz KBIOADWVBLONPJ-CYBMUJFWSA-N -1 1 328.437 4.482 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc3nc(C4CC4)oc3c2)c(C)c1 ZINC000432191654 1023971629 /nfs/dbraw/zinc/97/16/29/1023971629.db2.gz JVPHGJKMWKBQAK-UHFFFAOYSA-N -1 1 342.420 4.123 20 0 EIADMM COc1cc(Nc2cc(Cl)c(C)c(Cl)c2[O-])ccc1CO ZINC001216114848 1024223477 /nfs/dbraw/zinc/22/34/77/1024223477.db2.gz ABCMXMVVKMVGRJ-UHFFFAOYSA-N -1 1 328.195 4.252 20 0 EIADMM C[C@@H](CC[N-]S(=O)(=O)c1cc2cc(F)ccc2o1)CC(C)(C)C ZINC001211526110 1024523474 /nfs/dbraw/zinc/52/34/74/1024523474.db2.gz PYDIQQMJSVDMRM-LBPRGKRZSA-N -1 1 341.448 4.313 20 0 EIADMM CCOc1cccc(S(=O)(=O)[N-]c2c(C)cccc2C(C)C)c1 ZINC000410337821 1024689784 /nfs/dbraw/zinc/68/97/84/1024689784.db2.gz BTHPBGCTULJHDB-UHFFFAOYSA-N -1 1 333.453 4.318 20 0 EIADMM C[C@@H](C(=O)Nc1c([O-])cccc1F)c1cccc(Br)c1 ZINC000643209708 1024819952 /nfs/dbraw/zinc/81/99/52/1024819952.db2.gz UTTAWPRQPIKPHS-SECBINFHSA-N -1 1 338.176 4.036 20 0 EIADMM CCC(C)(C)c1ccc(S(=O)(=O)[N-]c2ccc3c[nH]nc3c2)cc1 ZINC000467087390 1024828743 /nfs/dbraw/zinc/82/87/43/1024828743.db2.gz YYGQHTZSJKYDMF-UHFFFAOYSA-N -1 1 343.452 4.051 20 0 EIADMM CCc1oc(C(=O)[O-])cc1CN1CC=C(c2cccc(C)c2)CC1 ZINC000652442191 1024836101 /nfs/dbraw/zinc/83/61/01/1024836101.db2.gz QTZZFHORZKUKJE-UHFFFAOYSA-N -1 1 325.408 4.138 20 0 EIADMM O=C([O-])C[C@@H](NCc1cc(C(F)(F)F)ccc1F)c1ccsc1 ZINC000276967130 1024839721 /nfs/dbraw/zinc/83/97/21/1024839721.db2.gz GOVWSTXBUFWNHC-CYBMUJFWSA-N -1 1 347.333 4.212 20 0 EIADMM CC1(C)CN(C(=O)c2ncc3ccccc3c2[O-])[C@@H]1c1cccs1 ZINC000663166722 1024863894 /nfs/dbraw/zinc/86/38/94/1024863894.db2.gz OHOGNQWOEWHKRE-QGZVFWFLSA-N -1 1 338.432 4.225 20 0 EIADMM O=C(c1ccc([O-])cc1)C1CCN(Cc2ccc(F)cc2Cl)CC1 ZINC000261369384 1025824400 /nfs/dbraw/zinc/82/44/00/1025824400.db2.gz NBNJPOGMCKMPOW-UHFFFAOYSA-N -1 1 347.817 4.280 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc(SC(F)F)cc2)cc1C ZINC000006317087 1025930332 /nfs/dbraw/zinc/93/03/32/1025930332.db2.gz AYVKZLMOSHAEEY-UHFFFAOYSA-N -1 1 343.420 4.419 20 0 EIADMM Cc1ccc(Cl)cc1S(=O)(=O)[N-]c1ccc(-c2cnco2)cc1 ZINC000119784392 1026087578 /nfs/dbraw/zinc/08/75/78/1026087578.db2.gz QKQUWXDISGYCKU-UHFFFAOYSA-N -1 1 348.811 4.104 20 0 EIADMM Cc1c(=O)[n-]c(SCCCC2CCOCC2)nc1-c1ccccc1 ZINC000279143790 1026132806 /nfs/dbraw/zinc/13/28/06/1026132806.db2.gz YQGCSNYVAJQZLX-UHFFFAOYSA-N -1 1 344.480 4.457 20 0 EIADMM CCC[C@H](NCc1ccc(-c2ccc(C(F)(F)F)cc2)o1)C(=O)[O-] ZINC000426685745 1026476447 /nfs/dbraw/zinc/47/64/47/1026476447.db2.gz KGEGJSVSRXCEGX-AWEZNQCLSA-N -1 1 341.329 4.308 20 0 EIADMM O=C([O-])[C@H](NCc1cccc(Cl)c1F)c1cccc(Cl)c1 ZINC000426735526 1026517167 /nfs/dbraw/zinc/51/71/67/1026517167.db2.gz FWQWVFMLWABTGJ-CQSZACIVSA-N -1 1 328.170 4.048 20 0 EIADMM CCc1ccc(CN[C@H](CC(=O)[O-])c2cc(Cl)cc(Cl)c2)o1 ZINC000426752000 1026535052 /nfs/dbraw/zinc/53/50/52/1026535052.db2.gz AEBXODJBWQQUNR-OAHLLOKOSA-N -1 1 342.222 4.454 20 0 EIADMM O=C([O-])[C@H](NCc1cccc(OC2CCCC2)c1)c1ccccc1F ZINC000426766553 1026560881 /nfs/dbraw/zinc/56/08/81/1026560881.db2.gz FNANLBRLIKAQKJ-LJQANCHMSA-N -1 1 343.398 4.063 20 0 EIADMM O=C([O-])C[C@H](NCc1ccc2ccccc2c1)c1ccc(F)cc1F ZINC000426786421 1026562945 /nfs/dbraw/zinc/56/29/45/1026562945.db2.gz VJSUIYHPUMFLDU-IBGZPJMESA-N -1 1 341.357 4.424 20 0 EIADMM O=C([O-])C[C@@H](NCc1cc(Cl)ccc1Cl)c1cccs1 ZINC000236422974 1026575053 /nfs/dbraw/zinc/57/50/53/1026575053.db2.gz WICYKHXNSSZCFN-GFCCVEGCSA-N -1 1 330.236 4.361 20 0 EIADMM O=C(Nc1ccc(Cl)cc1F)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684869640 1026624170 /nfs/dbraw/zinc/62/41/70/1026624170.db2.gz WJZAWEVERFXHFK-UHFFFAOYSA-N -1 1 333.668 4.456 20 0 EIADMM O=C(Nc1cccc2cccnc21)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684869940 1026625419 /nfs/dbraw/zinc/62/54/19/1026625419.db2.gz BKJYEAMHFKLFMG-UHFFFAOYSA-N -1 1 332.281 4.212 20 0 EIADMM Cc1ccc(C)c(S(=O)(=O)[N-]c2cccc(OC(F)(F)F)c2)c1 ZINC000024429656 1026627132 /nfs/dbraw/zinc/62/71/32/1026627132.db2.gz IKHLFPFPQACGEK-UHFFFAOYSA-N -1 1 345.342 4.003 20 0 EIADMM CCN(Cc1cccs1)C(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684870402 1026631455 /nfs/dbraw/zinc/63/14/55/1026631455.db2.gz FIYFKHCYROGNCM-UHFFFAOYSA-N -1 1 329.343 4.135 20 0 EIADMM Cc1cnc(C(=O)N(C)[C@H](C)[C@@H](C)c2ccc(Cl)cc2)c([O-])c1 ZINC000427249480 1026789573 /nfs/dbraw/zinc/78/95/73/1026789573.db2.gz NCNYTKJDVVGDBC-CHWSQXEVSA-N -1 1 332.831 4.013 20 0 EIADMM COc1cnc(=S)[n-]c1O[C@@H](C)c1c(Cl)cccc1Cl ZINC001226244479 1026910946 /nfs/dbraw/zinc/91/09/46/1026910946.db2.gz BKOPYQMDWRKAAY-ZETCQYMHSA-N -1 1 331.224 4.221 20 0 EIADMM CCOc1cc(C(=O)Nc2ncsc2C(C)C)cc(Cl)c1[O-] ZINC000582657542 1026913334 /nfs/dbraw/zinc/91/33/34/1026913334.db2.gz KTZXVTMALIPIRL-UHFFFAOYSA-N -1 1 340.832 4.277 20 0 EIADMM CCc1cc(=O)[n-]c(SCc2nc3ccccc3c(C)c2Cl)n1 ZINC000188094966 1027078169 /nfs/dbraw/zinc/07/81/69/1027078169.db2.gz FGJLSSOWFLVBCY-UHFFFAOYSA-N -1 1 345.855 4.135 20 0 EIADMM COc1ccc(S(=O)(=O)[N-]c2ccc(C)c(F)c2)c2ccccc12 ZINC000614738247 1027353323 /nfs/dbraw/zinc/35/33/23/1027353323.db2.gz PPFUBEHWLKYVAU-UHFFFAOYSA-N -1 1 345.395 4.097 20 0 EIADMM Cc1nc(-c2ccc(N[C@@H](C)CCCC(C)C)nc2)[n-]c(=O)c1C ZINC000302708328 1027366507 /nfs/dbraw/zinc/36/65/07/1027366507.db2.gz CTKJNZONTHVLMY-ZDUSSCGKSA-N -1 1 328.460 4.488 20 0 EIADMM CC[C@H]1CC[C@H](Nc2ccc(-c3nc(C)c(C)c(=O)[n-]3)cn2)CC1 ZINC000431494487 1027461630 /nfs/dbraw/zinc/46/16/30/1027461630.db2.gz GQCFVPLRWNLVCF-KOMQPUFPSA-N -1 1 326.444 4.242 20 0 EIADMM O=C([O-])[C@H](CCN(Cc1ccco1)Cc1ccco1)c1ccccc1 ZINC000520416465 1027527689 /nfs/dbraw/zinc/52/76/89/1027527689.db2.gz DPRDWLNMNKNCHG-LJQANCHMSA-N -1 1 339.391 4.133 20 0 EIADMM COc1cc(C(=O)N2CCC[C@]3(CC=CCC3)C2)cc(Cl)c1[O-] ZINC000153826759 1027980716 /nfs/dbraw/zinc/98/07/16/1027980716.db2.gz XISBMVGSQMGSEX-GOSISDBHSA-N -1 1 335.831 4.017 20 0 EIADMM Cc1ccc(F)c(C(=O)[N-]c2nnc(/C=C\c3ccco3)s2)c1F ZINC000346540836 1028487423 /nfs/dbraw/zinc/48/74/23/1028487423.db2.gz XPROEHCSWGPMEG-ALCCZGGFSA-N -1 1 347.346 4.140 20 0 EIADMM O=C(CCOc1ccc(Cl)cc1Cl)Nc1c([O-])cccc1F ZINC000092551415 1028514653 /nfs/dbraw/zinc/51/46/53/1028514653.db2.gz JKODGUHVJXQTSC-UHFFFAOYSA-N -1 1 344.169 4.246 20 0 EIADMM CCC[C@H](NC(=O)c1cncc([O-])c1)c1cccc(C(F)(F)F)c1 ZINC000346579739 1028525694 /nfs/dbraw/zinc/52/56/94/1028525694.db2.gz TUILWTNXBUWSBV-HNNXBMFYSA-N -1 1 338.329 4.077 20 0 EIADMM COc1ccccc1/C=C\c1nc(-c2ccc([O-])cc2Cl)no1 ZINC000445449341 1028538054 /nfs/dbraw/zinc/53/80/54/1028538054.db2.gz OBOHWXGCMNVDFY-TWGQIWQCSA-N -1 1 328.755 4.275 20 0 EIADMM COc1ccccc1/C=C/c1nc(-c2ccc([O-])cc2Cl)no1 ZINC000445449339 1028538571 /nfs/dbraw/zinc/53/85/71/1028538571.db2.gz OBOHWXGCMNVDFY-RMKNXTFCSA-N -1 1 328.755 4.275 20 0 EIADMM [O-]c1ccc(-c2noc(-c3ccnc(OC4CCC4)c3)n2)c(Cl)c1 ZINC000445443311 1028567665 /nfs/dbraw/zinc/56/76/65/1028567665.db2.gz BUHKTQNNPQBZCB-UHFFFAOYSA-N -1 1 343.770 4.089 20 0 EIADMM Cc1c(-c2nc(-c3ccc([O-])cc3Cl)no2)cnn1CCC(C)C ZINC000445443367 1028569963 /nfs/dbraw/zinc/56/99/63/1028569963.db2.gz CAMPPSVCVWACGN-UHFFFAOYSA-N -1 1 346.818 4.314 20 0 EIADMM COc1cc(Cc2nc(-c3ccc([O-])cc3Cl)no2)ccc1C ZINC000445445986 1028580055 /nfs/dbraw/zinc/58/00/55/1028580055.db2.gz KMEKMWMAHISRAM-UHFFFAOYSA-N -1 1 330.771 4.003 20 0 EIADMM Cc1[nH]c2ccccc2c1Cc1nc(-c2ccc([O-])cc2Cl)no1 ZINC000445447397 1028581101 /nfs/dbraw/zinc/58/11/01/1028581101.db2.gz OSFIHNSMIBBOOG-UHFFFAOYSA-N -1 1 339.782 4.476 20 0 EIADMM [O-]c1ccc(-c2noc(COc3ccccc3Cl)n2)c(Cl)c1 ZINC000445447104 1028581875 /nfs/dbraw/zinc/58/18/75/1028581875.db2.gz GRIYWLZLVPKTRU-UHFFFAOYSA-N -1 1 337.162 4.328 20 0 EIADMM COc1ccccc1C/C(C)=C\c1nc(-c2ccc([O-])cc2F)no1 ZINC000445453230 1028604723 /nfs/dbraw/zinc/60/47/23/1028604723.db2.gz AYGZWYTUVBFOEQ-BENRWUELSA-N -1 1 340.354 4.236 20 0 EIADMM [O-]c1ccc(-c2noc(CCCOc3ccccc3F)n2)c(Cl)c1 ZINC000445453719 1028604973 /nfs/dbraw/zinc/60/49/73/1028604973.db2.gz JHJJEIFQPMBOEX-UHFFFAOYSA-N -1 1 348.761 4.246 20 0 EIADMM [O-]c1ccc(-c2noc([C@@H]3CCC[C@H](C(F)(F)F)C3)n2)c(F)c1 ZINC000445457936 1028612456 /nfs/dbraw/zinc/61/24/56/1028612456.db2.gz VEVWQYZFZLKXJQ-BDAKNGLRSA-N -1 1 330.281 4.417 20 0 EIADMM [O-]c1ccc(-c2noc([C@H]3C[C@H]3c3cc(F)ccc3F)n2)c(F)c1 ZINC000445457672 1028612626 /nfs/dbraw/zinc/61/26/26/1028612626.db2.gz ZGKXEWFZFOFNTA-AAEUAGOBSA-N -1 1 332.281 4.131 20 0 EIADMM Cc1ccc(-c2nc(-c3nc(-c4ccc([O-])c(F)c4)no3)cs2)o1 ZINC000445477799 1028622055 /nfs/dbraw/zinc/62/20/55/1028622055.db2.gz ATHKTXFQCLTLMC-UHFFFAOYSA-N -1 1 343.339 4.273 20 0 EIADMM [O-]c1ccc(-c2noc([C@@H]3CCOc4ccc(Cl)cc43)n2)cc1F ZINC000445478578 1028623022 /nfs/dbraw/zinc/62/30/22/1028623022.db2.gz DBOSNFOGOXHUSI-LLVKDONJSA-N -1 1 346.745 4.149 20 0 EIADMM [O-]c1ccc(-c2noc(/C=C/c3ccc(OC(F)F)cc3)n2)cc1F ZINC000445478447 1028623187 /nfs/dbraw/zinc/62/31/87/1028623187.db2.gz HCOAYJWHDYSSMA-FPYGCLRLSA-N -1 1 348.280 4.353 20 0 EIADMM Cc1ccc2c(CCc3nc(-c4ccc([O-])c(F)c4)no3)c[nH]c2c1 ZINC000445480116 1028626899 /nfs/dbraw/zinc/62/68/99/1028626899.db2.gz LBFYHGMOZBLDTE-UHFFFAOYSA-N -1 1 337.354 4.156 20 0 EIADMM C[C@@H](Cc1nc(-c2ccc([O-])c(F)c2)no1)c1ccc(F)cc1F ZINC000445480805 1028627430 /nfs/dbraw/zinc/62/74/30/1028627430.db2.gz KQFMCCWPITXRCV-VIFPVBQESA-N -1 1 334.297 4.206 20 0 EIADMM Cc1nc(-c2ccccc2)ncc1-c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445480021 1028627892 /nfs/dbraw/zinc/62/78/92/1028627892.db2.gz DLOQDQJLDHBGRM-UHFFFAOYSA-N -1 1 348.337 4.014 20 0 EIADMM Cc1cc(F)cc2[nH]c(-c3nc(-c4ccc([O-])c(F)c4)no3)cc21 ZINC000445481110 1028629534 /nfs/dbraw/zinc/62/95/34/1028629534.db2.gz OLNMUDSQMKQKDX-UHFFFAOYSA-N -1 1 327.290 4.177 20 0 EIADMM [O-]c1ccc(-c2noc(CC3CCC(C(F)(F)F)CC3)n2)cc1F ZINC000445482748 1028631416 /nfs/dbraw/zinc/63/14/16/1028631416.db2.gz QANGQELZRXBECS-UHFFFAOYSA-N -1 1 344.308 4.493 20 0 EIADMM CCC(CC)n1nc(C)cc1-c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445476160 1028647201 /nfs/dbraw/zinc/64/72/01/1028647201.db2.gz ZFNGOQUDBXBUKE-UHFFFAOYSA-N -1 1 330.363 4.114 20 0 EIADMM Cc1nc(C(C)(C)C)sc1-c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445476262 1028648412 /nfs/dbraw/zinc/64/84/12/1028648412.db2.gz AKAXKJQOLNWNAB-UHFFFAOYSA-N -1 1 333.388 4.311 20 0 EIADMM CSc1ccccc1C(=O)N=c1cc(-c2ccc(Cl)s2)[n-][nH]1 ZINC000536046440 1028800782 /nfs/dbraw/zinc/80/07/82/1028800782.db2.gz WMVMDQIEFKSAMH-UHFFFAOYSA-N -1 1 349.868 4.188 20 0 EIADMM CC(C)c1ccc(S(=O)(=O)[N-]c2ccc(-c3cc[nH]n3)cc2)cc1 ZINC000324560099 1029113775 /nfs/dbraw/zinc/11/37/75/1029113775.db2.gz PPMZJAMITWZVHL-UHFFFAOYSA-N -1 1 341.436 4.001 20 0 EIADMM COCc1ccccc1[N-]S(=O)(=O)c1ccc(CCC(C)C)cc1 ZINC000614808525 1029141720 /nfs/dbraw/zinc/14/17/20/1029141720.db2.gz VPKIYUGMFPBCEJ-UHFFFAOYSA-N -1 1 347.480 4.222 20 0 EIADMM Cc1ccccc1[C@H]1CN(C(=O)c2ccc3ccccc3c2[O-])CCO1 ZINC000525253158 1029534054 /nfs/dbraw/zinc/53/40/54/1029534054.db2.gz RCYUEQYMTXJARV-HXUWFJFHSA-N -1 1 347.414 4.068 20 0 EIADMM Cc1ccc(F)cc1[N-]S(=O)(=O)c1ccc(OC(C)C)c(C)c1 ZINC000614737292 1029652391 /nfs/dbraw/zinc/65/23/91/1029652391.db2.gz OMVUUXXCIOAXRO-UHFFFAOYSA-N -1 1 337.416 4.031 20 0 EIADMM Cc1ccc(Cl)c([N-]S(=O)(=O)c2cc(F)ccc2F)c1C ZINC000446971272 1029661976 /nfs/dbraw/zinc/66/19/76/1029661976.db2.gz DQKOYBPBJJYWSO-UHFFFAOYSA-N -1 1 331.771 4.036 20 0 EIADMM Cc1nc(-c2ccc(NC[C@H]3CCC[C@@H](C)C3)nc2)[n-]c(=O)c1C ZINC000301348389 1029714287 /nfs/dbraw/zinc/71/42/87/1029714287.db2.gz HXWIFTSQVPCEFA-DOMZBBRYSA-N -1 1 326.444 4.099 20 0 EIADMM Cc1nc(-c2ccc(NC[C@@H]3C[C@H]3c3ccccc3)nc2)[n-]c(=O)c1C ZINC000301398703 1029724820 /nfs/dbraw/zinc/72/48/20/1029724820.db2.gz OOXMZNWAZLYICU-ROUUACIJSA-N -1 1 346.434 4.077 20 0 EIADMM Cc1cc(C)cc(CCNc2ccc(-c3nc(C)c(C)c(=O)[n-]3)cn2)c1 ZINC000301408267 1029727185 /nfs/dbraw/zinc/72/71/85/1029727185.db2.gz WGSASBLSCCEVAZ-UHFFFAOYSA-N -1 1 348.450 4.132 20 0 EIADMM Cc1nc(-c2ccc(N3CCC[C@@H]3c3ccccc3)nc2)[n-]c(=O)c1C ZINC000301519481 1029749363 /nfs/dbraw/zinc/74/93/63/1029749363.db2.gz KTNIBSAEGVKJCI-GOSISDBHSA-N -1 1 346.434 4.203 20 0 EIADMM Cc1ccc(CCCC(=O)Nc2ccc(-c3cc(=O)[nH][n-]3)cc2)s1 ZINC000431548001 1029759717 /nfs/dbraw/zinc/75/97/17/1029759717.db2.gz VEJFYRDJMITPBI-UHFFFAOYSA-N -1 1 341.436 4.114 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)C1(Cc2ccccc2)CCOCC1 ZINC000584450951 1029890059 /nfs/dbraw/zinc/89/00/59/1029890059.db2.gz DSSPAHLSFDRAAL-UHFFFAOYSA-N -1 1 345.826 4.024 20 0 EIADMM CCOc1cc(C(=O)Nc2ccc3nc(C)oc3c2)cc(Cl)c1[O-] ZINC000186450044 1030276236 /nfs/dbraw/zinc/27/62/36/1030276236.db2.gz QKVOXQJXPMYYKM-UHFFFAOYSA-N -1 1 346.770 4.146 20 0 EIADMM CCC(C)(C)c1ccc([N-]S(=O)(=O)c2ccc3c(c2)COC3)cc1 ZINC000447787073 1030335240 /nfs/dbraw/zinc/33/52/40/1030335240.db2.gz LSHSHZUIPLMSCU-UHFFFAOYSA-N -1 1 345.464 4.205 20 0 EIADMM CC(C)c1ccccc1[N-]S(=O)(=O)c1ccc(F)c2ncccc12 ZINC000024578725 1030451872 /nfs/dbraw/zinc/45/18/72/1030451872.db2.gz LDUMFJQWRJSHLB-UHFFFAOYSA-N -1 1 344.411 4.298 20 0 EIADMM Cn1ccc2ccc([N-]S(=O)(=O)c3ccc4ccccc4c3)cc21 ZINC000527198252 1030562788 /nfs/dbraw/zinc/56/27/88/1030562788.db2.gz QCZPPRACQVGJEG-UHFFFAOYSA-N -1 1 336.416 4.132 20 0 EIADMM O=S(=O)([N-]Cc1csc2ccccc12)c1cc2ccccc2o1 ZINC000531485923 1031307540 /nfs/dbraw/zinc/30/75/40/1031307540.db2.gz IRPHIOALUJNJEH-UHFFFAOYSA-N -1 1 343.429 4.126 20 0 EIADMM O=C(c1ccc([O-])cc1)C1CCN(C(=O)c2ccc(C3CC3)cc2)CC1 ZINC000612382066 1031462629 /nfs/dbraw/zinc/46/26/29/1031462629.db2.gz LVKWQGIWDHTSLR-UHFFFAOYSA-N -1 1 349.430 4.005 20 0 EIADMM O=C(Nc1ccc(F)cc1[O-])c1csc(-c2ccc(F)cc2)n1 ZINC000531756442 1031534588 /nfs/dbraw/zinc/53/45/88/1031534588.db2.gz KLGJOZITRYKZJK-UHFFFAOYSA-N -1 1 332.331 4.046 20 0 EIADMM C[C@H](C(=O)Nc1c([O-])cc(Br)cc1Cl)C(C)(F)F ZINC000570045902 1031598440 /nfs/dbraw/zinc/59/84/40/1031598440.db2.gz AOAAXNIMJWMJPP-RXMQYKEDSA-N -1 1 342.567 4.038 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2cccc(COC(C)C)c2)c(C)s1 ZINC000126772170 1031660511 /nfs/dbraw/zinc/66/05/11/1031660511.db2.gz NHZIZQJVTPHRBZ-UHFFFAOYSA-N -1 1 339.482 4.091 20 0 EIADMM CC(=O)c1ccc(-c2ccc(C(=O)Nc3ccc(F)cc3[O-])o2)cc1 ZINC000532012859 1031974507 /nfs/dbraw/zinc/97/45/07/1031974507.db2.gz KKCQBPMCMUPTDB-UHFFFAOYSA-N -1 1 339.322 4.246 20 0 EIADMM CC(C)CNC(=O)c1ccc(NCc2cccc([O-])c2Cl)cc1 ZINC000645180694 1033989471 /nfs/dbraw/zinc/98/94/71/1033989471.db2.gz LRPBAPIJFFUCLU-UHFFFAOYSA-N -1 1 332.831 4.044 20 0 EIADMM CCS(=O)(=O)c1ccc([O-])c(Nc2ccc(OC(C)C)cc2C)c1 ZINC001211812478 1034072739 /nfs/dbraw/zinc/07/27/39/1034072739.db2.gz CIDPMDUNHGNENM-UHFFFAOYSA-N -1 1 349.452 4.025 20 0 EIADMM CC[C@@H](C)c1ccc(S(=O)(=O)[N-]c2cc(C(C)(C)C)n[nH]2)cc1 ZINC000322437242 1034660739 /nfs/dbraw/zinc/66/07/39/1034660739.db2.gz ZJHKXQLPFKEHIU-GFCCVEGCSA-N -1 1 335.473 4.022 20 0 EIADMM CCC(=O)c1cccc([N-]S(=O)(=O)c2ccc(Cl)cc2C)c1 ZINC000433601539 1034839286 /nfs/dbraw/zinc/83/92/86/1034839286.db2.gz YVOUVADKWQWVBX-UHFFFAOYSA-N -1 1 337.828 4.042 20 0 EIADMM CCC(=O)c1cccc([N-]S(=O)(=O)c2ccc(C(C)C)cc2)c1 ZINC000433602805 1034841371 /nfs/dbraw/zinc/84/13/71/1034841371.db2.gz FWHWKCZKAICCMX-UHFFFAOYSA-N -1 1 331.437 4.204 20 0 EIADMM CCC(=O)c1cccc([N-]S(=O)(=O)c2cccc(Cl)c2C)c1 ZINC000433620407 1034841944 /nfs/dbraw/zinc/84/19/44/1034841944.db2.gz ZGQJTWTVXSSEHN-UHFFFAOYSA-N -1 1 337.828 4.042 20 0 EIADMM O=C(Nc1cccc(OC2CCCC2)c1)c1c(F)ccc([O-])c1F ZINC000280697224 1035321531 /nfs/dbraw/zinc/32/15/31/1035321531.db2.gz DZXAJIRWSSQQJZ-UHFFFAOYSA-N -1 1 333.334 4.244 20 0 EIADMM O=S(=O)([N-]c1ccc(F)cc1-c1ccc(F)cc1)c1ccccc1 ZINC000484996744 1035543994 /nfs/dbraw/zinc/54/39/94/1035543994.db2.gz YHCIDEDEPLVTCR-UHFFFAOYSA-N -1 1 345.370 4.433 20 0 EIADMM COc1cc([C@@H](C)NCc2cc(C(=O)[O-])c(C)o2)cc2ccccc21 ZINC000905797580 1035894964 /nfs/dbraw/zinc/89/49/64/1035894964.db2.gz DFXSNNUFDYAVCH-GFCCVEGCSA-N -1 1 339.391 4.299 20 0 EIADMM O=C([N-]c1nnc(-c2ccccc2)s1)c1ncoc1-c1ccccc1 ZINC000601438378 1036086874 /nfs/dbraw/zinc/08/68/74/1036086874.db2.gz IMHPBKRAKJABQJ-UHFFFAOYSA-N -1 1 348.387 4.112 20 0 EIADMM CO[C@H](C)c1cccc([N-]S(=O)(=O)c2ccc(Cl)cc2C)c1 ZINC000588833032 1036563795 /nfs/dbraw/zinc/56/37/95/1036563795.db2.gz DJFYACPMVWOZCQ-GFCCVEGCSA-N -1 1 339.844 4.157 20 0 EIADMM COCc1ccccc1S(=O)(=O)[N-]c1c(C)cccc1C(C)C ZINC000486749780 1036837875 /nfs/dbraw/zinc/83/78/75/1036837875.db2.gz SLQKYLGORMUAIA-UHFFFAOYSA-N -1 1 333.453 4.066 20 0 EIADMM CC(C)(C)c1cnc(NC(=O)Nc2ccc([O-])c(Cl)c2)s1 ZINC000486914808 1036887682 /nfs/dbraw/zinc/88/76/82/1036887682.db2.gz PFTRSECYWNGNFF-UHFFFAOYSA-N -1 1 325.821 4.444 20 0 EIADMM COC(=O)c1cc(NC(=O)Nc2ccc([O-])c(Cl)c2)cc(C)c1C ZINC000486950398 1036904133 /nfs/dbraw/zinc/90/41/33/1036904133.db2.gz LHKPXHNTACFMJP-UHFFFAOYSA-N -1 1 348.786 4.093 20 0 EIADMM CC(C)(C)SCCCC(=O)Nc1cccc([O-])c1Br ZINC000908710074 1036921973 /nfs/dbraw/zinc/92/19/73/1036921973.db2.gz VWEMFZGTKTZIHI-UHFFFAOYSA-N -1 1 346.290 4.405 20 0 EIADMM CC[C@@H](CC(=O)Nc1cc([O-])c(F)cc1F)c1ccc(OC)cc1 ZINC000909984708 1037227555 /nfs/dbraw/zinc/22/75/55/1037227555.db2.gz RVAAQSMDZWOUQY-NSHDSACASA-N -1 1 335.350 4.201 20 0 EIADMM CC(C)(C)c1ncc(/C=C/C(=O)Nc2cc([O-])c(F)cc2F)s1 ZINC000909982940 1037235433 /nfs/dbraw/zinc/23/54/33/1037235433.db2.gz OCEGNNLWFVOHFM-SNAWJCMRSA-N -1 1 338.379 4.076 20 0 EIADMM CN(Cc1ccccc1)Cn1c(CCC2CCCC2)n[n-]c1=S ZINC000058204697 1037585167 /nfs/dbraw/zinc/58/51/67/1037585167.db2.gz SYTOIJYCAIQTLQ-UHFFFAOYSA-N -1 1 330.501 4.153 20 0 EIADMM Cc1ncsc1CSc1nc(-c2ccccc2)c(C)c(=O)[n-]1 ZINC000573731547 1037679567 /nfs/dbraw/zinc/67/95/67/1037679567.db2.gz XIYRCMURJBGENM-UHFFFAOYSA-N -1 1 329.450 4.215 20 0 EIADMM O=C([O-])[C@H]1CCCN1Cc1ccc(-c2ccc(C(F)(F)F)cc2)o1 ZINC000414670953 1037768715 /nfs/dbraw/zinc/76/87/15/1037768715.db2.gz AIXPPKICXPFXEN-CQSZACIVSA-N -1 1 339.313 4.014 20 0 EIADMM CC[C@@H](NCc1ccc(-c2ccc(Cl)c(Cl)c2)o1)C(=O)[O-] ZINC000414687874 1037825755 /nfs/dbraw/zinc/82/57/55/1037825755.db2.gz XVCJRBXUDOAXCB-CYBMUJFWSA-N -1 1 328.195 4.206 20 0 EIADMM Cc1ccc(C)c(S(=O)(=O)[N-]c2ccc3nn(C(C)C)cc3c2)c1 ZINC000605615219 1037842439 /nfs/dbraw/zinc/84/24/39/1037842439.db2.gz UZTHQRNUFAWDRN-UHFFFAOYSA-N -1 1 343.452 4.035 20 0 EIADMM Cc1cc(F)c(CN[C@@H](CC(=O)[O-])c2cccs2)c(Cl)c1 ZINC000669472600 1037943267 /nfs/dbraw/zinc/94/32/67/1037943267.db2.gz CBNBLLNZAQYFKC-ZDUSSCGKSA-N -1 1 327.808 4.155 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1nc(-c2ccccc2)cs1 ZINC000513805145 1038126321 /nfs/dbraw/zinc/12/63/21/1038126321.db2.gz LTMIUKWWAXDTQX-UHFFFAOYSA-N -1 1 330.796 4.421 20 0 EIADMM C[C@H](c1ccc(C(=O)[O-])o1)N1CCC[C@H](Oc2ccccc2Cl)C1 ZINC000574406459 1038212405 /nfs/dbraw/zinc/21/24/05/1038212405.db2.gz QDJVNGSYUHWHOT-OLZOCXBDSA-N -1 1 349.814 4.236 20 0 EIADMM Cc1ccsc1S(=O)(=O)[N-]c1cc(C(F)(F)F)ccc1F ZINC000607615161 1038240429 /nfs/dbraw/zinc/24/04/29/1038240429.db2.gz KYBIAEAOAAUUIC-UHFFFAOYSA-N -1 1 339.335 4.015 20 0 EIADMM CCC[C@@H](CC)[N-]S(=O)(=O)c1c(Cl)cccc1C(F)(F)F ZINC000606905207 1038301544 /nfs/dbraw/zinc/30/15/44/1038301544.db2.gz UECZTLVAXRGMCW-SECBINFHSA-N -1 1 343.798 4.216 20 0 EIADMM C[C@@H](C(=O)Nc1c([O-])cccc1F)c1ccc(Br)s1 ZINC000608366066 1038802477 /nfs/dbraw/zinc/80/24/77/1038802477.db2.gz MVYSDUQXCJUVMC-SSDOTTSWSA-N -1 1 344.205 4.098 20 0 EIADMM Cc1ccccc1-c1nc(C(=O)Nc2c([O-])cccc2F)cs1 ZINC000608366272 1038803030 /nfs/dbraw/zinc/80/30/30/1038803030.db2.gz HMZKMTOWIHOILY-UHFFFAOYSA-N -1 1 328.368 4.216 20 0 EIADMM CSCCc1ccc([N-]S(=O)(=O)c2cccc(Cl)c2)cc1 ZINC000609016083 1038991789 /nfs/dbraw/zinc/99/17/89/1038991789.db2.gz UZFXONFWVPLGKD-UHFFFAOYSA-N -1 1 341.885 4.046 20 0 EIADMM COc1cccc([C@H]2C[C@H](N(C)C(=O)c3cc(Cl)ccc3[O-])C2)c1 ZINC000456929472 1039763869 /nfs/dbraw/zinc/76/38/69/1039763869.db2.gz VJDKUUXAMIIQCW-CTYIDZIISA-N -1 1 345.826 4.072 20 0 EIADMM CC(C)(C)[C@@H]1CCCN(C(=O)c2ccc(Br)c([O-])c2)C1 ZINC000478471643 1039782145 /nfs/dbraw/zinc/78/21/45/1039782145.db2.gz WHZSIUVCQOTYEO-GFCCVEGCSA-N -1 1 340.261 4.053 20 0 EIADMM O=c1cc(C(F)(F)F)nc(SCc2sccc2Cl)[n-]1 ZINC000505531320 1039877675 /nfs/dbraw/zinc/87/76/75/1039877675.db2.gz APRKNYMBJJRNIW-UHFFFAOYSA-N -1 1 326.752 4.208 20 0 EIADMM CCc1nc(C(C)C)ccc1CSc1nc(CC)c(C)c(=O)[n-]1 ZINC000565547770 1040112879 /nfs/dbraw/zinc/11/28/79/1040112879.db2.gz CRCNEQKKWHVYHA-UHFFFAOYSA-N -1 1 331.485 4.426 20 0 EIADMM CCOc1ccc(F)c([N-]C(=O)c2cc(F)c(F)c(F)c2F)c1F ZINC000535484981 1040305499 /nfs/dbraw/zinc/30/54/99/1040305499.db2.gz XVHSBSZJXYVYSU-UHFFFAOYSA-N -1 1 349.230 4.172 20 0 EIADMM Cc1cccc(F)c1S(=O)(=O)[N-]c1cc(Cl)ccc1Cl ZINC000479483962 1040388750 /nfs/dbraw/zinc/38/87/50/1040388750.db2.gz ZJJYVDQZWUWXCF-UHFFFAOYSA-N -1 1 334.199 4.242 20 0 EIADMM C[C@@H](C(=O)Nc1ccc(F)cc1[O-])c1cccc(Br)c1 ZINC000462239972 1040417204 /nfs/dbraw/zinc/41/72/04/1040417204.db2.gz UVHPERKVNRMDEC-SECBINFHSA-N -1 1 338.176 4.036 20 0 EIADMM Cc1cccc(S(=O)(=O)[N-]c2cc(-c3ccncc3)ccc2C)c1 ZINC000171055161 1040417353 /nfs/dbraw/zinc/41/73/53/1040417353.db2.gz YIGBZAHIFVVGDY-UHFFFAOYSA-N -1 1 338.432 4.166 20 0 EIADMM COc1cc(C)c([N-]S(=O)(=O)c2cccc3ccccc32)cc1C ZINC000435729615 1040563227 /nfs/dbraw/zinc/56/32/27/1040563227.db2.gz AWXIHSCUCUAYIS-UHFFFAOYSA-N -1 1 341.432 4.266 20 0 EIADMM Cc1cc(C(=O)Nc2ccc(-c3cc(=O)[nH][n-]3)cc2)c(C)cc1Cl ZINC000479729887 1040610066 /nfs/dbraw/zinc/61/00/66/1040610066.db2.gz NJGCYVHAAXXBCD-UHFFFAOYSA-N -1 1 341.798 4.305 20 0 EIADMM Cc1ccc(-c2nc(CSc3nc(C)c(C)c(=O)[n-]3)co2)cc1 ZINC000539618509 1040615168 /nfs/dbraw/zinc/61/51/68/1040615168.db2.gz GSVIAKUVKVFMHZ-UHFFFAOYSA-N -1 1 327.409 4.055 20 0 EIADMM Cc1ccsc1S(=O)(=O)[N-]c1ccc(OC(C)C)cc1Cl ZINC000436150689 1040926070 /nfs/dbraw/zinc/92/60/70/1040926070.db2.gz GGIIMHBUELBOAS-UHFFFAOYSA-N -1 1 345.873 4.298 20 0 EIADMM CCOc1ccc([N-]S(=O)(=O)c2cccc(C(C)C)c2)cc1F ZINC000460818900 1040950019 /nfs/dbraw/zinc/95/00/19/1040950019.db2.gz GICCPIGDQHBGIS-UHFFFAOYSA-N -1 1 337.416 4.149 20 0 EIADMM Cc1coc(-c2ccc(C)c([N-]S(=O)(=O)c3ccccc3C)c2)n1 ZINC000161062400 1040956207 /nfs/dbraw/zinc/95/62/07/1040956207.db2.gz FYDIDWHEEDILGS-UHFFFAOYSA-N -1 1 342.420 4.068 20 0 EIADMM CCCOc1ccc(S(=O)(=O)[N-]c2cc3[nH]ccc3cc2C)cc1 ZINC000436191769 1040963907 /nfs/dbraw/zinc/96/39/07/1040963907.db2.gz ZWYRTKKDXSITBA-UHFFFAOYSA-N -1 1 344.436 4.066 20 0 EIADMM CC(C)c1cccc(S(=O)(=O)[N-]c2ccc(-c3cc[nH]n3)cc2)c1 ZINC000460831827 1040992088 /nfs/dbraw/zinc/99/20/88/1040992088.db2.gz ARXSJXWKJGDOMR-UHFFFAOYSA-N -1 1 341.436 4.001 20 0 EIADMM O=c1cc(C2CC2)nc(SCc2cc(-c3ccc(F)cc3)no2)[n-]1 ZINC000436249682 1040998210 /nfs/dbraw/zinc/99/82/10/1040998210.db2.gz BAFZUHJTWQGOGU-UHFFFAOYSA-N -1 1 343.383 4.146 20 0 EIADMM CSc1cccc([N-]S(=O)(=O)c2ccc3c(c2)CCC3)c1C ZINC000538093489 1041045326 /nfs/dbraw/zinc/04/53/26/1041045326.db2.gz CZCPSMGIGKFDFF-UHFFFAOYSA-N -1 1 333.478 4.006 20 0 EIADMM CCc1cccc(S(=O)(=O)[N-]c2ccc(-c3ccc[nH]3)cc2)c1 ZINC000484251260 1041177377 /nfs/dbraw/zinc/17/73/77/1041177377.db2.gz FHZTXAUDTJNFTE-UHFFFAOYSA-N -1 1 326.421 4.045 20 0 EIADMM CC(C)c1ccccc1[N-]S(=O)(=O)c1ccc(CCCl)cc1 ZINC000042777441 1041189606 /nfs/dbraw/zinc/18/96/06/1041189606.db2.gz HIGACFVDWDGCTA-UHFFFAOYSA-N -1 1 337.872 4.392 20 0 EIADMM CSCC1CCN([C@@H](C(=O)[O-])c2ccc(Cl)c(Cl)c2)CC1 ZINC000903915993 1041231045 /nfs/dbraw/zinc/23/10/45/1041231045.db2.gz GNMCJTRTUYFXER-CQSZACIVSA-N -1 1 348.295 4.194 20 0 EIADMM Cc1cccc(Oc2ccccc2[N-]S(=O)(=O)CCCCF)c1 ZINC000436478635 1041263370 /nfs/dbraw/zinc/26/33/70/1041263370.db2.gz NEZCSPQQKMIPBK-UHFFFAOYSA-N -1 1 337.416 4.279 20 0 EIADMM C=Cc1ccc(S(=O)(=O)[N-]c2ccccc2CC(F)(F)F)cc1 ZINC000436479991 1041264594 /nfs/dbraw/zinc/26/45/94/1041264594.db2.gz YGVOELSFQIUBQH-UHFFFAOYSA-N -1 1 341.354 4.235 20 0 EIADMM O=C([O-])C[C@@H](NCc1csc(C(F)(F)F)c1)c1ccccc1F ZINC000904044523 1041298095 /nfs/dbraw/zinc/29/80/95/1041298095.db2.gz CBXYNAHPMVKRBW-GFCCVEGCSA-N -1 1 347.333 4.212 20 0 EIADMM COc1ccc(C(=O)Nc2cc(-c3ccccc3)cnc2C)c([O-])c1 ZINC000436523049 1041307881 /nfs/dbraw/zinc/30/78/81/1041307881.db2.gz YYFANSYYMUXZAN-UHFFFAOYSA-N -1 1 334.375 4.024 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1CCc2cc(F)c(F)cc21 ZINC000436525286 1041310391 /nfs/dbraw/zinc/31/03/91/1041310391.db2.gz FWXZDLQCOFNDIC-UHFFFAOYSA-N -1 1 325.314 4.027 20 0 EIADMM CCS[C@H]1CCCCN(C(=O)c2cc3ccccc3cc2[O-])C1 ZINC000436548666 1041322234 /nfs/dbraw/zinc/32/22/34/1041322234.db2.gz UCGDUGXFDZIVGB-INIZCTEOSA-N -1 1 329.465 4.293 20 0 EIADMM CCS[C@@H]1CCCCN(C(=O)c2ccc3ccccc3c2[O-])C1 ZINC000436551438 1041327747 /nfs/dbraw/zinc/32/77/47/1041327747.db2.gz YYJSGSRAEFKUNX-OAHLLOKOSA-N -1 1 329.465 4.293 20 0 EIADMM O=C(Nc1ccccc1-c1nc2ccccc2[nH]1)c1cc(F)ccc1[O-] ZINC000436553584 1041328099 /nfs/dbraw/zinc/32/80/99/1041328099.db2.gz DBYLCZQAOOSWPC-UHFFFAOYSA-N -1 1 347.349 4.327 20 0 EIADMM COc1ccc(C(=O)N(C)c2ccc(Oc3ccccc3)cc2)c([O-])c1 ZINC000436539898 1041332378 /nfs/dbraw/zinc/33/23/78/1041332378.db2.gz QCWVAHAODZKSSA-UHFFFAOYSA-N -1 1 349.386 4.470 20 0 EIADMM O=C(NC[C@@H]1CCO[C@H]1c1ccccc1)c1cc2ccccc2cc1[O-] ZINC000436592324 1041350891 /nfs/dbraw/zinc/35/08/91/1041350891.db2.gz UEMXNMNWNOHMPH-RXVVDRJESA-N -1 1 347.414 4.053 20 0 EIADMM O=C(c1cc(Cl)ccc1[O-])N1CC(Cc2ccccc2Cl)C1 ZINC000436591752 1041351507 /nfs/dbraw/zinc/35/15/07/1041351507.db2.gz XZDJNAUQIJQCNX-UHFFFAOYSA-N -1 1 336.218 4.014 20 0 EIADMM O=C(NC[C@H]1CCO[C@@H]1c1ccccc1)c1cc2ccccc2cc1[O-] ZINC000436592325 1041352402 /nfs/dbraw/zinc/35/24/02/1041352402.db2.gz UEMXNMNWNOHMPH-WIYYLYMNSA-N -1 1 347.414 4.053 20 0 EIADMM CCOc1cc(-c2nc3cccc(C)c3c(=O)[nH]2)cc(Cl)c1[O-] ZINC000436595870 1041355326 /nfs/dbraw/zinc/35/53/26/1041355326.db2.gz NKNZJMUCSPCNGB-UHFFFAOYSA-N -1 1 330.771 4.069 20 0 EIADMM O=C(N[C@H](CC(F)(F)F)c1ccc(F)cc1)c1cc(F)ccc1[O-] ZINC000436616925 1041374715 /nfs/dbraw/zinc/37/47/15/1041374715.db2.gz JAMBSEVUNFALRB-CYBMUJFWSA-N -1 1 345.267 4.094 20 0 EIADMM O=C(c1cc(F)ccc1[O-])N1[C@@H]2CC[C@H]1C[C@@H](c1ccccc1)C2 ZINC000436676678 1041415681 /nfs/dbraw/zinc/41/56/81/1041415681.db2.gz RYPZEEQRSAPAFL-ACHSLPGTSA-N -1 1 325.383 4.082 20 0 EIADMM COc1ccc(-c2ccc(-c3nc4ccccc4c(=O)[n-]3)cc2)cc1 ZINC000463222630 1041431756 /nfs/dbraw/zinc/43/17/56/1041431756.db2.gz XJYBOQYXMWCFCE-UHFFFAOYSA-N -1 1 328.371 4.266 20 0 EIADMM C[C@@H](CC(=O)Nc1ccc(F)cc1[O-])C(=O)c1ccc(Cl)cc1 ZINC000538606318 1041438788 /nfs/dbraw/zinc/43/87/88/1041438788.db2.gz ZMUJEOJUQXIPDA-JTQLQIEISA-N -1 1 335.762 4.032 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N1CCC[C@H](c2ccccc2)CC1 ZINC000436718753 1041442527 /nfs/dbraw/zinc/44/25/27/1041442527.db2.gz MBLLBEQCRCFAFU-HNNXBMFYSA-N -1 1 329.827 4.456 20 0 EIADMM C[C@@H]1CN(C(=O)c2ccc(Cl)cc2[O-])CC[C@H]1c1ccccc1 ZINC000436718721 1041442804 /nfs/dbraw/zinc/44/28/04/1041442804.db2.gz LIDKMNXSXKEZCR-CZUORRHYSA-N -1 1 329.827 4.311 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N(Cc1ccc(F)cc1F)C1CC1 ZINC000436721861 1041442812 /nfs/dbraw/zinc/44/28/12/1041442812.db2.gz LEDLSGRWEIYQFP-UHFFFAOYSA-N -1 1 337.753 4.129 20 0 EIADMM C[C@@H](c1cccc(C(F)(F)F)c1)N(C)C(=O)c1cc(F)ccc1[O-] ZINC000436759854 1041457621 /nfs/dbraw/zinc/45/76/21/1041457621.db2.gz HNUYCXUGUIFIKX-JTQLQIEISA-N -1 1 341.304 4.383 20 0 EIADMM O=C(Nc1ccc(-c2cnc(C3CC3)o2)cc1)c1cc(F)ccc1[O-] ZINC000436762410 1041459987 /nfs/dbraw/zinc/45/99/87/1041459987.db2.gz SAKQOYHAWKMRPO-UHFFFAOYSA-N -1 1 338.338 4.316 20 0 EIADMM CC[C@@H](C)N(Cc1ccccc1)C(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC000436748558 1041461552 /nfs/dbraw/zinc/46/15/52/1041461552.db2.gz GSFIQBPIHMMAAF-CYBMUJFWSA-N -1 1 347.842 4.495 20 0 EIADMM O=C(N[C@H](c1ccccc1)[C@H]1CCOC1)c1cc2ccccc2cc1[O-] ZINC000436750662 1041463507 /nfs/dbraw/zinc/46/35/07/1041463507.db2.gz OPCQVNUKUNYUEQ-GHTZIAJQSA-N -1 1 347.414 4.053 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1CCc2[nH]c3ccccc3c2C1 ZINC000436753213 1041465061 /nfs/dbraw/zinc/46/50/61/1041465061.db2.gz CTKOHHCMIIWBSZ-UHFFFAOYSA-N -1 1 342.398 4.225 20 0 EIADMM CCS[C@@H]1CC[C@H](N(C)C(=O)c2ccc(C(F)(F)F)cc2[O-])C1 ZINC000436752311 1041465270 /nfs/dbraw/zinc/46/52/70/1041465270.db2.gz QYKDWZSSOMKVAK-NWDGAFQWSA-N -1 1 347.402 4.157 20 0 EIADMM CCS[C@@H]1CC[C@@H](N(C)C(=O)c2ccc(C(F)(F)F)cc2[O-])C1 ZINC000436752315 1041465781 /nfs/dbraw/zinc/46/57/81/1041465781.db2.gz QYKDWZSSOMKVAK-VXGBXAGGSA-N -1 1 347.402 4.157 20 0 EIADMM O=C(c1cc(F)ccc1[O-])N1CCC(CCc2ccccc2)CC1 ZINC000436755237 1041466348 /nfs/dbraw/zinc/46/63/48/1041466348.db2.gz MAKWKVMUGDQYCI-UHFFFAOYSA-N -1 1 327.399 4.016 20 0 EIADMM CC(C)c1ccc(C(=O)Nc2ccc(Cn3cccn3)cc2)c([O-])c1 ZINC000436780473 1041472626 /nfs/dbraw/zinc/47/26/26/1041472626.db2.gz OVWPUJDDCLDCQR-UHFFFAOYSA-N -1 1 335.407 4.013 20 0 EIADMM CCSc1cccc(Br)c1[N-]C(=O)c1cncs1 ZINC000484874491 1041474995 /nfs/dbraw/zinc/47/49/95/1041474995.db2.gz COOHPSBLJHFNDI-UHFFFAOYSA-N -1 1 343.271 4.270 20 0 EIADMM C[C@H](NC(=O)c1ccc([O-])cc1F)c1cc(Cl)ccc1Cl ZINC000436831825 1041495772 /nfs/dbraw/zinc/49/57/72/1041495772.db2.gz GZMWQLNAPGJQMK-QMMMGPOBSA-N -1 1 328.170 4.329 20 0 EIADMM CCSc1cccc(F)c1[N-]C(=O)c1cnc2ccccc2n1 ZINC000484918129 1041512182 /nfs/dbraw/zinc/51/21/82/1041512182.db2.gz ACAJVABYPWQFRX-UHFFFAOYSA-N -1 1 327.384 4.133 20 0 EIADMM [O-]c1ccc(-c2noc(-c3ncoc3-c3ccc(F)cc3)n2)cc1F ZINC000436869532 1041528998 /nfs/dbraw/zinc/52/89/98/1041528998.db2.gz BAHBSGPQKNQGCF-UHFFFAOYSA-N -1 1 341.273 4.042 20 0 EIADMM CC(=O)Nc1cccc(-c2nc(-c3ccc([O-])cc3Cl)no2)c1C ZINC000436870822 1041529705 /nfs/dbraw/zinc/52/97/05/1041529705.db2.gz IPNZIINBUXNRMX-UHFFFAOYSA-N -1 1 343.770 4.029 20 0 EIADMM C[C@H](Oc1ccc(Cl)cc1)c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000436877057 1041530522 /nfs/dbraw/zinc/53/05/22/1041530522.db2.gz CYUCFSCAPMFAFJ-VIFPVBQESA-N -1 1 334.734 4.375 20 0 EIADMM [O-]c1ccc(-c2noc([C@@H]3C[C@H]3c3ccc(F)cc3F)n2)c(F)c1 ZINC000436875244 1041531119 /nfs/dbraw/zinc/53/11/19/1041531119.db2.gz UEHWAVIIJKWJGC-QWHCGFSZSA-N -1 1 332.281 4.131 20 0 EIADMM CCOc1cc(-c2noc(/C=C\c3cncs3)n2)cc(Cl)c1[O-] ZINC000436874333 1041531286 /nfs/dbraw/zinc/53/12/86/1041531286.db2.gz SVKDWNXXLGZQJR-ARJAWSKDSA-N -1 1 349.799 4.121 20 0 EIADMM CC(C)(Oc1ccc(F)cc1)c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000436876930 1041535585 /nfs/dbraw/zinc/53/55/85/1041535585.db2.gz CORYVLBTJSKXBL-UHFFFAOYSA-N -1 1 332.306 4.035 20 0 EIADMM [O-]c1ccc(-c2noc(-c3ncccc3Oc3ccccc3)n2)c(F)c1 ZINC000436877843 1041535865 /nfs/dbraw/zinc/53/58/65/1041535865.db2.gz HXPPHJDSENQDIT-UHFFFAOYSA-N -1 1 349.321 4.436 20 0 EIADMM Cc1ccc(-c2ocnc2-c2nc(-c3ccc([O-])cc3F)no2)cc1 ZINC000436876443 1041536441 /nfs/dbraw/zinc/53/64/41/1041536441.db2.gz YVUMRSGNFARNBU-UHFFFAOYSA-N -1 1 337.310 4.212 20 0 EIADMM CC1(C)CN(C(=O)c2ccc3ccccc3c2[O-])[C@H]1c1ccncc1 ZINC000436878403 1041537302 /nfs/dbraw/zinc/53/73/02/1041537302.db2.gz CKQUFMJAQDPOKH-IBGZPJMESA-N -1 1 332.403 4.164 20 0 EIADMM [O-]c1ccc(-c2noc([C@@H]3C[C@H]3c3ccc(F)cc3F)n2)cc1F ZINC000436877482 1041537336 /nfs/dbraw/zinc/53/73/36/1041537336.db2.gz GOYHEGCDKAHCMC-NWDGAFQWSA-N -1 1 332.281 4.131 20 0 EIADMM CC(C)(COCc1ccccc1)c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000436881248 1041537603 /nfs/dbraw/zinc/53/76/03/1041537603.db2.gz WSRLCGWEHBNOFD-UHFFFAOYSA-N -1 1 342.370 4.076 20 0 EIADMM COc1ccc(-c2nc(C(C)(C)c3ccc(Cl)cc3)no2)c([O-])c1 ZINC000436886704 1041542406 /nfs/dbraw/zinc/54/24/06/1041542406.db2.gz NRJRQCNJUYVRJR-UHFFFAOYSA-N -1 1 344.798 4.430 20 0 EIADMM COc1ccc(OCc2noc(-c3ccc4ccccc4c3[O-])n2)cc1 ZINC000436896695 1041551721 /nfs/dbraw/zinc/55/17/21/1041551721.db2.gz ZMEIYTMUOYLERG-UHFFFAOYSA-N -1 1 348.358 4.183 20 0 EIADMM CC(C)(C)C[C@H](NC(=O)C(=O)c1ccc([O-])cc1)c1ccc(F)cc1 ZINC000436899123 1041551851 /nfs/dbraw/zinc/55/18/51/1041551851.db2.gz BJXRNTAPFUWVBC-KRWDZBQOSA-N -1 1 343.398 4.008 20 0 EIADMM COCCCCc1noc(-c2cc(Oc3ccccc3)ccc2[O-])n1 ZINC000436918811 1041557000 /nfs/dbraw/zinc/55/70/00/1041557000.db2.gz KIWVPPOWLCCPOP-UHFFFAOYSA-N -1 1 340.379 4.204 20 0 EIADMM O=C(c1nc[n-]c1-c1nc(C2CCCCCC2)no1)c1ccccc1 ZINC000904686476 1041567281 /nfs/dbraw/zinc/56/72/81/1041567281.db2.gz WPEDBSHKPMAKTM-UHFFFAOYSA-N -1 1 336.395 4.129 20 0 EIADMM O=C(c1ccc([O-])cc1F)N1CC2(CCCC2)c2cccc(F)c21 ZINC000436946827 1041570401 /nfs/dbraw/zinc/57/04/01/1041570401.db2.gz BXPHJPGVRCKPCT-UHFFFAOYSA-N -1 1 329.346 4.143 20 0 EIADMM CCCCOc1ccc(C(=O)N2CCc3cc(F)c(F)cc32)c([O-])c1 ZINC000436972642 1041578000 /nfs/dbraw/zinc/57/80/00/1041578000.db2.gz PPXBIMLXYYSGSR-UHFFFAOYSA-N -1 1 347.361 4.052 20 0 EIADMM O=C(c1ccc(Cl)cc1[O-])N1CC2(CCC2)[C@@H]1c1ccccc1 ZINC000436977586 1041579698 /nfs/dbraw/zinc/57/96/98/1041579698.db2.gz FUULXOWWTHGSBD-KRWDZBQOSA-N -1 1 327.811 4.413 20 0 EIADMM CCOCc1ccccc1CNC(=O)c1ccc2ccccc2c1[O-] ZINC000436982157 1041581167 /nfs/dbraw/zinc/58/11/67/1041581167.db2.gz GEJWAYQMZSBING-UHFFFAOYSA-N -1 1 335.403 4.012 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2cc(C)c(C)c3ncccc23)c(C)c1 ZINC000437317641 1041752872 /nfs/dbraw/zinc/75/28/72/1041752872.db2.gz IKVQGOMVQZNNRH-UHFFFAOYSA-N -1 1 340.448 4.269 20 0 EIADMM Cc1ccc([C@H]2CCN(C(=O)c3ccc4ccccc4c3[O-])C2)cc1 ZINC000541479945 1041958358 /nfs/dbraw/zinc/95/83/58/1041958358.db2.gz DBQYPWQMAMNAOA-SFHVURJKSA-N -1 1 331.415 4.484 20 0 EIADMM O=S(=O)([N-]c1ccc(SC(F)F)cc1)c1cccc(Cl)c1 ZINC000007052033 1042012338 /nfs/dbraw/zinc/01/23/38/1042012338.db2.gz DAEOFXXJFVAZFM-UHFFFAOYSA-N -1 1 349.811 4.456 20 0 EIADMM Cc1cc(F)ccc1S(=O)(=O)[N-]c1ccc(C(=O)C(C)(C)C)cc1 ZINC000425967978 1042102867 /nfs/dbraw/zinc/10/28/67/1042102867.db2.gz PZYWPIJNYOTKCE-UHFFFAOYSA-N -1 1 349.427 4.164 20 0 EIADMM CC(C)c1ccc(S(=O)(=O)[N-]c2ccc3c(c2)C(=O)CCC3)cc1 ZINC000425973924 1042125552 /nfs/dbraw/zinc/12/55/52/1042125552.db2.gz ASGVEBTXZZFFNR-UHFFFAOYSA-N -1 1 343.448 4.130 20 0 EIADMM O=S(=O)([N-]c1cccc2ccc(O)cc21)c1ccc(C(F)F)cc1 ZINC000517996156 1042307835 /nfs/dbraw/zinc/30/78/35/1042307835.db2.gz NHUADQZKIYOCLB-UHFFFAOYSA-N -1 1 349.358 4.284 20 0 EIADMM O=S(=O)([N-]c1cccc(CC(F)(F)F)c1)c1cccc(Cl)c1 ZINC000438777081 1042345568 /nfs/dbraw/zinc/34/55/68/1042345568.db2.gz UVSKMVCWXXGDPB-UHFFFAOYSA-N -1 1 349.761 4.246 20 0 EIADMM C[C@@H]1CCC[C@@H]1[N-]S(=O)(=O)c1c(Cl)cc(Cl)cc1Cl ZINC000520555856 1042887122 /nfs/dbraw/zinc/88/71/22/1042887122.db2.gz UZAFVZGJEGJVHI-HQJQHLMTSA-N -1 1 342.675 4.114 20 0 EIADMM C[C@@H](c1ccc(Cl)c(Cl)c1)N1CCC2(C[C@H]2C(=O)[O-])CC1 ZINC000405359311 1042952091 /nfs/dbraw/zinc/95/20/91/1042952091.db2.gz NBSFLEINEZKZQO-JQWIXIFHSA-N -1 1 328.239 4.241 20 0 EIADMM CCN(c1ccc(NC(=O)c2c(F)ccc([O-])c2F)cc1)C(C)C ZINC000280833357 1042962079 /nfs/dbraw/zinc/96/20/79/1042962079.db2.gz TXZGTOPWRXTKGF-UHFFFAOYSA-N -1 1 334.366 4.157 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1c[nH]nc1-c1ccccc1Cl ZINC000182879210 1043035851 /nfs/dbraw/zinc/03/58/51/1043035851.db2.gz ZBUNJUPZZYETRI-UHFFFAOYSA-N -1 1 348.189 4.341 20 0 EIADMM Cc1ccc(Oc2cc(-c3nc4cccnc4c(=O)[n-]3)ccn2)cc1C ZINC000491818736 1043064336 /nfs/dbraw/zinc/06/43/36/1043064336.db2.gz OUFXGHSEKHSCPY-UHFFFAOYSA-N -1 1 344.374 4.202 20 0 EIADMM CC[C@H](O[C@H]1CCC[C@H](C)C1)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000509167250 1043158542 /nfs/dbraw/zinc/15/85/42/1043158542.db2.gz DCNANQXAVWYVAL-RBOXIYTFSA-N -1 1 325.836 4.358 20 0 EIADMM [O-]c1c(F)cc(Nc2c(O)cccc2Br)cc1Cl ZINC001214488276 1043179078 /nfs/dbraw/zinc/17/90/78/1043179078.db2.gz ACIJMKUYNHPJKT-UHFFFAOYSA-N -1 1 332.556 4.396 20 0 EIADMM Cc1c(Br)scc1C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000185403669 1043179779 /nfs/dbraw/zinc/17/97/79/1043179779.db2.gz QOQUIBSJFDOJMW-UHFFFAOYSA-N -1 1 346.633 4.430 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2cccc(-c3ccccc3)c2)cc1O ZINC000507908371 1043194121 /nfs/dbraw/zinc/19/41/21/1043194121.db2.gz KVRLDTUBGZJGES-UHFFFAOYSA-N -1 1 339.416 4.168 20 0 EIADMM Cc1ccc(-c2ccc(-c3noc(-c4ncccc4[O-])n3)cc2)cc1 ZINC001212481026 1043435428 /nfs/dbraw/zinc/43/54/28/1043435428.db2.gz VZEFBXUDLKSOJW-UHFFFAOYSA-N -1 1 329.359 4.480 20 0 EIADMM Cc1cccc(C)c1[N-]S(=O)(=O)c1ccc(CC(F)(F)F)cc1 ZINC000189230176 1043497675 /nfs/dbraw/zinc/49/76/75/1043497675.db2.gz VHFYOZXGKKAKAJ-UHFFFAOYSA-N -1 1 343.370 4.209 20 0 EIADMM O=C(Nc1ccc2ncsc2c1)c1cc(Br)ccc1[O-] ZINC000222631731 1043637535 /nfs/dbraw/zinc/63/75/35/1043637535.db2.gz URSQMCAQZRRUKR-UHFFFAOYSA-N -1 1 349.209 4.017 20 0 EIADMM O=S(=O)([N-]c1ccccc1F)c1ccc(Cl)c(F)c1Cl ZINC000190182846 1043690084 /nfs/dbraw/zinc/69/00/84/1043690084.db2.gz CVCIWGZOCIBMDX-UHFFFAOYSA-N -1 1 338.162 4.072 20 0 EIADMM CC1(C)Oc2ccc(NC(=O)Nc3ccc([O-])c(Cl)c3)cc2O1 ZINC000190953040 1043754610 /nfs/dbraw/zinc/75/46/10/1043754610.db2.gz LBJDNHOJMJRPKK-UHFFFAOYSA-N -1 1 334.759 4.197 20 0 EIADMM COc1cc(C(=O)Nc2ccccc2OCC(C)C)cc(Cl)c1[O-] ZINC000442735496 1043821196 /nfs/dbraw/zinc/82/11/96/1043821196.db2.gz GXLJVPHMKHDEMK-UHFFFAOYSA-N -1 1 349.814 4.341 20 0 EIADMM O=S(=O)(/C=C/c1ccccc1)[N-]c1ccc(-c2ccccc2)cn1 ZINC000731779713 1043830027 /nfs/dbraw/zinc/83/00/27/1043830027.db2.gz OVCXWLKSJOYPHT-BUHFOSPRSA-N -1 1 336.416 4.161 20 0 EIADMM CC(C)[C@@H]1N(C(=O)Cc2ccc([O-])c(Cl)c2)CC12CCCCC2 ZINC001626104894 1043834458 /nfs/dbraw/zinc/83/44/58/1043834458.db2.gz AOPZDIBCXZGXFK-SFHVURJKSA-N -1 1 335.875 4.405 20 0 EIADMM CC(C)Oc1ccc(S(=O)(=O)[N-]c2ccc3ccoc3c2)cc1 ZINC000442852104 1043856447 /nfs/dbraw/zinc/85/64/47/1043856447.db2.gz XSCJYSICHNUGGK-UHFFFAOYSA-N -1 1 331.393 4.021 20 0 EIADMM COc1cc(C(=O)NCc2ccc(C(C)C)cc2)cc(Cl)c1[O-] ZINC000442873602 1043873461 /nfs/dbraw/zinc/87/34/61/1043873461.db2.gz RNGAYMMZCUDKPJ-UHFFFAOYSA-N -1 1 333.815 4.108 20 0 EIADMM COc1cc(C(=O)N(C)[C@@H](C)Cc2ccc(C)cc2)cc(Cl)c1[O-] ZINC000442986022 1043953171 /nfs/dbraw/zinc/95/31/71/1043953171.db2.gz YFBMVNOEDLPLSF-ZDUSSCGKSA-N -1 1 347.842 4.066 20 0 EIADMM COc1cc(-c2nc(CCCc3ccccc3)no2)cc(Cl)c1[O-] ZINC000443096512 1044028791 /nfs/dbraw/zinc/02/87/91/1044028791.db2.gz IZWNACWVEVRJCI-UHFFFAOYSA-N -1 1 344.798 4.280 20 0 EIADMM CC[C@H]1Cc2ccccc2CN1C(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC000443132074 1044033867 /nfs/dbraw/zinc/03/38/67/1044033867.db2.gz RVVQSYQZESNBTK-HNNXBMFYSA-N -1 1 345.826 4.031 20 0 EIADMM COc1cc(-c2nc(Cc3ccc(C)cc3)no2)cc(Cl)c1[O-] ZINC000443206863 1044095498 /nfs/dbraw/zinc/09/54/98/1044095498.db2.gz XXWDRAJEUNQRST-UHFFFAOYSA-N -1 1 330.771 4.003 20 0 EIADMM COc1cc(C(=O)Nc2cccc(C(C)(C)C)c2O)cc(Cl)c1[O-] ZINC000443216598 1044105579 /nfs/dbraw/zinc/10/55/79/1044105579.db2.gz PTMNPPWHOLVCOM-UHFFFAOYSA-N -1 1 349.814 4.310 20 0 EIADMM COc1cc(-c2nc(-c3cc(C)cc(F)c3)no2)cc(Cl)c1[O-] ZINC000443222589 1044108515 /nfs/dbraw/zinc/10/85/15/1044108515.db2.gz IWRXRVXXRQDUFV-UHFFFAOYSA-N -1 1 334.734 4.219 20 0 EIADMM COc1cc(C(=O)N2CC[C@H](c3ccccc3)[C@@H]2C)cc(Cl)c1[O-] ZINC000443302013 1044165488 /nfs/dbraw/zinc/16/54/88/1044165488.db2.gz OCZSDARFNGTFBH-WFASDCNBSA-N -1 1 345.826 4.072 20 0 EIADMM COc1cc(C(=O)Nc2ccc(OC(C)(C)C)cc2)cc(Cl)c1[O-] ZINC000443302942 1044170138 /nfs/dbraw/zinc/17/01/38/1044170138.db2.gz QFWJVNUKSJFQQF-UHFFFAOYSA-N -1 1 349.814 4.484 20 0 EIADMM CCOc1cc(-c2nc(COc3ccccc3)no2)cc(Cl)c1[O-] ZINC000191160462 1044217188 /nfs/dbraw/zinc/21/71/88/1044217188.db2.gz PXEJRVRWQMZURG-UHFFFAOYSA-N -1 1 346.770 4.073 20 0 EIADMM CCOc1cccc(S(=O)(=O)[N-]c2ccccc2NC(C)(C)C)c1 ZINC000443407198 1044253051 /nfs/dbraw/zinc/25/30/51/1044253051.db2.gz HEZCSIZQZKXJMS-UHFFFAOYSA-N -1 1 348.468 4.097 20 0 EIADMM CCOc1cc(C(=O)N(CCC(C)C)C2CC2)cc(Cl)c1[O-] ZINC000358492459 1044300182 /nfs/dbraw/zinc/30/01/82/1044300182.db2.gz ADFVHVFVQSJSPO-UHFFFAOYSA-N -1 1 325.836 4.095 20 0 EIADMM O=C(Nc1ccc(Br)c([O-])c1)c1cc(F)ccc1Cl ZINC001117997997 1044329858 /nfs/dbraw/zinc/32/98/58/1044329858.db2.gz YTHZKPZBXAZTJJ-UHFFFAOYSA-N -1 1 344.567 4.200 20 0 EIADMM Cc1c(F)cccc1-c1ccc(CN(CC(=O)[O-])CC(C)(C)C)o1 ZINC000665350197 1044466147 /nfs/dbraw/zinc/46/61/47/1044466147.db2.gz GUIAMQDLSLZHAK-UHFFFAOYSA-N -1 1 333.403 4.327 20 0 EIADMM CCc1cc([N-]S(=O)(=O)c2ccc(C(F)F)cc2)ccc1F ZINC000673483253 1044504236 /nfs/dbraw/zinc/50/42/36/1044504236.db2.gz MAEDUPGXNAIAPW-UHFFFAOYSA-N -1 1 329.343 4.127 20 0 EIADMM CC(C)c1cc(C(=O)Nc2c([O-])cccc2F)nn1-c1ccccc1 ZINC000676447152 1044746920 /nfs/dbraw/zinc/74/69/20/1044746920.db2.gz KKBGCYFEJRVMBZ-UHFFFAOYSA-N -1 1 339.370 4.093 20 0 EIADMM Cc1ccc(-c2noc(-c3cc(F)ccc3[O-])n2)c(Br)c1 ZINC000230998154 1044833655 /nfs/dbraw/zinc/83/36/55/1044833655.db2.gz RIFVIQZOTRYQAJ-UHFFFAOYSA-N -1 1 349.159 4.319 20 0 EIADMM CCN(CCC1CC1)C(=O)c1ccc(NC(=O)OC(C)(C)C)cc1[O-] ZINC000495434140 1045092052 /nfs/dbraw/zinc/09/20/52/1045092052.db2.gz NAUNMPIYPOAITN-UHFFFAOYSA-N -1 1 348.443 4.001 20 0 EIADMM CSc1cccc(S(=O)(=O)[N-]c2ccc(Cl)c(F)c2)c1 ZINC000509100376 1045126430 /nfs/dbraw/zinc/12/64/30/1045126430.db2.gz QTYJQBKDDBDOFY-UHFFFAOYSA-N -1 1 331.821 4.002 20 0 EIADMM O=C([O-])C[C@@H](NCc1nc(-c2ccccc2)cs1)c1cccs1 ZINC000321182438 1045174292 /nfs/dbraw/zinc/17/42/92/1045174292.db2.gz ZQSSNLBJDWJQSV-CYBMUJFWSA-N -1 1 344.461 4.177 20 0 EIADMM O=C(c1ccc([O-])c(F)c1)N1CCC(c2cc3ccccc3[nH]2)CC1 ZINC000767885310 1045661494 /nfs/dbraw/zinc/66/14/94/1045661494.db2.gz RWERCQHOLICDCN-UHFFFAOYSA-N -1 1 338.382 4.032 20 0 EIADMM O=C(Nc1ccc(F)cc1[O-])c1ccc(C2SCCS2)cc1 ZINC000768256117 1045766940 /nfs/dbraw/zinc/76/69/40/1045766940.db2.gz TYPLUHHNXDJKQY-UHFFFAOYSA-N -1 1 335.425 4.262 20 0 EIADMM CC1(C)[C@H](C(F)(F)F)CCN1C(=O)c1ccc2ccccc2c1[O-] ZINC000326418197 1045806108 /nfs/dbraw/zinc/80/61/08/1045806108.db2.gz QJMAFPCHBDVERQ-CQSZACIVSA-N -1 1 337.341 4.348 20 0 EIADMM O=S(=O)(/C=C/c1cccc(Cl)c1)[N-]c1ccc2ccccc2n1 ZINC000768859629 1045845501 /nfs/dbraw/zinc/84/55/01/1045845501.db2.gz ZDRKLSJBSRJRHO-ZHACJKMWSA-N -1 1 344.823 4.301 20 0 EIADMM Cc1cc(Br)c([O-])c(NC(=O)[C@@H](F)c2ccccc2)c1 ZINC000769620695 1046035675 /nfs/dbraw/zinc/03/56/75/1046035675.db2.gz YEDBTALRVQJIHO-ZDUSSCGKSA-N -1 1 338.176 4.112 20 0 EIADMM O=C(c1c([O-])cccc1Cl)N1CCC[C@@H]1Cc1cccc(F)c1 ZINC000769707162 1046051827 /nfs/dbraw/zinc/05/18/27/1046051827.db2.gz XOFYXEJRMCUFDG-CQSZACIVSA-N -1 1 333.790 4.032 20 0 EIADMM O=C(c1c([O-])cccc1Cl)N1CCC[C@@H]1Cc1ccc(F)cc1 ZINC000769715159 1046052284 /nfs/dbraw/zinc/05/22/84/1046052284.db2.gz VHCKQSPSLGIDKI-CQSZACIVSA-N -1 1 333.790 4.032 20 0 EIADMM CSCC1CCC(NC(=O)c2cc3ccccc3cc2[O-])CC1 ZINC000385670081 1046094764 /nfs/dbraw/zinc/09/47/64/1046094764.db2.gz LYMMYXIEIQHGKE-UHFFFAOYSA-N -1 1 329.465 4.197 20 0 EIADMM CCc1nc(C)c([C@@H](C)N(C)C(=O)c2c([O-])cccc2Cl)s1 ZINC000769907185 1046095535 /nfs/dbraw/zinc/09/55/35/1046095535.db2.gz ILVRHBLUOSABCT-SNVBAGLBSA-N -1 1 338.860 4.206 20 0 EIADMM CC[C@@H](C)Oc1ccccc1/C=C/C(=O)Nc1c([O-])cccc1F ZINC000770862216 1046278419 /nfs/dbraw/zinc/27/84/19/1046278419.db2.gz LMULTUKKAJLJPQ-XZHRJIJLSA-N -1 1 329.371 4.361 20 0 EIADMM O=C(Nc1ncc(Br)s1)c1cc2ccccc2cc1[O-] ZINC000037387138 1046359443 /nfs/dbraw/zinc/35/94/43/1046359443.db2.gz BECLSMPRDVICLO-UHFFFAOYSA-N -1 1 349.209 4.017 20 0 EIADMM Cc1onc(-c2ccccc2Cl)c1C(=O)[N-]c1c(F)ccnc1F ZINC001129484436 1046510520 /nfs/dbraw/zinc/51/05/20/1046510520.db2.gz XWEJVLRPCCUATO-UHFFFAOYSA-N -1 1 349.724 4.229 20 0 EIADMM CSc1cc(C)ccc1[N-]C(=O)c1scnc1C(F)(F)F ZINC001129802321 1046746698 /nfs/dbraw/zinc/74/66/98/1046746698.db2.gz GAKIDLDJCRRVQS-UHFFFAOYSA-N -1 1 332.372 4.445 20 0 EIADMM Cc1c(=O)[n-]c(SC[C@H]2CC[C@@H](C3CC3)O2)nc1-c1ccccc1 ZINC000917467625 1046909614 /nfs/dbraw/zinc/90/96/14/1046909614.db2.gz FWWOSRXHMYOTDA-CVEARBPZSA-N -1 1 342.464 4.207 20 0 EIADMM Cc1ccc(C2=CCN(C(=O)c3cc(Cl)ccc3[O-])CC2)cc1 ZINC000788315116 1047167611 /nfs/dbraw/zinc/16/76/11/1047167611.db2.gz NCNSGAYWCWOOPQ-UHFFFAOYSA-N -1 1 327.811 4.284 20 0 EIADMM CCN(C(=O)c1cc(Cl)c([O-])c(OC)c1)c1ccc2[nH]ccc2c1 ZINC000788549932 1047220311 /nfs/dbraw/zinc/22/03/11/1047220311.db2.gz FVCFUBXPJUXSBK-UHFFFAOYSA-N -1 1 344.798 4.202 20 0 EIADMM CC(C)(C)Sc1ccc(NC(=O)C(=O)c2ccc([O-])cc2)cc1 ZINC000806753849 1047355310 /nfs/dbraw/zinc/35/53/10/1047355310.db2.gz ZAVZHLCTYPCXSO-UHFFFAOYSA-N -1 1 329.421 4.104 20 0 EIADMM Cc1ccc(C(F)(F)F)cc1S(=O)(=O)[N-]c1c(C)cccc1C ZINC000476253909 1047431673 /nfs/dbraw/zinc/43/16/73/1047431673.db2.gz DHXMTGKFLWVCQL-UHFFFAOYSA-N -1 1 343.370 4.431 20 0 EIADMM COc1cc(C2(C(=O)Nc3ccc([O-])c(Cl)c3)CC2)ccc1C ZINC000129573483 1047436333 /nfs/dbraw/zinc/43/63/33/1047436333.db2.gz FQGDIVUAHNKJPO-UHFFFAOYSA-N -1 1 331.799 4.033 20 0 EIADMM O=C(Nc1ncc(-c2ccc(Cl)cc2)s1)c1ccc(O)cc1[O-] ZINC001626973550 1047454648 /nfs/dbraw/zinc/45/46/48/1047454648.db2.gz VYCJGFGFZMLYGP-UHFFFAOYSA-N -1 1 346.795 4.127 20 0 EIADMM CCC(=O)Nc1ccc(C)c(NC(=O)Nc2ccc([O-])c(Cl)c2)c1 ZINC000476352138 1047470107 /nfs/dbraw/zinc/47/01/07/1047470107.db2.gz GNDXYQMDKGLVAV-UHFFFAOYSA-N -1 1 347.802 4.347 20 0 EIADMM COc1ccc(C(=O)Nc2ccc([O-])c(Cl)c2)c(OCC(C)C)c1 ZINC000789820633 1047479403 /nfs/dbraw/zinc/47/94/03/1047479403.db2.gz HZPHWLZUVKKUHF-UHFFFAOYSA-N -1 1 349.814 4.341 20 0 EIADMM O=C(Nc1nc(Cl)ccc1[O-])c1ccc(SC(F)F)cc1 ZINC000789931258 1047486118 /nfs/dbraw/zinc/48/61/18/1047486118.db2.gz DYFGXLBCSDZKBE-UHFFFAOYSA-N -1 1 330.743 4.008 20 0 EIADMM CCCCCN(C(=O)c1ccc(Br)cc1[O-])C(C)C ZINC000044491218 1047646985 /nfs/dbraw/zinc/64/69/85/1047646985.db2.gz WWGSERXNMNJEJU-UHFFFAOYSA-N -1 1 328.250 4.196 20 0 EIADMM CC(C)c1ccc(C(=O)Nc2nc(-c3cccnc3)cs2)c([O-])c1 ZINC000108062177 1047777878 /nfs/dbraw/zinc/77/78/78/1047777878.db2.gz UOCRYISIOQZVOT-UHFFFAOYSA-N -1 1 339.420 4.286 20 0 EIADMM CC(C)n1cc2cc(NC(=O)Cc3ccc([O-])c(Cl)c3)ccc2n1 ZINC001136934427 1047937368 /nfs/dbraw/zinc/93/73/68/1047937368.db2.gz MEUISNFHCRTQTQ-UHFFFAOYSA-N -1 1 343.814 4.157 20 0 EIADMM O=C(Nc1c([O-])cc(Br)cc1Cl)c1ccsc1 ZINC000556850432 1048063257 /nfs/dbraw/zinc/06/32/57/1048063257.db2.gz AHZCEOGDZDHANI-UHFFFAOYSA-N -1 1 332.606 4.122 20 0 EIADMM CCc1ccc([C@H]2C[C@@H](C)CCN2C(=O)c2ccc([O-])c(F)c2)o1 ZINC001137026359 1048077594 /nfs/dbraw/zinc/07/75/94/1048077594.db2.gz ICMKVUCMIOJDGD-BLLLJJGKSA-N -1 1 331.387 4.300 20 0 EIADMM CCOC(=O)N(C)c1ccc(NCc2cccc([O-])c2Cl)cc1 ZINC000815117989 1048333183 /nfs/dbraw/zinc/33/31/83/1048333183.db2.gz KHTZYHJVNDCOAS-UHFFFAOYSA-N -1 1 334.803 4.250 20 0 EIADMM COc1ccc(C(=O)Nc2ccc(OCCC(C)C)cc2F)c([O-])c1 ZINC001144212456 1048499133 /nfs/dbraw/zinc/49/91/33/1048499133.db2.gz STEVGRXEOFEOJW-UHFFFAOYSA-N -1 1 347.386 4.217 20 0 EIADMM [O-]c1ccc(F)cc1-c1nc(-c2ccc(Br)cc2)no1 ZINC000132981044 1048553763 /nfs/dbraw/zinc/55/37/63/1048553763.db2.gz HTEGRWNGBLHEAY-UHFFFAOYSA-N -1 1 335.132 4.011 20 0 EIADMM [O-]c1ccc(F)cc1-c1nc(-c2cccc(Br)c2)no1 ZINC000132979529 1048554211 /nfs/dbraw/zinc/55/42/11/1048554211.db2.gz BISLSDMEQRLFPP-UHFFFAOYSA-N -1 1 335.132 4.011 20 0 EIADMM O=C(N[C@@H]1CCSc2ccc(F)cc21)c1c([O-])cccc1Cl ZINC000920432368 1048679400 /nfs/dbraw/zinc/67/94/00/1048679400.db2.gz WDSLVCUXIVRRKZ-GFCCVEGCSA-N -1 1 337.803 4.152 20 0 EIADMM Cc1cc(CN(Cc2ccccc2)Cc2c(F)cc([O-])cc2F)on1 ZINC001144560291 1048726997 /nfs/dbraw/zinc/72/69/97/1048726997.db2.gz ZJLDQIIONXOPKD-UHFFFAOYSA-N -1 1 344.361 4.169 20 0 EIADMM [O-]c1cc(F)c(CN2CCC[C@@H]2c2cc(F)cc(F)c2)c(F)c1 ZINC001144567616 1048734003 /nfs/dbraw/zinc/73/40/03/1048734003.db2.gz UXIJZZGPJWFCON-QGZVFWFLSA-N -1 1 325.305 4.286 20 0 EIADMM Cc1ccc(OC2CCN(Cc3cc(F)c([O-])cc3F)CC2)cc1 ZINC001144666527 1048787728 /nfs/dbraw/zinc/78/77/28/1048787728.db2.gz MGDJUOJLUCDKQA-UHFFFAOYSA-N -1 1 333.378 4.022 20 0 EIADMM C[C@@H]1CC/C(=C/C(=O)Nc2c([O-])cc(Br)cc2Cl)C1 ZINC000816590696 1048832057 /nfs/dbraw/zinc/83/20/57/1048832057.db2.gz JDCFAUGSPVCZQL-CPJBWDMUSA-N -1 1 344.636 4.493 20 0 EIADMM C[C@H]1CC/C(=C\C(=O)Nc2c([O-])cc(Br)cc2Cl)C1 ZINC000816590698 1048832408 /nfs/dbraw/zinc/83/24/08/1048832408.db2.gz JDCFAUGSPVCZQL-MOIHINDBSA-N -1 1 344.636 4.493 20 0 EIADMM CSc1cccnc1[N-]C(=O)c1csc(-c2cccs2)n1 ZINC001144820607 1048863281 /nfs/dbraw/zinc/86/32/81/1048863281.db2.gz JTJJQYUHGQSCHF-UHFFFAOYSA-N -1 1 333.463 4.241 20 0 EIADMM CC(C)(C)c1ccc(CC(=O)Nc2cc(=O)n(-c3ccccc3)[n-]2)cc1 ZINC001144866527 1048871913 /nfs/dbraw/zinc/87/19/13/1048871913.db2.gz PZTZGDMBZRNXJC-UHFFFAOYSA-N -1 1 349.434 4.057 20 0 EIADMM O=C(Nc1nc2ccccc2s1)c1ccc(C(F)(F)F)cc1[O-] ZINC001135900031 1048952835 /nfs/dbraw/zinc/95/28/35/1048952835.db2.gz ZIXYTLHPEQZNDX-UHFFFAOYSA-N -1 1 338.310 4.273 20 0 EIADMM O=C(c1c([O-])cccc1Cl)N1CC2(CCC2)[C@@H]1c1ccccc1 ZINC000817564785 1049002470 /nfs/dbraw/zinc/00/24/70/1049002470.db2.gz DBSQKMKHELJAFW-KRWDZBQOSA-N -1 1 327.811 4.413 20 0 EIADMM CC[C@H]1CCCN(C(=O)c2cc(-c3ccc(C=O)o3)ccc2[O-])CC1 ZINC001146333229 1049016080 /nfs/dbraw/zinc/01/60/80/1049016080.db2.gz WHVVRILGNVQLFO-AWEZNQCLSA-N -1 1 341.407 4.117 20 0 EIADMM O=C(N[C@@H]1CC[C@H]2CCCC[C@H]2C1)c1ccc(C(F)(F)F)c([O-])c1 ZINC001136019205 1049040186 /nfs/dbraw/zinc/04/01/86/1049040186.db2.gz MNHISFTYHAMCPG-MBNYWOFBSA-N -1 1 341.373 4.500 20 0 EIADMM CCOc1ccc(NC(=O)c2cc(Cl)c([O-])c(OC)c2)c(C)c1 ZINC000134970747 1049047684 /nfs/dbraw/zinc/04/76/84/1049047684.db2.gz BYIRDRKQFJKPGL-UHFFFAOYSA-N -1 1 335.787 4.014 20 0 EIADMM C[C@]1(Cc2ccccc2Cl)CCCN1C(=O)c1ccc(F)c([O-])c1 ZINC001146989533 1049076633 /nfs/dbraw/zinc/07/66/33/1049076633.db2.gz YTCSMPNKYJCVJO-LJQANCHMSA-N -1 1 347.817 4.422 20 0 EIADMM Cc1ccc(C[C@H](C)N(C)C(=O)c2ccc3ccc(O)cc3c2[O-])cc1 ZINC001147276201 1049124220 /nfs/dbraw/zinc/12/42/20/1049124220.db2.gz GETYILRCXSKYBU-HNNXBMFYSA-N -1 1 349.430 4.263 20 0 EIADMM Cc1ccc([C@H]2[C@H](C)CCCN2C(=O)c2ccc([O-])c(F)c2)cc1 ZINC001147796241 1049217843 /nfs/dbraw/zinc/21/78/43/1049217843.db2.gz QXKRZSBMHGQQTN-AUUYWEPGSA-N -1 1 327.399 4.453 20 0 EIADMM O=C(Nc1nc(-c2c[nH]c3ccccc32)cs1)c1ccccc1[O-] ZINC000044585254 1049250302 /nfs/dbraw/zinc/25/03/02/1049250302.db2.gz KSICREXBGUCNEF-UHFFFAOYSA-N -1 1 335.388 4.249 20 0 EIADMM O=C(N[C@@H](c1ccccc1)c1ccc(F)cc1)c1cccc([O-])c1F ZINC001136223166 1049316528 /nfs/dbraw/zinc/31/65/28/1049316528.db2.gz GLMGZUVPTHBZBG-IBGZPJMESA-N -1 1 339.341 4.190 20 0 EIADMM O=C(c1ccc2ccc(O)cc2c1[O-])N1CCC[C@@H]2CCCC[C@@H]21 ZINC001148456926 1049316947 /nfs/dbraw/zinc/31/69/47/1049316947.db2.gz UDEKWEPDBNGSFW-KSSFIOAISA-N -1 1 325.408 4.046 20 0 EIADMM C[C@H]1c2ccccc2CCN1C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC001148790230 1049371242 /nfs/dbraw/zinc/37/12/42/1049371242.db2.gz JCEUKSFOMRCRQL-NSHDSACASA-N -1 1 335.325 4.171 20 0 EIADMM CC(=O)c1cccc(NC(=O)c2ccc(C(F)(F)F)cc2[O-])c1C ZINC001148801084 1049382430 /nfs/dbraw/zinc/38/24/30/1049382430.db2.gz RERGULUOGXLIGU-UHFFFAOYSA-N -1 1 337.297 4.174 20 0 EIADMM O=C(c1cccc(-c2ccccc2)c1[O-])N1CCC(=O)[C@H]2CCCC[C@@H]21 ZINC001148860900 1049389948 /nfs/dbraw/zinc/38/99/48/1049389948.db2.gz APCVSYONGQQLOW-HKUYNNGSSA-N -1 1 349.430 4.033 20 0 EIADMM O=C(N[C@@H]1CCCc2cnccc21)c1cccc(-c2ccccc2)c1[O-] ZINC001148872982 1049393358 /nfs/dbraw/zinc/39/33/58/1049393358.db2.gz OKIJCCWKSHIVGE-HXUWFJFHSA-N -1 1 344.414 4.262 20 0 EIADMM CCOc1cccc(NC(=O)c2ccc(C(F)(F)F)cc2[O-])c1 ZINC001136320986 1049473224 /nfs/dbraw/zinc/47/32/24/1049473224.db2.gz JQIOQJDCXSTNNL-UHFFFAOYSA-N -1 1 325.286 4.062 20 0 EIADMM CCc1cc2c(CN3C[C@@H](C)c4ccccc43)cc(=O)oc2cc1[O-] ZINC001171352127 1049506128 /nfs/dbraw/zinc/50/61/28/1049506128.db2.gz BJPGGFFSVPQUHP-CYBMUJFWSA-N -1 1 335.403 4.185 20 0 EIADMM CCc1ccc(S(=O)(=O)[N-]c2cccc(Cl)c2Cl)s1 ZINC000244206703 1049597444 /nfs/dbraw/zinc/59/74/44/1049597444.db2.gz VRVBJFMAFWWDDW-UHFFFAOYSA-N -1 1 336.265 4.418 20 0 EIADMM COC(=O)Cc1ccc(Nc2ccc(Cl)c(Cl)c2[O-])cc1 ZINC001212622239 1049749667 /nfs/dbraw/zinc/74/96/67/1049749667.db2.gz WQBGPBQKUYVWSM-UHFFFAOYSA-N -1 1 326.179 4.158 20 0 EIADMM O=C(Nc1cccc(F)c1[O-])c1cc(C2CC2)nc2ccc(F)cc21 ZINC001171632702 1049763351 /nfs/dbraw/zinc/76/33/51/1049763351.db2.gz LNEUVHRAUXYWDK-UHFFFAOYSA-N -1 1 340.329 4.348 20 0 EIADMM CCCC[C@@H]1CCC[C@@H]1NC(=O)c1c([O-])cnc2c(F)cccc21 ZINC001136601327 1049777094 /nfs/dbraw/zinc/77/70/94/1049777094.db2.gz SUNTUEMLKJJNEX-DOMZBBRYSA-N -1 1 330.403 4.168 20 0 EIADMM CCCC[C@@H]1CCC[C@H]1NC(=O)c1c([O-])cnc2c(F)cccc21 ZINC001136601328 1049777314 /nfs/dbraw/zinc/77/73/14/1049777314.db2.gz SUNTUEMLKJJNEX-IUODEOHRSA-N -1 1 330.403 4.168 20 0 EIADMM Cc1ccc(-c2csc(NC(=O)c3ccc(O)cc3[O-])n2)c(C)c1 ZINC001136674226 1049824439 /nfs/dbraw/zinc/82/44/39/1049824439.db2.gz ZRXYBNJLXUQQCV-UHFFFAOYSA-N -1 1 340.404 4.090 20 0 EIADMM CC[C@H](C)[C@@H](C)N(C(=O)c1ccc2ccc(O)cc2c1[O-])C1CC1 ZINC001136714624 1049844043 /nfs/dbraw/zinc/84/40/43/1049844043.db2.gz RMYPVGXZOVBJNR-QWHCGFSZSA-N -1 1 327.424 4.290 20 0 EIADMM CCCOc1c(F)cc(F)c(Nc2ccnc(Cl)c2[O-])c1F ZINC001212648299 1049870617 /nfs/dbraw/zinc/87/06/17/1049870617.db2.gz VUEDSPJHPNFEML-UHFFFAOYSA-N -1 1 332.709 4.390 20 0 EIADMM O=C([N-]c1c(F)cc(Cl)cc1F)c1cc([N+](=O)[O-])ccc1Cl ZINC000180358642 1049887710 /nfs/dbraw/zinc/88/77/10/1049887710.db2.gz SNDLFQDZCHYLFM-UHFFFAOYSA-N -1 1 347.104 4.432 20 0 EIADMM Cc1c(CNC(=O)c2ccc(Cl)cc2[O-])oc2ccc(F)cc12 ZINC001136805570 1049892757 /nfs/dbraw/zinc/89/27/57/1049892757.db2.gz KSQDPIGUXSARSF-UHFFFAOYSA-N -1 1 333.746 4.169 20 0 EIADMM O=C(N=c1cc(-c2cccs2)[n-][nH]1)c1cccc(Cl)c1Cl ZINC000617365474 1049982304 /nfs/dbraw/zinc/98/23/04/1049982304.db2.gz QGHURELNVHUCBS-UHFFFAOYSA-N -1 1 338.219 4.119 20 0 EIADMM Cc1nc([C@@H](C)[N@H+]2CCC[C@@H](C(=O)[O-])C2)oc1-c1ccc(Cl)cc1 ZINC000263582063 1050090023 /nfs/dbraw/zinc/09/00/23/1050090023.db2.gz YAYBINXBGRKHAM-TZMCWYRMSA-N -1 1 348.830 4.161 20 0 EIADMM COc1cc([N-]S(=O)(=O)c2cccc(F)c2C)cc2ccccc21 ZINC001185837355 1050167865 /nfs/dbraw/zinc/16/78/65/1050167865.db2.gz XZHBQLQAFWEBNA-UHFFFAOYSA-N -1 1 345.395 4.097 20 0 EIADMM Cc1ccc(Cl)c(-c2noc(-c3ncc(C(F)(F)F)[n-]3)n2)c1 ZINC001212689865 1050229230 /nfs/dbraw/zinc/22/92/30/1050229230.db2.gz QJRUJMYOEBEWKT-UHFFFAOYSA-N -1 1 328.681 4.107 20 0 EIADMM Cc1ccc(Cl)c(-c2noc(-c3nc(C(F)(F)F)c[n-]3)n2)c1 ZINC001212689865 1050229244 /nfs/dbraw/zinc/22/92/44/1050229244.db2.gz QJRUJMYOEBEWKT-UHFFFAOYSA-N -1 1 328.681 4.107 20 0 EIADMM Cc1c(F)ccc(-c2noc(-c3ncc(C(F)(F)F)[n-]3)n2)c1Cl ZINC001212690142 1050230427 /nfs/dbraw/zinc/23/04/27/1050230427.db2.gz ZPHDJSRNQYOJKA-UHFFFAOYSA-N -1 1 346.671 4.246 20 0 EIADMM Cc1c(F)ccc(-c2noc(-c3nc(C(F)(F)F)c[n-]3)n2)c1Cl ZINC001212690142 1050230439 /nfs/dbraw/zinc/23/04/39/1050230439.db2.gz ZPHDJSRNQYOJKA-UHFFFAOYSA-N -1 1 346.671 4.246 20 0 EIADMM O=C(Nc1ccc(C2(C(F)(F)F)CC2)cc1)c1ccc([O-])c(F)c1 ZINC001186202026 1050259167 /nfs/dbraw/zinc/25/91/67/1050259167.db2.gz HLQIMHCEOYHWEU-UHFFFAOYSA-N -1 1 339.288 4.378 20 0 EIADMM O=C(Nc1cccc(OC(F)(F)C(F)F)c1)c1ccc([O-])c(F)c1 ZINC001186202913 1050259795 /nfs/dbraw/zinc/25/97/95/1050259795.db2.gz ZVHATVNCAFRAIK-UHFFFAOYSA-N -1 1 347.239 4.020 20 0 EIADMM O=C(NC1c2ccccc2Oc2ccccc21)c1ccc([O-])c(F)c1 ZINC001186234288 1050266397 /nfs/dbraw/zinc/26/63/97/1050266397.db2.gz VEKOGZMLNSOEPE-UHFFFAOYSA-N -1 1 335.334 4.156 20 0 EIADMM CC(C)c1oncc1[N-]C(=O)c1cc(-c2ccccc2Cl)on1 ZINC001177844124 1050315854 /nfs/dbraw/zinc/31/58/54/1050315854.db2.gz YHOGHFQNHLCILV-UHFFFAOYSA-N -1 1 331.759 4.359 20 0 EIADMM CC(C)(C)CCC[N-]S(=O)(=O)c1c(Cl)cc(F)cc1Cl ZINC001187181117 1050496832 /nfs/dbraw/zinc/49/68/32/1050496832.db2.gz RJAXEVGEXLPRHU-UHFFFAOYSA-N -1 1 342.263 4.237 20 0 EIADMM Cc1ccc(Cl)c([N-]S(=O)(=O)c2cc3c(s2)CCCC3)c1 ZINC001187210585 1050508194 /nfs/dbraw/zinc/50/81/94/1050508194.db2.gz VGRUKYHZFZVGHX-UHFFFAOYSA-N -1 1 341.885 4.390 20 0 EIADMM O=C(Nc1cccc(Br)c1)Nc1cc([O-])c(F)cc1F ZINC001187465485 1050546061 /nfs/dbraw/zinc/54/60/61/1050546061.db2.gz SSTCWBRPQPGYJZ-UHFFFAOYSA-N -1 1 343.127 4.077 20 0 EIADMM CS(=O)(=O)c1ccc([O-])c(Nc2ccccc2-c2ccccc2)c1 ZINC001173818889 1050565234 /nfs/dbraw/zinc/56/52/34/1050565234.db2.gz MYZMMRBUSJZZID-UHFFFAOYSA-N -1 1 339.416 4.206 20 0 EIADMM COC(=O)[N-]C(=S)N(c1ccc(C(C)C)cc1)c1ccccc1N ZINC001173894222 1050608799 /nfs/dbraw/zinc/60/87/99/1050608799.db2.gz KKBGRFXZXLZUBY-UHFFFAOYSA-N -1 1 343.452 4.171 20 0 EIADMM [O-]C(c1ccc(NC2=CCCC2)cc1)(C(F)(F)F)C(F)(F)F ZINC001173999407 1050671144 /nfs/dbraw/zinc/67/11/44/1050671144.db2.gz MNGHOYIBUTXAMX-UHFFFAOYSA-N -1 1 325.252 4.479 20 0 EIADMM [O-]c1c(Cl)cc(Br)cc1Nc1ccc2c(c1)CCO2 ZINC001174013498 1050680563 /nfs/dbraw/zinc/68/05/63/1050680563.db2.gz RIUAWBRHCPJGAO-UHFFFAOYSA-N -1 1 340.604 4.487 20 0 EIADMM CC1(C)CCN(C(=O)c2cc(F)ccc2[O-])C[C@H]1c1ccccc1 ZINC001179370643 1050684497 /nfs/dbraw/zinc/68/44/97/1050684497.db2.gz BSZARLKQJAXZFH-KRWDZBQOSA-N -1 1 327.399 4.187 20 0 EIADMM CCCc1cc(=O)[n-]c(SCC(=O)c2cc(CC)ccc2CC)n1 ZINC001188153936 1050712000 /nfs/dbraw/zinc/71/20/00/1050712000.db2.gz AQZYQYFEBLQJTB-UHFFFAOYSA-N -1 1 344.480 4.235 20 0 EIADMM O=C(/C=C/c1cc(F)cc(F)c1)Nc1cccc(C(F)(F)F)c1[O-] ZINC001179566967 1050717738 /nfs/dbraw/zinc/71/77/38/1050717738.db2.gz AYSFPFBBCDJXJD-SNAWJCMRSA-N -1 1 343.251 4.341 20 0 EIADMM C[C@H](CC(=O)Nc1cc(F)c([O-])cc1Cl)c1ccc(F)cc1 ZINC001179655620 1050738426 /nfs/dbraw/zinc/73/84/26/1050738426.db2.gz IPBWFQGWAXCBOK-SECBINFHSA-N -1 1 325.742 4.456 20 0 EIADMM Cc1cc2ccccc2n1CC(=O)Nc1cc(F)c([O-])cc1Cl ZINC001179656620 1050738646 /nfs/dbraw/zinc/73/86/46/1050738646.db2.gz VNXQYZCYFVRNNN-UHFFFAOYSA-N -1 1 332.762 4.087 20 0 EIADMM Cc1ccc(NC2CC2)c(C(=O)Nc2cc(F)c([O-])cc2Cl)c1 ZINC001179659548 1050739438 /nfs/dbraw/zinc/73/94/38/1050739438.db2.gz BKPRRKQBUWRMPK-UHFFFAOYSA-N -1 1 334.778 4.320 20 0 EIADMM CC(C)CNC(=O)c1cccc(Nc2cc([O-])c(Cl)cc2F)c1 ZINC001174194241 1050829657 /nfs/dbraw/zinc/82/96/57/1050829657.db2.gz DBMQRVQSYVJMIC-UHFFFAOYSA-N -1 1 336.794 4.314 20 0 EIADMM [O-]c1c(Br)ccc(Cl)c1Nc1cccc2n[nH]cc21 ZINC001174348295 1050904760 /nfs/dbraw/zinc/90/47/60/1050904760.db2.gz WLZFPLONCJTBPD-UHFFFAOYSA-N -1 1 338.592 4.428 20 0 EIADMM O=C(Nc1c([O-])cccc1F)NC(c1ccccc1)c1ccccc1 ZINC001189534279 1051014077 /nfs/dbraw/zinc/01/40/77/1051014077.db2.gz URJKQZHXDGBBNO-UHFFFAOYSA-N -1 1 336.366 4.442 20 0 EIADMM O=C(Nc1ccc(F)cc1[O-])NC(c1ccccc1)c1ccccc1 ZINC001189533745 1051015287 /nfs/dbraw/zinc/01/52/87/1051015287.db2.gz GRIJNGVYTNPSGD-UHFFFAOYSA-N -1 1 336.366 4.442 20 0 EIADMM Cc1c(Cl)cc(NC2=CCC3(CC2)OCCO3)c([O-])c1Cl ZINC001174642876 1051098301 /nfs/dbraw/zinc/09/83/01/1051098301.db2.gz HTPJVRFFWONUMO-UHFFFAOYSA-N -1 1 330.211 4.230 20 0 EIADMM CCC(C)(C)c1ccc(S(=O)(=O)[N-]c2ccccc2[C@@H](C)O)cc1 ZINC001190448555 1051189038 /nfs/dbraw/zinc/18/90/38/1051189038.db2.gz VHKXMFFVVWDWIE-CQSZACIVSA-N -1 1 347.480 4.228 20 0 EIADMM O=S(=O)([N-]c1ccccc1-n1cccc1)c1ccc(C2CC2)cc1 ZINC001190499448 1051193391 /nfs/dbraw/zinc/19/33/91/1051193391.db2.gz GLUNFRKSIFHUOV-UHFFFAOYSA-N -1 1 338.432 4.156 20 0 EIADMM O=S(=O)([N-]c1ccc(F)c2cnccc12)c1ccc(C2CC2)cc1 ZINC001190507410 1051198810 /nfs/dbraw/zinc/19/88/10/1051198810.db2.gz VGTYVLAOCWEUEH-UHFFFAOYSA-N -1 1 342.395 4.052 20 0 EIADMM Cc1ccc([C@@H](NCc2ccc([O-])c(F)c2F)c2ccccn2)cc1 ZINC001181410653 1051216266 /nfs/dbraw/zinc/21/62/66/1051216266.db2.gz OALCSUVOYUFADF-HXUWFJFHSA-N -1 1 340.373 4.253 20 0 EIADMM CC[C@@H](c1ccncc1)N(CC)C(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC000153871481 1051237493 /nfs/dbraw/zinc/23/74/93/1051237493.db2.gz BVUROCGBALQHKW-HNNXBMFYSA-N -1 1 348.830 4.063 20 0 EIADMM CC[C@H](CC(C)C)C(=O)Nc1cc(OC)cc(Br)c1[O-] ZINC001181829657 1051325279 /nfs/dbraw/zinc/32/52/79/1051325279.db2.gz BAGWQVPZUUNYJG-SNVBAGLBSA-N -1 1 344.249 4.174 20 0 EIADMM Cc1cc(NC(=O)c2ccc([O-])cc2F)ccc1Oc1cccnc1 ZINC000154824564 1051341947 /nfs/dbraw/zinc/34/19/47/1051341947.db2.gz RUUKJHNFJGAZTJ-UHFFFAOYSA-N -1 1 338.338 4.279 20 0 EIADMM CC(=O)c1cc(Nc2c(F)cc([O-])cc2F)ccc1Br ZINC001175102897 1051349735 /nfs/dbraw/zinc/34/97/35/1051349735.db2.gz OUSUNBUEZVFLTF-UHFFFAOYSA-N -1 1 342.139 4.379 20 0 EIADMM COc1cc(C(=O)Nc2cc(OC(C)C)ccc2C)cc(Cl)c1[O-] ZINC001191148914 1051365268 /nfs/dbraw/zinc/36/52/68/1051365268.db2.gz UTEOVEUDDIGFFH-UHFFFAOYSA-N -1 1 349.814 4.402 20 0 EIADMM O=C(NCCCc1ccccc1)Nc1cccc(C(F)(F)F)c1[O-] ZINC001191211370 1051386819 /nfs/dbraw/zinc/38/68/19/1051386819.db2.gz VIQVSTWCNOOXJY-UHFFFAOYSA-N -1 1 338.329 4.165 20 0 EIADMM CCCCc1ccc(S(=O)(=O)[N-]c2c(C)ccnc2CC)cc1 ZINC001191232915 1051405585 /nfs/dbraw/zinc/40/55/85/1051405585.db2.gz LTXMKWXZTGAINN-UHFFFAOYSA-N -1 1 332.469 4.096 20 0 EIADMM CCCCCCOc1ccc(-n2[n-]c(=O)c3ccc(N)cc32)cc1 ZINC001175191037 1051416722 /nfs/dbraw/zinc/41/67/22/1051416722.db2.gz WZSLETNHBQJDHK-UHFFFAOYSA-N -1 1 325.412 4.272 20 0 EIADMM CC[C@H](C)Sc1ccc([N-]S(=O)(=O)c2cccn2C)c(C)c1 ZINC000414381206 1051450355 /nfs/dbraw/zinc/45/03/55/1051450355.db2.gz MHPLUCDMQFHDJU-ZDUSSCGKSA-N -1 1 338.498 4.025 20 0 EIADMM CCCCOc1ccc(Nc2cc3ccc([O-])cc3oc2=O)cc1 ZINC001175241807 1051469447 /nfs/dbraw/zinc/46/94/47/1051469447.db2.gz LYSWEWHFDBQAIN-UHFFFAOYSA-N -1 1 325.364 4.421 20 0 EIADMM O=S(=O)(CC1CCCC1)[N-]c1ccccc1OCc1ccccc1 ZINC001191524185 1051474702 /nfs/dbraw/zinc/47/47/02/1051474702.db2.gz WQLSSJAYKJNAFP-UHFFFAOYSA-N -1 1 345.464 4.198 20 0 EIADMM O=C(Nc1cc(F)cc(C(F)(F)F)c1)Nc1cc(Cl)ncc1[O-] ZINC001191561861 1051490670 /nfs/dbraw/zinc/49/06/70/1051490670.db2.gz RJPVMSJPQIECEZ-UHFFFAOYSA-N -1 1 349.671 4.243 20 0 EIADMM CC(=O)c1c(Br)cccc1Nc1c(F)ccc([O-])c1F ZINC001175268117 1051503793 /nfs/dbraw/zinc/50/37/93/1051503793.db2.gz KSFYRYNICDHNIA-UHFFFAOYSA-N -1 1 342.139 4.379 20 0 EIADMM O=S(=O)([N-][C@H]1CCC[C@H](F)C1)c1sc2ccccc2c1Cl ZINC001191754997 1051538707 /nfs/dbraw/zinc/53/87/07/1051538707.db2.gz CIISKPJAUGGMMD-UWVGGRQHSA-N -1 1 347.864 4.114 20 0 EIADMM CCNC(=O)c1ccc(Nc2cc(Cl)c([O-])cc2Cl)cc1 ZINC001175632967 1051683549 /nfs/dbraw/zinc/68/35/49/1051683549.db2.gz PIJPCCIOHYWNFP-UHFFFAOYSA-N -1 1 325.195 4.192 20 0 EIADMM O=C(NC1CC1)c1ccc(Nc2cc(Cl)c([O-])cc2Cl)cc1 ZINC001175608714 1051697181 /nfs/dbraw/zinc/69/71/81/1051697181.db2.gz MICJZSISFMLSJB-UHFFFAOYSA-N -1 1 337.206 4.335 20 0 EIADMM CC(C)[C@H]1CN(C(=O)Cc2ccc([O-])c(Cl)c2)c2ccccc2N1 ZINC001182864212 1051726229 /nfs/dbraw/zinc/72/62/29/1051726229.db2.gz UDAMGWQEDBYVCZ-MRXNPFEDSA-N -1 1 344.842 4.071 20 0 EIADMM O=C(NC1CCC(c2ccccc2)CC1)c1cc([O-])cc(F)c1F ZINC001192670377 1051788727 /nfs/dbraw/zinc/78/87/27/1051788727.db2.gz IQGGRQLUPZYZPB-UHFFFAOYSA-N -1 1 331.362 4.127 20 0 EIADMM O=c1ccn(-c2ccc(Nc3ccc(-c4ccccc4)nc3)cc2)[n-]1 ZINC001175834583 1051798420 /nfs/dbraw/zinc/79/84/20/1051798420.db2.gz SLBNPARMGZLBSZ-UHFFFAOYSA-N -1 1 328.375 4.384 20 0 EIADMM [O-]c1c(F)c(F)ccc1Nc1cccc2c1cnn2[C@H]1CCCCO1 ZINC001176323836 1051988898 /nfs/dbraw/zinc/98/88/98/1051988898.db2.gz REIZWIASPJMNHL-MRXNPFEDSA-N -1 1 345.349 4.463 20 0 EIADMM O=C(OCc1cc(Cl)cc2cccnc21)c1ccc([O-])cc1F ZINC000773567989 1051994480 /nfs/dbraw/zinc/99/44/80/1051994480.db2.gz CBTSLQADKCOSLE-UHFFFAOYSA-N -1 1 331.730 4.090 20 0 EIADMM CCS(=O)(=O)c1ccc([O-])c(Nc2cc(C)c(Cl)c(C)c2)c1 ZINC001176337860 1051995520 /nfs/dbraw/zinc/99/55/20/1051995520.db2.gz NKMFODBWTFTFKC-UHFFFAOYSA-N -1 1 339.844 4.200 20 0 EIADMM COc1ccc(C)c([N-]S(=O)(=O)c2ccc(C)c3ccccc32)c1 ZINC001193824240 1052005599 /nfs/dbraw/zinc/00/55/99/1052005599.db2.gz DXEFFKVQYHHEJS-UHFFFAOYSA-N -1 1 341.432 4.266 20 0 EIADMM Cc1nc(CSc2nc(-c3ccccc3)c(C)c(=O)[n-]2)sc1C ZINC000163897809 1052010641 /nfs/dbraw/zinc/01/06/41/1052010641.db2.gz KQSGVYMKYBMVLM-UHFFFAOYSA-N -1 1 343.477 4.111 20 0 EIADMM C[C@@H](OC(=O)c1ccc([O-])cc1F)c1ncc(-c2ccccc2)o1 ZINC000773576860 1052057594 /nfs/dbraw/zinc/05/75/94/1052057594.db2.gz DHMCFIJPODUFRS-LLVKDONJSA-N -1 1 327.311 4.104 20 0 EIADMM O=C([O-])C[C@H](NCc1ncc(-c2ccccc2)s1)c1cccs1 ZINC000671162447 1052070985 /nfs/dbraw/zinc/07/09/85/1052070985.db2.gz DPCLCZDJQZNIMM-ZDUSSCGKSA-N -1 1 344.461 4.177 20 0 EIADMM Cc1cc(Br)ccc1NC(=O)Nc1cccc(F)c1[O-] ZINC001184819932 1052111470 /nfs/dbraw/zinc/11/14/70/1052111470.db2.gz JYHBBLRODSCMOW-UHFFFAOYSA-N -1 1 339.164 4.246 20 0 EIADMM [O-]c1c(-c2nc(C3Cc4ccccc4C3)no2)ccc2ccccc21 ZINC000327530275 1052117534 /nfs/dbraw/zinc/11/75/34/1052117534.db2.gz PEMUBXIRLLYIGX-UHFFFAOYSA-N -1 1 328.371 4.478 20 0 EIADMM CCS(=O)(=O)c1ccc([O-])c(Nc2cc(Cl)cc(Cl)c2)c1 ZINC001176570937 1052136312 /nfs/dbraw/zinc/13/63/12/1052136312.db2.gz PVNATCMHWGPKOD-UHFFFAOYSA-N -1 1 346.235 4.236 20 0 EIADMM Cc1ncc(Nc2c(F)cc(F)c([O-])c2F)cc1Br ZINC001176664353 1052157466 /nfs/dbraw/zinc/15/74/66/1052157466.db2.gz VMHLLYHOZIXMPN-UHFFFAOYSA-N -1 1 333.107 4.019 20 0 EIADMM Cc1cnn(-c2cccc(F)c2)c1Nc1c(F)cc(F)c([O-])c1F ZINC001176669673 1052157681 /nfs/dbraw/zinc/15/76/81/1052157681.db2.gz KAPWHXWRYDFYGB-UHFFFAOYSA-N -1 1 337.276 4.186 20 0 EIADMM COc1cccc(-c2cc(Nc3c(F)cc(F)c([O-])c3F)on2)c1 ZINC001176663879 1052157988 /nfs/dbraw/zinc/15/79/88/1052157988.db2.gz NEILLICEZXVAOZ-UHFFFAOYSA-N -1 1 336.269 4.217 20 0 EIADMM COc1cc(Nc2c(F)cc(F)c([O-])c2F)ccc1-n1cnc(C)c1 ZINC001176671018 1052160175 /nfs/dbraw/zinc/16/01/75/1052160175.db2.gz QYGVZTUTWJFARB-UHFFFAOYSA-N -1 1 349.312 4.056 20 0 EIADMM [O-]c1c(F)cc(F)c(Nc2ccc(OCC(F)(F)F)cc2)c1F ZINC001176671015 1052160397 /nfs/dbraw/zinc/16/03/97/1052160397.db2.gz QXHRGYYGMKCAOR-UHFFFAOYSA-N -1 1 337.219 4.494 20 0 EIADMM CC(C)OC(=O)c1cccc(Nc2c(F)cc(F)c([O-])c2F)c1 ZINC001176673253 1052160441 /nfs/dbraw/zinc/16/04/41/1052160441.db2.gz QLGWAEKXMUTZNY-UHFFFAOYSA-N -1 1 325.286 4.118 20 0 EIADMM Cc1ccc(C(F)(F)F)c([N-]S(=O)(=O)c2c(C)cccc2C)c1 ZINC001194637739 1052182426 /nfs/dbraw/zinc/18/24/26/1052182426.db2.gz DBSHRWVVEPGLOD-UHFFFAOYSA-N -1 1 343.370 4.431 20 0 EIADMM O=S(=O)([N-]c1ccc(Oc2ccc(F)cc2)cc1)c1ccsc1 ZINC001185382634 1052226337 /nfs/dbraw/zinc/22/63/37/1052226337.db2.gz ALWSMGMBLIEZKG-UHFFFAOYSA-N -1 1 349.408 4.480 20 0 EIADMM Cc1cc(Oc2ccc([N-]S(=O)(=O)c3ccsc3)cc2)ccn1 ZINC001185390476 1052228343 /nfs/dbraw/zinc/22/83/43/1052228343.db2.gz HGZDYYIVDUEJSA-UHFFFAOYSA-N -1 1 346.433 4.045 20 0 EIADMM O=C(Nc1cccc(C(F)(F)F)c1[O-])C12CCC(F)(CC1)CC2 ZINC001185531728 1052258970 /nfs/dbraw/zinc/25/89/70/1052258970.db2.gz IIOJMTWPTMOMMO-UHFFFAOYSA-N -1 1 331.309 4.412 20 0 EIADMM CCC1(CC)CCN(C(=O)c2ccc(C(F)(F)F)cc2[O-])CC1 ZINC000622522898 1052315741 /nfs/dbraw/zinc/31/57/41/1052315741.db2.gz PPBYZYVAPXFVFI-UHFFFAOYSA-N -1 1 329.362 4.453 20 0 EIADMM CC(C)c1ocnc1C(=O)[N-]c1c(F)cc(Br)cc1F ZINC000072498375 1052371902 /nfs/dbraw/zinc/37/19/02/1052371902.db2.gz ITZTYBUUKATWBF-UHFFFAOYSA-N -1 1 345.143 4.091 20 0 EIADMM O=C([N-]c1c(F)cc(Cl)cc1F)c1csc([C@H]2CCCO2)n1 ZINC000180352899 1052795483 /nfs/dbraw/zinc/79/54/83/1052795483.db2.gz JWQWAXPFWVUUEA-LLVKDONJSA-N -1 1 344.770 4.179 20 0 EIADMM O=C([N-]c1cnoc1)c1csc(-c2ccc(Cl)cc2Cl)n1 ZINC000623938837 1052839714 /nfs/dbraw/zinc/83/97/14/1052839714.db2.gz KZOZTDWWIOWKGY-UHFFFAOYSA-N -1 1 340.191 4.357 20 0 EIADMM CC(C)c1ccc([C@H](C)N(C)Cc2nc(=O)c3sccc3[n-]2)cc1 ZINC000194990360 1053049633 /nfs/dbraw/zinc/04/96/33/1053049633.db2.gz WNJYFTQYLZVXRI-ZDUSSCGKSA-N -1 1 341.480 4.301 20 0 EIADMM O=C(c1c([O-])cnc2ccc(Cl)cc21)N1CCCC2(CCC2)C1 ZINC000338928842 1053241390 /nfs/dbraw/zinc/24/13/90/1053241390.db2.gz XOKKSFVDPSSKNS-UHFFFAOYSA-N -1 1 330.815 4.000 20 0 EIADMM CC(C)c1cccc(S(=O)(=O)[N-]c2cccc3cnccc32)c1 ZINC001195109098 1053270992 /nfs/dbraw/zinc/27/09/92/1053270992.db2.gz ZBMTYSOUPCBQFV-UHFFFAOYSA-N -1 1 326.421 4.159 20 0 EIADMM CC(C)(C)c1csc(CN[C@H](CCC(=O)[O-])c2ccccc2)n1 ZINC000864511924 1053299271 /nfs/dbraw/zinc/29/92/71/1053299271.db2.gz RMPFVSAPNTZPTR-CQSZACIVSA-N -1 1 332.469 4.136 20 0 EIADMM O=C([O-])CCc1cccc(CNCc2cnc(C3CCCC3)s2)c1 ZINC000864518930 1053300926 /nfs/dbraw/zinc/30/09/26/1053300926.db2.gz YWIHTEXRAGQRAW-UHFFFAOYSA-N -1 1 344.480 4.108 20 0 EIADMM CC(C)=CC[C@H](NCc1ccc(-c2ccc(F)cc2C)o1)C(=O)[O-] ZINC000864528324 1053305790 /nfs/dbraw/zinc/30/57/90/1053305790.db2.gz NQFFROQNDVZQHS-KRWDZBQOSA-N -1 1 331.387 4.293 20 0 EIADMM Cc1cc(NC(=O)Cc2ccc([O-])c(Cl)c2)ccc1N1CCCC1 ZINC000864669509 1053332718 /nfs/dbraw/zinc/33/27/18/1053332718.db2.gz JKJNUESOYCQDGL-UHFFFAOYSA-N -1 1 344.842 4.135 20 0 EIADMM Cc1ccc([O-])c(C(=O)N2CCC(c3ccc4ccccc4c3)CC2)n1 ZINC001195323442 1053357618 /nfs/dbraw/zinc/35/76/18/1053357618.db2.gz IOKCEHSALHDSRM-UHFFFAOYSA-N -1 1 346.430 4.269 20 0 EIADMM COc1cccc([O-])c1C(=O)Nc1cccc2c(Cl)c(C)cnc12 ZINC001168537648 1053461217 /nfs/dbraw/zinc/46/12/17/1053461217.db2.gz JPGCRYBNOMKCLD-UHFFFAOYSA-N -1 1 342.782 4.163 20 0 EIADMM CCN(C(=O)c1ccc(C(F)(F)F)c([O-])c1)c1ccccc1OC ZINC001626919639 1053695423 /nfs/dbraw/zinc/69/54/23/1053695423.db2.gz DNLRJKDEAUKGHR-UHFFFAOYSA-N -1 1 339.313 4.086 20 0 EIADMM C[C@H](c1cccc(F)c1)[NH+]1CCN(Cc2ccc(O)c(Cl)c2)CC1 ZINC001197069513 1053832098 /nfs/dbraw/zinc/83/20/98/1053832098.db2.gz JGDFGOITSVDSPL-CQSZACIVSA-N -1 1 348.849 4.064 20 0 EIADMM Cc1nc(C(C)C)[n-]c(=O)c1C(=O)Nc1ccc2c(c1)C=CCCC2 ZINC000855859351 1053987588 /nfs/dbraw/zinc/98/75/88/1053987588.db2.gz PWCLZUDEJUJKHX-UHFFFAOYSA-N -1 1 337.423 4.216 20 0 EIADMM CC(=O)Nc1cccc(NC(=O)c2cc3ccccc3cc2[O-])c1C ZINC000029818167 1054022331 /nfs/dbraw/zinc/02/23/31/1054022331.db2.gz VOIXMGVJMDGQSB-UHFFFAOYSA-N -1 1 334.375 4.065 20 0 EIADMM Cc1cc2cc(NC(=O)c3cc(Br)ccc3[O-])ccc2[nH]1 ZINC000029879585 1054023973 /nfs/dbraw/zinc/02/39/73/1054023973.db2.gz BZUNABZHJUNAKM-UHFFFAOYSA-N -1 1 345.196 4.197 20 0 EIADMM Cc1c(=O)[n-]c(SC[C@@H]2C[C@H]3CCC[C@H]3O2)nc1-c1ccccc1 ZINC000871666989 1054242363 /nfs/dbraw/zinc/24/23/63/1054242363.db2.gz BCTIQCGGCCPBNI-OWCLPIDISA-N -1 1 342.464 4.207 20 0 EIADMM Cc1ccc(OC(C)C)cc1[N-]S(=O)(=O)c1ccc2occc2c1 ZINC001198858505 1054283151 /nfs/dbraw/zinc/28/31/51/1054283151.db2.gz AZUUQJADASDAAN-UHFFFAOYSA-N -1 1 345.420 4.329 20 0 EIADMM CC(C)Oc1cccc([N-]S(=O)(=O)c2ccc3occc3c2)c1 ZINC001198863275 1054288134 /nfs/dbraw/zinc/28/81/34/1054288134.db2.gz XUTKLVMPIJSXSF-UHFFFAOYSA-N -1 1 331.393 4.021 20 0 EIADMM Cc1cc([N-]S(=O)(=O)c2ccc3occc3c2)cc2scnc21 ZINC001198868620 1054294245 /nfs/dbraw/zinc/29/42/45/1054294245.db2.gz KDSDZYBMXVDOLX-UHFFFAOYSA-N -1 1 344.417 4.152 20 0 EIADMM O=C(Nc1cccc(C(F)(F)F)c1[O-])c1ccc(C2CCC2)nc1 ZINC001199285775 1054378915 /nfs/dbraw/zinc/37/89/15/1054378915.db2.gz DVBCUZYKZNJDNC-UHFFFAOYSA-N -1 1 336.313 4.326 20 0 EIADMM O=C([N-]c1nc[nH]n1)c1sc2cc(Cl)cc(Cl)c2c1Cl ZINC000060847950 1054726020 /nfs/dbraw/zinc/72/60/20/1054726020.db2.gz UXDJMZPGOJYXNJ-UHFFFAOYSA-N -1 1 347.614 4.232 20 0 EIADMM C[C@@H](CC(F)(F)F)NCc1ccc(-c2ccccc2C(=O)[O-])o1 ZINC000859794396 1054729640 /nfs/dbraw/zinc/72/96/40/1054729640.db2.gz ADXMTPCJCXFENS-JTQLQIEISA-N -1 1 327.302 4.075 20 0 EIADMM O=C(NCc1ccc([O-])c(Cl)c1)N[C@@H](c1cccs1)C1CC1 ZINC000875038195 1054758178 /nfs/dbraw/zinc/75/81/78/1054758178.db2.gz GMCNDMUPDNNEJF-OAHLLOKOSA-N -1 1 336.844 4.058 20 0 EIADMM O=S(=O)([N-]c1ccccc1)c1cc(Cl)cc(C(F)(F)F)c1 ZINC001201343286 1054768761 /nfs/dbraw/zinc/76/87/61/1054768761.db2.gz FYDZUKZXBZYYFA-UHFFFAOYSA-N -1 1 335.734 4.160 20 0 EIADMM Cc1cccc(S(=O)(=O)[N-]c2ccc3nc(C4CC4)sc3c2)c1 ZINC000063879477 1054842260 /nfs/dbraw/zinc/84/22/60/1054842260.db2.gz NJYLUZJZXDKDRF-UHFFFAOYSA-N -1 1 344.461 4.283 20 0 EIADMM O=C(NC[C@@H](c1ccccc1)C(F)(F)F)c1c([O-])cccc1Cl ZINC000777219963 1054993490 /nfs/dbraw/zinc/99/34/90/1054993490.db2.gz CFPYBMJLDWWUMH-NSHDSACASA-N -1 1 343.732 4.122 20 0 EIADMM CN(C(=O)OC(C)(C)C)c1ccc(NC(=O)c2ccccc2[O-])cc1 ZINC000862828991 1055116052 /nfs/dbraw/zinc/11/60/52/1055116052.db2.gz XOKRVBLYUNCGHJ-UHFFFAOYSA-N -1 1 342.395 4.016 20 0 EIADMM O=C(Nc1cccc(C(F)(F)F)c1)Nc1cc(F)c(F)cc1[O-] ZINC001202298231 1055131262 /nfs/dbraw/zinc/13/12/62/1055131262.db2.gz VNFSGOOKFDLHOZ-UHFFFAOYSA-N -1 1 332.228 4.333 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1ccc(N2CCCCCC2)nc1 ZINC000111666770 1055224492 /nfs/dbraw/zinc/22/44/92/1055224492.db2.gz CMGBXXPQBCQQKP-UHFFFAOYSA-N -1 1 345.830 4.073 20 0 EIADMM COc1ccc(S(=O)(=O)[N-]c2c(C)cccc2C)c2ccccc12 ZINC000055558819 1055802157 /nfs/dbraw/zinc/80/21/57/1055802157.db2.gz CXPCOBLPVFRKBE-UHFFFAOYSA-N -1 1 341.432 4.266 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1ccnc(Oc2ccccc2)c1 ZINC000542817553 1056099370 /nfs/dbraw/zinc/09/93/70/1056099370.db2.gz SMLMBQPFDLKWCI-UHFFFAOYSA-N -1 1 340.766 4.485 20 0 EIADMM CC[C@H](C)CC[N-]S(=O)(=O)c1c(Cl)cc(Cl)cc1Cl ZINC001212436068 1056483165 /nfs/dbraw/zinc/48/31/65/1056483165.db2.gz WQJLNOJTWUGQMY-QMMMGPOBSA-N -1 1 344.691 4.361 20 0 EIADMM COc1cc(Br)cnc1Nc1cc(F)c([O-])c(Cl)c1 ZINC001214480147 1056702441 /nfs/dbraw/zinc/70/24/41/1056702441.db2.gz MHWSFTPOBIVAJY-UHFFFAOYSA-N -1 1 347.571 4.094 20 0 EIADMM Cc1ncc(Br)cc1Nc1cc(F)c([O-])c(Cl)c1 ZINC001214482577 1056720754 /nfs/dbraw/zinc/72/07/54/1056720754.db2.gz BYCYTQIUTLAROV-UHFFFAOYSA-N -1 1 331.572 4.394 20 0 EIADMM CC[C@@H](C)c1ccc(S(=O)(=O)[N-]c2cc(OC)cc(OC)c2)cc1 ZINC000007056336 1056761206 /nfs/dbraw/zinc/76/12/06/1056761206.db2.gz JWGBIVAAKNZTLL-CYBMUJFWSA-N -1 1 349.452 4.018 20 0 EIADMM O=S(=O)([N-]c1cc(F)ccc1F)c1cccc(Cl)c1Cl ZINC000007405104 1056792191 /nfs/dbraw/zinc/79/21/91/1056792191.db2.gz NFBMUVIDAQGQHY-UHFFFAOYSA-N -1 1 338.162 4.072 20 0 EIADMM Cc1cccc(C)c1[N-]S(=O)(=O)c1cccc(OC(F)(F)F)c1 ZINC000025523998 1032168755 /nfs/dbraw/zinc/16/87/55/1032168755.db2.gz OYVATOOITHZCIY-UHFFFAOYSA-N -1 1 345.342 4.003 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2cc(F)c(C)cc2F)c(Cl)c1 ZINC000475735423 1032541947 /nfs/dbraw/zinc/54/19/47/1032541947.db2.gz CZQHXKRDAQKESB-UHFFFAOYSA-N -1 1 331.771 4.036 20 0 EIADMM CC(C)=CCC[C@H](C)Nc1ccc(-c2nc(C)c(C)c(=O)[n-]2)cn1 ZINC000450674064 1032646919 /nfs/dbraw/zinc/64/69/19/1032646919.db2.gz MCEMOXNDXNBMHD-ZDUSSCGKSA-N -1 1 326.444 4.408 20 0 EIADMM O=C(Cc1ccccc1OC1CCCC1)Nc1c([O-])cccc1F ZINC000655032640 1019216996 /nfs/dbraw/zinc/21/69/96/1019216996.db2.gz UVVVKZMMPSQDNV-UHFFFAOYSA-N -1 1 329.371 4.034 20 0 EIADMM COc1cccc2cc(CNC(=O)c3ccc4ccccc4c3[O-])oc21 ZINC001143531612 1032848083 /nfs/dbraw/zinc/84/80/83/1032848083.db2.gz HDIDUPUATNJOJL-UHFFFAOYSA-N -1 1 347.370 4.230 20 0 EIADMM CC[C@H](C(=O)[N-]OCCC(F)(F)F)c1cccc(C(F)(F)F)c1 ZINC000154900209 1020099283 /nfs/dbraw/zinc/09/92/83/1020099283.db2.gz RXPLVRWSDZZJDW-NSHDSACASA-N -1 1 343.267 4.199 20 0 EIADMM CCC(=O)Nc1ccc(C)c(NC(=O)c2cc(SC)ccc2[O-])c1 ZINC001625849170 1020280271 /nfs/dbraw/zinc/28/02/71/1020280271.db2.gz JFXPZBYXVBZOJA-UHFFFAOYSA-N -1 1 344.436 4.023 20 0 EIADMM O=C(c1ccc([O-])c(F)c1)N1CC2(CCCC2)c2cccc(F)c21 ZINC000683348443 1020355844 /nfs/dbraw/zinc/35/58/44/1020355844.db2.gz QKGMSIPIYJPFIW-UHFFFAOYSA-N -1 1 329.346 4.143 20 0 EIADMM CCc1cc(=O)[n-]c(SCCCc2ccc(C(F)(F)F)cc2)n1 ZINC000683454844 1020852613 /nfs/dbraw/zinc/85/26/13/1020852613.db2.gz WKOTXWQUXOJXAZ-UHFFFAOYSA-N -1 1 342.386 4.488 20 0 EIADMM O=C(Nc1nc(-c2ccncc2)cs1)c1cc2ccccc2cc1[O-] ZINC000006969500 1021382317 /nfs/dbraw/zinc/38/23/17/1021382317.db2.gz WEGMHBBWISZMIC-UHFFFAOYSA-N -1 1 347.399 4.316 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N(C[C@H]1CCCO1)C1CCCC1 ZINC000174543267 1022094350 /nfs/dbraw/zinc/09/43/50/1022094350.db2.gz BABFDIUPTYDHPV-QGZVFWFLSA-N -1 1 339.435 4.109 20 0 EIADMM CCCCC1CCC(C(=O)NCc2n[n-]c(=S)n2C(C)C)CC1 ZINC000066650297 1022226745 /nfs/dbraw/zinc/22/67/45/1022226745.db2.gz MSDHFFRFKXWMRZ-UHFFFAOYSA-N -1 1 338.521 4.134 20 0 EIADMM CCS[C@@H]1CC[C@@H](N(C)C(=O)c2ccc3ccccc3c2[O-])C1 ZINC000175391922 1022349457 /nfs/dbraw/zinc/34/94/57/1022349457.db2.gz LRLHXMRXPDLBFY-HUUCEWRRSA-N -1 1 329.465 4.292 20 0 EIADMM CCc1nc(C(C)C)ccc1CSc1nc(C(F)F)cc(=O)[n-]1 ZINC000549066653 1022587084 /nfs/dbraw/zinc/58/70/84/1022587084.db2.gz HDARCBPVFDBPDC-UHFFFAOYSA-N -1 1 339.411 4.493 20 0 EIADMM CCOc1cc(C(=O)N(C)[C@@H]2CCCC[C@@H]2C)cc(Cl)c1[O-] ZINC000186565609 1022673497 /nfs/dbraw/zinc/67/34/97/1022673497.db2.gz QLZINBMQBQDFQU-SMDDNHRTSA-N -1 1 325.836 4.095 20 0 EIADMM CCOc1cc(C(=O)NCc2cc3ccccc3o2)cc(Cl)c1[O-] ZINC000186624628 1022706929 /nfs/dbraw/zinc/70/69/29/1022706929.db2.gz VDMULAAPKFRLFY-UHFFFAOYSA-N -1 1 345.782 4.121 20 0 EIADMM CCOc1cc(C(=O)N2CCCc3cc(F)ccc32)cc(Cl)c1[O-] ZINC000186643323 1022714326 /nfs/dbraw/zinc/71/43/26/1022714326.db2.gz SKSLFOTUOHGLQZ-UHFFFAOYSA-N -1 1 349.789 4.176 20 0 EIADMM O=C(Nc1cc(Cl)c([O-])c2ccccc12)c1cnc2ccccc2n1 ZINC001167439739 1022732163 /nfs/dbraw/zinc/73/21/63/1022732163.db2.gz GPPHLHCBIYYKDV-UHFFFAOYSA-N -1 1 349.777 4.394 20 0 EIADMM CCOc1cc(C(=O)NC2(c3ccccc3F)CC2)cc(Cl)c1[O-] ZINC000186821237 1022761651 /nfs/dbraw/zinc/76/16/51/1022761651.db2.gz LQTXZEPPVMUPJV-UHFFFAOYSA-N -1 1 349.789 4.003 20 0 EIADMM Cc1csc(Nc2ccc(C(=O)Nc3ccc(F)cc3[O-])cc2)n1 ZINC000580982080 1022781722 /nfs/dbraw/zinc/78/17/22/1022781722.db2.gz MXQKFECEOGLTSB-UHFFFAOYSA-N -1 1 343.383 4.292 20 0 EIADMM O=C(Nc1cc(Cl)c([O-])c2ccccc12)c1ncoc1C1CC1 ZINC001167445518 1022829179 /nfs/dbraw/zinc/82/91/79/1022829179.db2.gz ZRHNWKYNZSHJQN-UHFFFAOYSA-N -1 1 328.755 4.317 20 0 EIADMM Cc1ccc(CN(C)C(=O)c2ccc(C(F)(F)F)cc2[O-])s1 ZINC000180501980 1023229442 /nfs/dbraw/zinc/22/94/42/1023229442.db2.gz FXKIBJAUEPOOCK-UHFFFAOYSA-N -1 1 329.343 4.053 20 0 EIADMM O=C(Nc1cccc(C(=O)c2ccccc2)c1)c1ccc([O-])cc1F ZINC000181200435 1023235008 /nfs/dbraw/zinc/23/50/08/1023235008.db2.gz DVPFRWNYPKSPMV-UHFFFAOYSA-N -1 1 335.334 4.015 20 0 EIADMM C[C@@H](CCSc1ccccc1)N1Cc2ccc(C(=O)[O-])cc2C1 ZINC000659790784 1023271542 /nfs/dbraw/zinc/27/15/42/1023271542.db2.gz MSLHVLCWSKEGGN-AWEZNQCLSA-N -1 1 327.449 4.271 20 0 EIADMM Cc1oc(-c2cccs2)nc1C(=O)[N-]c1c(F)cc(F)cc1F ZINC000072507217 1023296954 /nfs/dbraw/zinc/29/69/54/1023296954.db2.gz IBHZPVTUZCUORK-UHFFFAOYSA-N -1 1 338.310 4.381 20 0 EIADMM CCCc1csc(CN[C@H](CC(=O)[O-])c2cccc(C)c2C)n1 ZINC000417567097 1023359925 /nfs/dbraw/zinc/35/99/25/1023359925.db2.gz IVQUXQUPUIYLMH-MRXNPFEDSA-N -1 1 332.469 4.018 20 0 EIADMM CC(C)c1ccc([C@H](CC(=O)[O-])NCc2ccc(F)cc2F)cc1 ZINC000584875384 1023411112 /nfs/dbraw/zinc/41/11/12/1023411112.db2.gz CRWHRFVVCJKXJN-SFHVURJKSA-N -1 1 333.378 4.394 20 0 EIADMM CCc1cc([N-]S(=O)(=O)c2ccc(C(F)F)cc2)ccc1C ZINC000581629443 1023455897 /nfs/dbraw/zinc/45/58/97/1023455897.db2.gz SYVXHTIOQAATFH-UHFFFAOYSA-N -1 1 325.380 4.296 20 0 EIADMM CC(C)c1cccc(S(=O)(=O)[N-]c2cccc(OC(F)F)c2)c1 ZINC000460422519 1023527139 /nfs/dbraw/zinc/52/71/39/1023527139.db2.gz ATQNGGOFYSJFPQ-UHFFFAOYSA-N -1 1 341.379 4.212 20 0 EIADMM O=C([O-])c1ccc(CNCc2ccc(-c3ccccc3F)s2)o1 ZINC000756284735 1023623820 /nfs/dbraw/zinc/62/38/20/1023623820.db2.gz AZKHCFVNWJRAQM-UHFFFAOYSA-N -1 1 331.368 4.135 20 0 EIADMM CCOc1cc(-c2noc(/C=C/c3cscn3)n2)cc(Cl)c1[O-] ZINC000581765197 1023696548 /nfs/dbraw/zinc/69/65/48/1023696548.db2.gz IVVLGOYYMHQNNF-ONEGZZNKSA-N -1 1 349.799 4.121 20 0 EIADMM CC[C@@H](C)Oc1ccc([N-]S(=O)(=O)c2cccc(Cl)c2)cc1 ZINC000511696049 1023829202 /nfs/dbraw/zinc/82/92/02/1023829202.db2.gz TXWKRTFIUSETBG-GFCCVEGCSA-N -1 1 339.844 4.318 20 0 EIADMM Cc1cc(F)cc(C)c1S(=O)(=O)[N-]c1ccccc1C(F)(F)F ZINC000323470738 1024007692 /nfs/dbraw/zinc/00/76/92/1024007692.db2.gz XZTIUOYUAIMHJX-UHFFFAOYSA-N -1 1 347.333 4.262 20 0 EIADMM CSc1cccc([N-]S(=O)(=O)c2ccc(C)c(Cl)c2)c1 ZINC000048652521 1024670994 /nfs/dbraw/zinc/67/09/94/1024670994.db2.gz HDIZOAKNNRWGKQ-UHFFFAOYSA-N -1 1 327.858 4.171 20 0 EIADMM CSc1ccccc1CSc1nc([O-])cc(=O)n1C1CCCC1 ZINC000511919573 1024783644 /nfs/dbraw/zinc/78/36/44/1024783644.db2.gz NRYARGNMKWZTHP-UHFFFAOYSA-N -1 1 348.493 4.078 20 0 EIADMM CSc1ccccc1CSc1nc(=O)cc([O-])n1C1CCCC1 ZINC000511919573 1024783665 /nfs/dbraw/zinc/78/36/65/1024783665.db2.gz NRYARGNMKWZTHP-UHFFFAOYSA-N -1 1 348.493 4.078 20 0 EIADMM CC[C@]1(C)CCN(Cc2csc(-c3ccc(C(=O)[O-])cc3)n2)C1 ZINC000652431868 1024828221 /nfs/dbraw/zinc/82/82/21/1024828221.db2.gz SCLAQRCIMKQUIQ-GOSISDBHSA-N -1 1 330.453 4.130 20 0 EIADMM O=C(NCC(C1CCC1)C1CCC1)c1c([O-])cnc2c(F)cccc21 ZINC001167787298 1024868870 /nfs/dbraw/zinc/86/88/70/1024868870.db2.gz IGCBJXWIMJLTCY-UHFFFAOYSA-N -1 1 342.414 4.026 20 0 EIADMM O=C([O-])[C@H](NCc1ccc(-c2ccccc2)cc1)c1ccccc1F ZINC000426784695 1024877824 /nfs/dbraw/zinc/87/78/24/1024877824.db2.gz NIXMALOOKYJNOR-HXUWFJFHSA-N -1 1 335.378 4.408 20 0 EIADMM [O-]c1ccc(Oc2ccccc2)cc1-c1nc(-c2ccccn2)no1 ZINC000184838553 1024982178 /nfs/dbraw/zinc/98/21/78/1024982178.db2.gz GWVIUEGHECDIPA-UHFFFAOYSA-N -1 1 331.331 4.297 20 0 EIADMM CCO[C@H](C)c1ncc(C(=O)[N-]c2c(F)cc(Cl)cc2F)s1 ZINC000342078846 1025145349 /nfs/dbraw/zinc/14/53/49/1025145349.db2.gz XJBRMJXQYFGDAM-SSDOTTSWSA-N -1 1 346.786 4.425 20 0 EIADMM Cc1cnc(C(=O)N([C@@H](C)c2ccccc2Cl)C2CC2)c([O-])c1 ZINC000426627023 1025809433 /nfs/dbraw/zinc/80/94/33/1025809433.db2.gz ZETZMNBJLDDESP-LBPRGKRZSA-N -1 1 330.815 4.115 20 0 EIADMM O=C([O-])CC[C@H]1CCCN(Cc2ncc(-c3ccc(Cl)cc3)o2)C1 ZINC000324570753 1026059803 /nfs/dbraw/zinc/05/98/03/1026059803.db2.gz CLVMTBARIDYDRF-CYBMUJFWSA-N -1 1 348.830 4.072 20 0 EIADMM COc1cc([N-]S(=O)(=O)c2ccc3ccccc3c2)ccc1Cl ZINC000432472629 1026112687 /nfs/dbraw/zinc/11/26/87/1026112687.db2.gz OXOPWHOAWFRJAR-UHFFFAOYSA-N -1 1 347.823 4.303 20 0 EIADMM O=S(=O)([N-]c1ccc(F)nc1)c1ccc(C2CCCCC2)cc1 ZINC000391027230 1026304762 /nfs/dbraw/zinc/30/47/62/1026304762.db2.gz KXDGIWAUMMWMME-UHFFFAOYSA-N -1 1 334.416 4.069 20 0 EIADMM COc1ccc(Cl)cc1CSc1nc(C(F)F)cc(=O)[n-]1 ZINC000582270039 1026397190 /nfs/dbraw/zinc/39/71/90/1026397190.db2.gz FYJQGYPQAZDYIU-UHFFFAOYSA-N -1 1 332.759 4.074 20 0 EIADMM Cc1cc(F)ccc1-c1ccc(CNCc2ccc(C(=O)[O-])cc2)o1 ZINC000426713550 1026496628 /nfs/dbraw/zinc/49/66/28/1026496628.db2.gz HUNNSAIJKMBQNC-UHFFFAOYSA-N -1 1 339.366 4.382 20 0 EIADMM O=C([O-])[C@@H](NCc1ccc(Cl)cc1F)c1ccc(Cl)c(F)c1 ZINC000426754547 1026540599 /nfs/dbraw/zinc/54/05/99/1026540599.db2.gz RCHFPDRJGXMNLU-AWEZNQCLSA-N -1 1 346.160 4.187 20 0 EIADMM Cc1cc(C(F)(F)F)ccc1CN[C@@H](C(=O)[O-])c1ccccc1F ZINC000426779713 1026556647 /nfs/dbraw/zinc/55/66/47/1026556647.db2.gz KOHUTCSLXJMFER-OAHLLOKOSA-N -1 1 341.304 4.068 20 0 EIADMM O=C([O-])[C@@H](NCc1cc(C(F)(F)F)ccc1Cl)c1ccsc1 ZINC000426783748 1026559031 /nfs/dbraw/zinc/55/90/31/1026559031.db2.gz NGUGMLWASBSESY-LBPRGKRZSA-N -1 1 349.761 4.336 20 0 EIADMM O=C([O-])[C@@H](NCc1ccc(-c2ccccc2)s1)c1cccs1 ZINC000426804305 1026571368 /nfs/dbraw/zinc/57/13/68/1026571368.db2.gz SZIBROHIAXVBJD-INIZCTEOSA-N -1 1 329.446 4.392 20 0 EIADMM CCOc1ccccc1NC(=O)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684871086 1026634975 /nfs/dbraw/zinc/63/49/75/1026634975.db2.gz STEMKFMPFSVLDG-UHFFFAOYSA-N -1 1 325.286 4.062 20 0 EIADMM O=C(c1ccc(C(F)(F)F)c([O-])c1)N1CCC[C@@H]1C1CCCC1 ZINC000684872407 1026638123 /nfs/dbraw/zinc/63/81/23/1026638123.db2.gz DZHCVQXERXNZHG-CQSZACIVSA-N -1 1 327.346 4.206 20 0 EIADMM CCN(C(=O)c1ccc(C(F)(F)F)c([O-])c1)[C@@H](C)c1cccnc1 ZINC000684874145 1026642965 /nfs/dbraw/zinc/64/29/65/1026642965.db2.gz LWWBOKUGTCWLOV-NSHDSACASA-N -1 1 338.329 4.029 20 0 EIADMM CC[C@H](NC(=O)c1ccc(C(F)(F)F)c([O-])c1)c1nc(C)cs1 ZINC000684874240 1026643398 /nfs/dbraw/zinc/64/33/98/1026643398.db2.gz RUCFDSPXAMHKST-NSHDSACASA-N -1 1 344.358 4.057 20 0 EIADMM O=C(c1ccc(C(F)(F)F)c([O-])c1)N1CC[C@@H](Cc2ccccc2)C1 ZINC000684875283 1026648935 /nfs/dbraw/zinc/64/89/35/1026648935.db2.gz DYRGFFMDSRZGLL-AWEZNQCLSA-N -1 1 349.352 4.116 20 0 EIADMM C[C@@H]1CN(C(=O)c2ccc(C(F)(F)F)c([O-])c2)[C@H]1c1ccccc1 ZINC000684876071 1026653307 /nfs/dbraw/zinc/65/33/07/1026653307.db2.gz PKOKXQWDUNQZTF-BDJLRTHQSA-N -1 1 335.325 4.244 20 0 EIADMM COc1c(Br)cc(F)cc1Nc1ccnc(Cl)c1[O-] ZINC001211710211 1026687988 /nfs/dbraw/zinc/68/79/88/1026687988.db2.gz HTWOWZKKNOLCFB-UHFFFAOYSA-N -1 1 347.571 4.094 20 0 EIADMM O=C(N[C@H](c1cc2ccccc2o1)c1ccccc1)c1cncc([O-])c1 ZINC000548740674 1026741749 /nfs/dbraw/zinc/74/17/49/1026741749.db2.gz KTODZGOKPHADBT-FQEVSTJZSA-N -1 1 344.370 4.053 20 0 EIADMM CCCc1nc(-c2nc3sc4c(c3c(=O)[n-]2)CCCCC4)co1 ZINC000582584876 1026832889 /nfs/dbraw/zinc/83/28/89/1026832889.db2.gz VHZOECRMCRZQFA-UHFFFAOYSA-N -1 1 329.425 4.273 20 0 EIADMM O=C([N-]c1nc(-c2cccc(Cl)c2)ns1)c1ccc(F)s1 ZINC001125609827 1026852841 /nfs/dbraw/zinc/85/28/41/1026852841.db2.gz HLWUXYBXQOHQGK-UHFFFAOYSA-N -1 1 339.804 4.311 20 0 EIADMM COc1ccccc1[C@H]1CCN(C(=O)c2cc3ccccc3cc2[O-])C1 ZINC000153009351 1026941168 /nfs/dbraw/zinc/94/11/68/1026941168.db2.gz PCDHQNNUHYPQLD-KRWDZBQOSA-N -1 1 347.414 4.184 20 0 EIADMM CC(C)(C)n1cc([N-]c2nn3cc(C4CCCC4)nc3s2)cn1 ZINC000302384308 1027302300 /nfs/dbraw/zinc/30/23/00/1027302300.db2.gz AKGRBXUVTOWLMZ-UHFFFAOYSA-N -1 1 330.461 4.144 20 0 EIADMM CCC(C)(C)[C@H]1CCCN1C(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC000443058380 1027339495 /nfs/dbraw/zinc/33/94/95/1027339495.db2.gz KLEQXJUTZJCAPK-CQSZACIVSA-N -1 1 325.836 4.095 20 0 EIADMM Cc1nc(-c2ccc(N[C@H](C)CCCC(C)C)nc2)[n-]c(=O)c1C ZINC000302708327 1027365964 /nfs/dbraw/zinc/36/59/64/1027365964.db2.gz CTKJNZONTHVLMY-CYBMUJFWSA-N -1 1 328.460 4.488 20 0 EIADMM Cc1ccc(F)cc1S(=O)(=O)[N-]c1cccc(OC2CCCC2)c1 ZINC000614784534 1027686043 /nfs/dbraw/zinc/68/60/43/1027686043.db2.gz NZQPOUIVMJGQCY-UHFFFAOYSA-N -1 1 349.427 4.256 20 0 EIADMM CC(C)c1ccc(C[C@@H](C)NC(=O)c2c(F)ccc([O-])c2F)cc1 ZINC000582931725 1027713836 /nfs/dbraw/zinc/71/38/36/1027713836.db2.gz BXZNTXHZWQYKEV-GFCCVEGCSA-N -1 1 333.378 4.155 20 0 EIADMM CCOc1cc(-c2noc([C@@H]3CC[C@H](CC)O3)n2)cc(Cl)c1[O-] ZINC000278144459 1028296031 /nfs/dbraw/zinc/29/60/31/1028296031.db2.gz UAWPDDKZELZLPY-JQWIXIFHSA-N -1 1 338.791 4.124 20 0 EIADMM O=C(NC(c1cccs1)c1cccs1)c1ccc([O-])cc1F ZINC000154911504 1028319137 /nfs/dbraw/zinc/31/91/37/1028319137.db2.gz NCSFLZOUFRRNDF-UHFFFAOYSA-N -1 1 333.409 4.174 20 0 EIADMM CCOc1cc(-c2noc([C@H](C)C(F)(F)F)n2)cc(Cl)c1[O-] ZINC000445412154 1028510381 /nfs/dbraw/zinc/51/03/81/1028510381.db2.gz MCAPEZCTQQSHDI-LURJTMIESA-N -1 1 336.697 4.160 20 0 EIADMM CCOc1cc(-c2noc(-c3cccc(OC)c3)n2)cc(Cl)c1[O-] ZINC000445425852 1028520867 /nfs/dbraw/zinc/52/08/67/1028520867.db2.gz GFMQKRNAYUDLKF-UHFFFAOYSA-N -1 1 346.770 4.170 20 0 EIADMM C[C@@H](Oc1cccc(F)c1)c1nc(-c2ccc([O-])cc2Cl)no1 ZINC000445446993 1028534953 /nfs/dbraw/zinc/53/49/53/1028534953.db2.gz NOAQWOGICOILHZ-SECBINFHSA-N -1 1 334.734 4.375 20 0 EIADMM [O-]c1ccc(-c2noc(C(F)(F)c3ccccc3F)n2)c(Cl)c1 ZINC000445449832 1028537202 /nfs/dbraw/zinc/53/72/02/1028537202.db2.gz PUDBJGODAWPKQF-UHFFFAOYSA-N -1 1 340.688 4.375 20 0 EIADMM [O-]c1ccc(-c2noc(Cc3c(F)cccc3Cl)n2)c(Cl)c1 ZINC000445449151 1028537659 /nfs/dbraw/zinc/53/76/59/1028537659.db2.gz NWSAKYDYWBFXAD-UHFFFAOYSA-N -1 1 339.153 4.479 20 0 EIADMM Cc1ccc(OCc2nc(-c3ccc([O-])cc3Cl)no2)c(C)c1 ZINC000445449742 1028538633 /nfs/dbraw/zinc/53/86/33/1028538633.db2.gz ZJZOWYAFGXBSEI-UHFFFAOYSA-N -1 1 330.771 4.291 20 0 EIADMM COc1cccc(/C=C\c2nc(-c3ccc([O-])cc3Cl)no2)c1 ZINC000445450029 1028541637 /nfs/dbraw/zinc/54/16/37/1028541637.db2.gz QHLGUIAOAHFGJC-YVMONPNESA-N -1 1 328.755 4.275 20 0 EIADMM [O-]c1ccc(-c2noc(C3(c4ccccc4F)CC3)n2)c(Cl)c1 ZINC000445450473 1028542025 /nfs/dbraw/zinc/54/20/25/1028542025.db2.gz TZPHSPIZPVOCAV-UHFFFAOYSA-N -1 1 330.746 4.315 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cc4cc(F)ccc4[nH]3)n2)c(Cl)c1 ZINC000445443652 1028568698 /nfs/dbraw/zinc/56/86/98/1028568698.db2.gz CWHFEYUEJNVSNP-UHFFFAOYSA-N -1 1 329.718 4.383 20 0 EIADMM COc1ccc([C@H](C)c2nc(-c3ccc([O-])cc3Cl)no2)cc1 ZINC000445445245 1028577008 /nfs/dbraw/zinc/57/70/08/1028577008.db2.gz LOCSILCKRFIDAV-JTQLQIEISA-N -1 1 330.771 4.256 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cccc(Oc4ccncc4)c3)n2)c(F)c1 ZINC000445454133 1028607242 /nfs/dbraw/zinc/60/72/42/1028607242.db2.gz KPYOZXOKPFDHMU-UHFFFAOYSA-N -1 1 349.321 4.436 20 0 EIADMM COc1ccccc1C[C@@H](C)Cc1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445478564 1028625198 /nfs/dbraw/zinc/62/51/98/1028625198.db2.gz CZVDXLPCIQZUSC-GFCCVEGCSA-N -1 1 342.370 4.011 20 0 EIADMM Cc1c2cc(F)ccc2oc1-c1nc(-c2ccc([O-])c(F)c2)no1 ZINC000445479214 1028627017 /nfs/dbraw/zinc/62/70/17/1028627017.db2.gz JFDMJQYHGGFHLE-UHFFFAOYSA-N -1 1 328.274 4.442 20 0 EIADMM [O-]c1ccc(-c2noc([C@@H]3C[C@H]3c3c(F)cccc3F)n2)cc1F ZINC000445474180 1028644727 /nfs/dbraw/zinc/64/47/27/1028644727.db2.gz XIIZUXQRNSYOIC-NXEZZACHSA-N -1 1 332.281 4.131 20 0 EIADMM Cc1cc(N)c(Nc2cc(F)c([O-])c(F)c2)c(Br)c1 ZINC001213384310 1028727988 /nfs/dbraw/zinc/72/79/88/1028727988.db2.gz FQKGCUNQZHOXLT-UHFFFAOYSA-N -1 1 329.144 4.067 20 0 EIADMM [O-]c1c(-c2nc(-c3ccc4cc[nH]c4n3)no2)ccc2ccccc21 ZINC000445584801 1028745773 /nfs/dbraw/zinc/74/57/73/1028745773.db2.gz USUUUHDYDGFXKB-UHFFFAOYSA-N -1 1 328.331 4.139 20 0 EIADMM O=C(Nc1cc(Cl)cc(Cl)c1[O-])c1cn[nH]c1-c1ccccc1 ZINC000536141188 1029257201 /nfs/dbraw/zinc/25/72/01/1029257201.db2.gz OOFBHBKLEXSNBX-UHFFFAOYSA-N -1 1 348.189 4.341 20 0 EIADMM CCOc1cc(C(=O)Nc2cnn(C3CCCC3)c2)cc(Cl)c1[O-] ZINC000928796046 1029564584 /nfs/dbraw/zinc/56/45/84/1029564584.db2.gz IMJYDNUGADQHTE-UHFFFAOYSA-N -1 1 349.818 4.008 20 0 EIADMM Cc1nc(-c2ccc(NCC3(c4ccccc4)CC3)nc2)[n-]c(=O)c1C ZINC000301151838 1029677912 /nfs/dbraw/zinc/67/79/12/1029677912.db2.gz ATRCWMXFUGGEBW-UHFFFAOYSA-N -1 1 346.434 4.005 20 0 EIADMM Cc1nc(-c2ccc(NC[C@@H]3CCCC[C@@H]3C)nc2)[n-]c(=O)c1C ZINC000301349195 1029713785 /nfs/dbraw/zinc/71/37/85/1029713785.db2.gz IFNAZKZENICOCK-WFASDCNBSA-N -1 1 326.444 4.099 20 0 EIADMM Cc1nc(-c2ccc(N3CCC[C@H]3c3ccccc3)nc2)[n-]c(=O)c1C ZINC000301519484 1029748629 /nfs/dbraw/zinc/74/86/29/1029748629.db2.gz KTNIBSAEGVKJCI-SFHVURJKSA-N -1 1 346.434 4.203 20 0 EIADMM COC[C@H]([N-]c1nc(C(C)C)no1)c1cccc(C(F)(F)F)c1 ZINC000301736837 1029801834 /nfs/dbraw/zinc/80/18/34/1029801834.db2.gz BPRARBBZMXKAAU-LBPRGKRZSA-N -1 1 329.322 4.011 20 0 EIADMM Cc1c(=O)[n-]c(SC[C@@H]2CCO[C@@H](C)C2)nc1-c1ccccc1 ZINC000447284278 1029963214 /nfs/dbraw/zinc/96/32/14/1029963214.db2.gz FCYOOEIKUAGYJY-GXTWGEPZSA-N -1 1 330.453 4.065 20 0 EIADMM CC1(C)[C@H](c2ccc(F)cc2)CCN1C(=O)c1ccc([O-])c(F)c1 ZINC000529943446 1030000892 /nfs/dbraw/zinc/00/08/92/1030000892.db2.gz FLSAGLXXOHWQIZ-HNNXBMFYSA-N -1 1 331.362 4.079 20 0 EIADMM Cc1noc(C2CC2)c1[N-]C(=O)c1nc(-c2ccccc2)cs1 ZINC000183935143 1030046159 /nfs/dbraw/zinc/04/61/59/1030046159.db2.gz FNSXBKJBODEAKX-UHFFFAOYSA-N -1 1 325.393 4.236 20 0 EIADMM CCc1cc(=O)[n-]c(SCc2ccc(C)cc2Br)n1 ZINC000450908693 1030099309 /nfs/dbraw/zinc/09/93/09/1030099309.db2.gz MONLWUANSFBQQH-UHFFFAOYSA-N -1 1 339.258 4.108 20 0 EIADMM COc1cc(C(=O)Nc2ccc(C(F)(F)F)cc2)cc(Cl)c1[O-] ZINC000525952985 1030124639 /nfs/dbraw/zinc/12/46/39/1030124639.db2.gz XFXUIWIYFGAVHL-UHFFFAOYSA-N -1 1 345.704 4.325 20 0 EIADMM Cc1cc(Cl)ccc1C1=CCN(Cc2ccoc2C(=O)[O-])CC1 ZINC000530173759 1030194312 /nfs/dbraw/zinc/19/43/12/1030194312.db2.gz ZOLCDDHGDNXAFX-UHFFFAOYSA-N -1 1 331.799 4.229 20 0 EIADMM C[C@H]1CC(C(=O)[O-])C[C@H](C)N1Cc1nc(C2CCCCC2)cs1 ZINC000530175869 1030196192 /nfs/dbraw/zinc/19/61/92/1030196192.db2.gz QFRHDRZEAQPXHN-STQMWFEESA-N -1 1 336.501 4.264 20 0 EIADMM CCOc1cc(C(=O)N2CCC[C@@]3(CC=CCC3)C2)cc(Cl)c1[O-] ZINC000186813023 1030309707 /nfs/dbraw/zinc/30/97/07/1030309707.db2.gz IHXMGWCVWVBMCD-IBGZPJMESA-N -1 1 349.858 4.407 20 0 EIADMM COc1cc(C(=O)N(C)[C@@H]2CCCc3ccccc32)cc(Cl)c1[O-] ZINC000526945541 1030339746 /nfs/dbraw/zinc/33/97/46/1030339746.db2.gz VBZQYLPXALAPKD-MRXNPFEDSA-N -1 1 345.826 4.204 20 0 EIADMM Cn1cc(C=C2SC(=S)[N-]C2=O)c(-c2cc3ccccc3o2)n1 ZINC000063275041 1030439432 /nfs/dbraw/zinc/43/94/32/1030439432.db2.gz YJEOKRUVQVVYTG-QPEQYQDCSA-N -1 1 341.417 4.162 20 0 EIADMM Cc1nc(-c2cccc(NC(=O)Nc3ccc([O-])c(Cl)c3)c2)no1 ZINC000190953199 1030590049 /nfs/dbraw/zinc/59/00/49/1030590049.db2.gz LZZLBACDGFAMHP-UHFFFAOYSA-N -1 1 344.758 4.048 20 0 EIADMM O=C([O-])CC[C@H]1CCCN(Cc2csc(-c3ccccc3F)n2)C1 ZINC000263137880 1030595411 /nfs/dbraw/zinc/59/54/11/1030595411.db2.gz NVJSXROZSNTLFK-CYBMUJFWSA-N -1 1 348.443 4.026 20 0 EIADMM Cc1nc2ccc([N-]S(=O)(=O)c3ccc4ccccc4c3)cc2o1 ZINC000073957078 1030809692 /nfs/dbraw/zinc/80/96/92/1030809692.db2.gz OAJAPCFFDOWHAN-UHFFFAOYSA-N -1 1 338.388 4.090 20 0 EIADMM Cc1cccc(S(=O)(=O)[N-]c2cc(-c3cccnc3)ccc2C)c1 ZINC000475836283 1030863514 /nfs/dbraw/zinc/86/35/14/1030863514.db2.gz UVOCPJACODTVOD-UHFFFAOYSA-N -1 1 338.432 4.166 20 0 EIADMM COc1cccc(C=C2CCN(Cc3cccc(C(=O)[O-])c3)CC2)c1 ZINC000263457920 1030878626 /nfs/dbraw/zinc/87/86/26/1030878626.db2.gz HWOUXVNRJWZFTG-UHFFFAOYSA-N -1 1 337.419 4.073 20 0 EIADMM CN(CCC(C)(C)C)Cc1ccc(C(=O)[O-])cc1Br ZINC000399806910 1031180686 /nfs/dbraw/zinc/18/06/86/1031180686.db2.gz ZCPVUBAAGWFUSA-UHFFFAOYSA-N -1 1 328.250 4.015 20 0 EIADMM Cc1cc(C(C)(C)C)cc(C)c1CS(=O)(=O)c1ccc([O-])cc1 ZINC000063927463 1031269190 /nfs/dbraw/zinc/26/91/90/1031269190.db2.gz YSUNRBZQJGVVTD-UHFFFAOYSA-N -1 1 332.465 4.280 20 0 EIADMM O=C(Nc1ccc(F)cc1[O-])c1ccc(Br)cc1Cl ZINC000531756398 1031534181 /nfs/dbraw/zinc/53/41/81/1031534181.db2.gz AVTPGVGFUKQZCD-UHFFFAOYSA-N -1 1 344.567 4.200 20 0 EIADMM CCCOc1ccc(S(=O)(=O)[N-]c2ccc(Cl)c(F)c2)cc1 ZINC000614827243 1031598919 /nfs/dbraw/zinc/59/89/19/1031598919.db2.gz JAKRLMDVAGHMNB-UHFFFAOYSA-N -1 1 343.807 4.069 20 0 EIADMM CN(Cc1nc2ccccc2o1)Cc1cc(Cl)cc(Cl)c1[O-] ZINC000093339136 1031947623 /nfs/dbraw/zinc/94/76/23/1031947623.db2.gz QRINZQMTMCYSCD-UHFFFAOYSA-N -1 1 337.206 4.472 20 0 EIADMM O=C(C[C@@H](c1ccccc1)C(F)(F)F)Nc1ccc(F)cc1[O-] ZINC000532012648 1031974396 /nfs/dbraw/zinc/97/43/96/1031974396.db2.gz FLXWADHGLBNDFE-LBPRGKRZSA-N -1 1 327.277 4.206 20 0 EIADMM O=C(Nc1ccc(F)cc1[O-])c1cc(-c2ccc(Cl)cc2)on1 ZINC000532012789 1031974938 /nfs/dbraw/zinc/97/49/38/1031974938.db2.gz DWNKMWIXETUYPU-UHFFFAOYSA-N -1 1 332.718 4.092 20 0 EIADMM COc1cc(C(=O)Nc2ccc(F)cc2[O-])ccc1OC1CCCC1 ZINC000532012753 1031976154 /nfs/dbraw/zinc/97/61/54/1031976154.db2.gz BIZSICUURMXYHQ-UHFFFAOYSA-N -1 1 345.370 4.114 20 0 EIADMM CCc1nnc(-c2cccc(NCc3cccc([O-])c3Cl)c2)o1 ZINC000645166995 1033950725 /nfs/dbraw/zinc/95/07/25/1033950725.db2.gz UQWFKPNWYAOBOS-UHFFFAOYSA-N -1 1 329.787 4.270 20 0 EIADMM O=C([N-]c1nnc(C(F)F)s1)c1occc1-c1ccc(F)cc1 ZINC000161161908 1034821874 /nfs/dbraw/zinc/82/18/74/1034821874.db2.gz KVJKENCIQAWGGE-UHFFFAOYSA-N -1 1 339.298 4.127 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2ccc(C)c(OC(F)F)c2)c(C)s1 ZINC000513383280 1034899009 /nfs/dbraw/zinc/89/90/09/1034899009.db2.gz IXRFZISVXAPQSG-UHFFFAOYSA-N -1 1 347.408 4.076 20 0 EIADMM Cc1cc(C)cc(CN(C)c2ccc(-c3nc(C)c(C)c(=O)[n-]3)cn2)c1 ZINC000433814306 1034934722 /nfs/dbraw/zinc/93/47/22/1034934722.db2.gz VDFPIENOEBAVMN-UHFFFAOYSA-N -1 1 348.450 4.114 20 0 EIADMM CCc1onc(C)c1[N-]C(=O)c1c(C)onc1-c1ccccc1C ZINC000280374545 1035245765 /nfs/dbraw/zinc/24/57/65/1035245765.db2.gz OVWVBEFHDNOLIN-UHFFFAOYSA-N -1 1 325.368 4.070 20 0 EIADMM Cc1ccc([C@H]2CC[N@@H+](Cc3nc(=O)c4sccc4[n-]3)C2)c(C)c1 ZINC000280643765 1035310308 /nfs/dbraw/zinc/31/03/08/1035310308.db2.gz ZQGUBGOHCGKZLV-AWEZNQCLSA-N -1 1 339.464 4.003 20 0 EIADMM Cc1ccc([C@H]2CCN(Cc3nc(=O)c4sccc4[n-]3)C2)c(C)c1 ZINC000280643765 1035310315 /nfs/dbraw/zinc/31/03/15/1035310315.db2.gz ZQGUBGOHCGKZLV-AWEZNQCLSA-N -1 1 339.464 4.003 20 0 EIADMM C[C@@H](C(=O)Nc1ccc(F)cc1[O-])c1ccc(Br)cc1 ZINC000501740810 1035555696 /nfs/dbraw/zinc/55/56/96/1035555696.db2.gz WAVVLKVHGHONCN-SECBINFHSA-N -1 1 338.176 4.036 20 0 EIADMM Cc1cc(CN2CCC([C@@H](F)c3ccccc3F)CC2)oc1C(=O)[O-] ZINC000572016973 1036395410 /nfs/dbraw/zinc/39/54/10/1036395410.db2.gz PSLDUPGCDNTZIO-QGZVFWFLSA-N -1 1 349.377 4.348 20 0 EIADMM CO[C@@H](C)c1cccc([N-]S(=O)(=O)c2ccc(CC(C)C)cc2)c1 ZINC000588833545 1036543830 /nfs/dbraw/zinc/54/38/30/1036543830.db2.gz PHOQYVGEEBFUBZ-HNNXBMFYSA-N -1 1 347.480 4.393 20 0 EIADMM CC(C)(C)c1csc(NC(=O)Nc2ccc([O-])c(Cl)c2)n1 ZINC000486180849 1036550155 /nfs/dbraw/zinc/55/01/55/1036550155.db2.gz TWQLPJMMLYCLTB-UHFFFAOYSA-N -1 1 325.821 4.444 20 0 EIADMM COc1ccc([N-]S(=O)(=O)c2ccc(Cl)c(Cl)c2)c(C)c1 ZINC000589149050 1036689007 /nfs/dbraw/zinc/68/90/07/1036689007.db2.gz ILDWOUPUSKOXOR-UHFFFAOYSA-N -1 1 346.235 4.111 20 0 EIADMM Cc1nc(-c2ccc([N-]S(=O)(=O)c3ccccc3C)cc2)oc1C ZINC000589433537 1036800234 /nfs/dbraw/zinc/80/02/34/1036800234.db2.gz BJIIUWRONZJHJS-UHFFFAOYSA-N -1 1 342.420 4.068 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1CCC[C@H](CC(F)(F)F)C1 ZINC000421933915 1036852366 /nfs/dbraw/zinc/85/23/66/1036852366.db2.gz BDGCRSPPZQSPJP-GFCCVEGCSA-N -1 1 337.341 4.350 20 0 EIADMM CC[C@H](CC(F)(F)F)[N-]C(=O)C(F)(F)c1cccc(Cl)c1 ZINC000760765131 1037003268 /nfs/dbraw/zinc/00/32/68/1037003268.db2.gz IPGXTEVLYUIVMI-SNVBAGLBSA-N -1 1 329.696 4.279 20 0 EIADMM S=c1[n-]nc(CCC2CCCC2)n1CN1CCc2sccc2C1 ZINC000058205333 1037585367 /nfs/dbraw/zinc/58/53/67/1037585367.db2.gz ZGLPUXSPYWFWMF-UHFFFAOYSA-N -1 1 348.541 4.141 20 0 EIADMM O=C([O-])c1ccc(Cl)c(CN2CCC(c3ccsc3)CC2)c1 ZINC000573615646 1037602458 /nfs/dbraw/zinc/60/24/58/1037602458.db2.gz ABMMAHJSXFGWSJ-UHFFFAOYSA-N -1 1 335.856 4.479 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1CCS[C@H](c2ccccc2)C1 ZINC000605106892 1037672361 /nfs/dbraw/zinc/67/23/61/1037672361.db2.gz ANLSJODXSBGLSO-IBGZPJMESA-N -1 1 349.455 4.476 20 0 EIADMM Cc1cc(C)cc(CNc2ccc(-c3nc(C)c(C)c(=O)[n-]3)cn2)c1 ZINC000664319330 1037767368 /nfs/dbraw/zinc/76/73/68/1037767368.db2.gz INNGCUMJSQSAHK-UHFFFAOYSA-N -1 1 334.423 4.090 20 0 EIADMM O=C(Nc1c([O-])cccc1F)c1cnc(-c2ccccc2F)s1 ZINC000605440162 1037787705 /nfs/dbraw/zinc/78/77/05/1037787705.db2.gz LUGARWJYJSPHHK-UHFFFAOYSA-N -1 1 332.331 4.046 20 0 EIADMM Cc1cc(Br)c([O-])c(NC(=O)[C@H]2CCCC(F)(F)C2)c1 ZINC000503543222 1037802713 /nfs/dbraw/zinc/80/27/13/1037802713.db2.gz JGDFARFSPVGVQH-VIFPVBQESA-N -1 1 348.187 4.227 20 0 EIADMM CC(C)n1cc2cc([N-]S(=O)(=O)c3cccc(Cl)c3)ccc2n1 ZINC000605615331 1037842316 /nfs/dbraw/zinc/84/23/16/1037842316.db2.gz YIIVTFCCYMMHIB-UHFFFAOYSA-N -1 1 349.843 4.071 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1CC2(CCC2)[C@H]1c1cccnc1 ZINC000912038726 1037871845 /nfs/dbraw/zinc/87/18/45/1037871845.db2.gz ACANXEUJVFHPMC-HXUWFJFHSA-N -1 1 344.414 4.308 20 0 EIADMM COc1ccc2nc(-c3ccc(-c4ccccc4)cc3)[n-]c(=O)c2c1 ZINC000592887758 1037874508 /nfs/dbraw/zinc/87/45/08/1037874508.db2.gz FJOAKXHGMDJAIZ-UHFFFAOYSA-N -1 1 328.371 4.266 20 0 EIADMM Cc1nnc(C(=O)[N-]c2cccc(Cl)c2SCC(F)F)s1 ZINC000668939907 1037920227 /nfs/dbraw/zinc/92/02/27/1037920227.db2.gz JTXHBDYCEKOTFD-UHFFFAOYSA-N -1 1 349.815 4.109 20 0 EIADMM Cc1ccc(OCc2nc(C=C3SC(=S)[N-]C3=O)cs2)cc1 ZINC000063275046 1038180231 /nfs/dbraw/zinc/18/02/31/1038180231.db2.gz AEMGIXFWSJSHFU-SDQBBNPISA-N -1 1 348.474 4.360 20 0 EIADMM CCCC[C@H](CC)CCCN(C)C(=O)c1cnc(C2CC2)[n-]c1=O ZINC000912764838 1038276710 /nfs/dbraw/zinc/27/67/10/1038276710.db2.gz MKRBEHLSDYEQQS-AWEZNQCLSA-N -1 1 333.476 4.128 20 0 EIADMM CCCC(C)(C)[N-]S(=O)(=O)c1c(Cl)cccc1C(F)(F)F ZINC000606904975 1038299248 /nfs/dbraw/zinc/29/92/48/1038299248.db2.gz NIJHYVHLCXXHSB-UHFFFAOYSA-N -1 1 343.798 4.216 20 0 EIADMM O=C(Nc1ccc(F)cc1[O-])[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000533971354 1038745293 /nfs/dbraw/zinc/74/52/93/1038745293.db2.gz VZKDSNYFQWRUSG-QWHCGFSZSA-N -1 1 339.288 4.292 20 0 EIADMM O=C(Nc1ccc(F)cc1[O-])[C@H]1C[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000533971353 1038745446 /nfs/dbraw/zinc/74/54/46/1038745446.db2.gz VZKDSNYFQWRUSG-OLZOCXBDSA-N -1 1 339.288 4.292 20 0 EIADMM C[C@@H]1CCc2[nH]c3ccc(C(=O)Nc4c([O-])cccc4F)cc3c2C1 ZINC000608365171 1038803266 /nfs/dbraw/zinc/80/32/66/1038803266.db2.gz AIFXXBWNBWJWNC-LLVKDONJSA-N -1 1 338.382 4.390 20 0 EIADMM O=C(Nc1c([O-])cccc1F)c1cc(-c2cccc(Cl)c2)on1 ZINC000608366753 1038805218 /nfs/dbraw/zinc/80/52/18/1038805218.db2.gz XPIWPFWJZIDURI-UHFFFAOYSA-N -1 1 332.718 4.092 20 0 EIADMM C[C@H]1CCCN(Cc2cc(Cl)cc(C(F)(F)F)c2)[C@@H]1C(=O)[O-] ZINC000424424874 1038844719 /nfs/dbraw/zinc/84/47/19/1038844719.db2.gz XPGICPBUMHDFCJ-ZANVPECISA-N -1 1 335.753 4.044 20 0 EIADMM CCC(C)(C)C1CCC(NC(=O)c2c(F)ccc([O-])c2F)CC1 ZINC000539121712 1038848191 /nfs/dbraw/zinc/84/81/91/1038848191.db2.gz FEKHYHKBAKCCEB-UHFFFAOYSA-N -1 1 325.399 4.395 20 0 EIADMM C[C@H]1CCCN(Cc2ccc(Cl)c(C(F)(F)F)c2)[C@@H]1C(=O)[O-] ZINC000424413227 1038851672 /nfs/dbraw/zinc/85/16/72/1038851672.db2.gz FIOIPHQRILXNEW-ZANVPECISA-N -1 1 335.753 4.044 20 0 EIADMM O=C(CCc1nc(-c2ccc([O-])cc2Cl)no1)c1ccc(F)cc1 ZINC000445448979 1038886101 /nfs/dbraw/zinc/88/61/01/1038886101.db2.gz MWFBRRURFPEEOE-UHFFFAOYSA-N -1 1 346.745 4.050 20 0 EIADMM CCCc1ccc(S(=O)(=O)[N-]c2ccc3[nH]c(C)cc3c2)cc1 ZINC000505064807 1038939071 /nfs/dbraw/zinc/93/90/71/1038939071.db2.gz HJCVKNWZCSLFAW-UHFFFAOYSA-N -1 1 328.437 4.230 20 0 EIADMM CC(C)c1ccc2nc(-c3cccc(OCC(F)F)n3)[n-]c(=O)c2c1 ZINC000534059166 1039078258 /nfs/dbraw/zinc/07/82/58/1039078258.db2.gz NMLMRSBYVYKPDU-UHFFFAOYSA-N -1 1 345.349 4.165 20 0 EIADMM Cc1cc(-c2nc(=O)c3sccc3[n-]2)cc(C)c1Br ZINC000477824969 1039120453 /nfs/dbraw/zinc/12/04/53/1039120453.db2.gz CZHIOSOETDISMX-UHFFFAOYSA-N -1 1 335.226 4.031 20 0 EIADMM CCSc1cccc([N-]S(=O)(=O)c2ccc(F)cc2C)c1 ZINC000505306738 1039209670 /nfs/dbraw/zinc/20/96/70/1039209670.db2.gz WTTRFLVPUDCYCB-UHFFFAOYSA-N -1 1 325.430 4.047 20 0 EIADMM C[C@H](C(=O)Nc1cc(Cl)c([O-])c2ccccc12)C(=O)OC(C)(C)C ZINC000600136108 1039313943 /nfs/dbraw/zinc/31/39/43/1039313943.db2.gz PKSHGXUOJXODCL-SNVBAGLBSA-N -1 1 349.814 4.115 20 0 EIADMM Cc1ccc(C(C)C)c(OCC(=O)Nc2ccc([O-])c(F)c2F)c1 ZINC000456793394 1039612527 /nfs/dbraw/zinc/61/25/27/1039612527.db2.gz LYPPCZLIUJZMBY-UHFFFAOYSA-N -1 1 335.350 4.120 20 0 EIADMM CC(C)CCc1ccc(S(=O)(=O)[N-]c2ncccc2Cl)cc1 ZINC000481918232 1039893186 /nfs/dbraw/zinc/89/31/86/1039893186.db2.gz DYPPZIMTQAHWQS-UHFFFAOYSA-N -1 1 338.860 4.124 20 0 EIADMM [O-]c1ccc(-c2noc(COC/C=C\c3ccccc3)n2)c(Cl)c1 ZINC000445450104 1039900634 /nfs/dbraw/zinc/90/06/34/1039900634.db2.gz QUVJHUHOUMRLDX-DAXSKMNVSA-N -1 1 342.782 4.326 20 0 EIADMM Cc1nc(-c2ccc(NCC3(C)CCCCC3)nc2)[n-]c(=O)c1C ZINC000514638407 1040073115 /nfs/dbraw/zinc/07/31/15/1040073115.db2.gz BBHLWMMBPINRTP-UHFFFAOYSA-N -1 1 326.444 4.243 20 0 EIADMM O=C(Nc1ccc(F)cc1[O-])c1ccc(CCC(F)(F)F)cc1 ZINC000505626425 1040176794 /nfs/dbraw/zinc/17/67/94/1040176794.db2.gz SAFKJIPMLPVFSO-UHFFFAOYSA-N -1 1 327.277 4.279 20 0 EIADMM C[C@]1(C(=O)Nc2ccc(-c3cc(=O)[nH][n-]3)cc2)CCCc2ccccc21 ZINC000477106476 1040217478 /nfs/dbraw/zinc/21/74/78/1040217478.db2.gz KUWCOJOZRWEYLE-NRFANRHFSA-N -1 1 347.418 4.015 20 0 EIADMM Cc1cc(Br)c([O-])c(NC(=O)c2cc3ccccc3o2)c1 ZINC000482573932 1040362274 /nfs/dbraw/zinc/36/22/74/1040362274.db2.gz IHMCZKITGUWHJG-UHFFFAOYSA-N -1 1 346.180 4.462 20 0 EIADMM Cc1cc(Br)c([O-])c(NC(=O)c2cccc(C)c2C)c1 ZINC000482733525 1040457367 /nfs/dbraw/zinc/45/73/67/1040457367.db2.gz FNQUMJQZTXEULJ-UHFFFAOYSA-N -1 1 334.213 4.332 20 0 EIADMM CC1=C(C(=O)Nc2c([O-])cc(Br)cc2Cl)CCC1 ZINC000568092620 1040521587 /nfs/dbraw/zinc/52/15/87/1040521587.db2.gz BLYGXRVRRQXYPQ-UHFFFAOYSA-N -1 1 330.609 4.247 20 0 EIADMM Cc1ccccc1-c1noc([C@H](C)Sc2nc(C)c(C)c(=O)[n-]2)n1 ZINC000539617385 1040614163 /nfs/dbraw/zinc/61/41/63/1040614163.db2.gz XLGQGZSWBWDHBJ-LBPRGKRZSA-N -1 1 342.424 4.011 20 0 EIADMM Cc1ccccc1-c1noc([C@@H](C)Sc2nc(C)c(C)c(=O)[n-]2)n1 ZINC000539617384 1040615239 /nfs/dbraw/zinc/61/52/39/1040615239.db2.gz XLGQGZSWBWDHBJ-GFCCVEGCSA-N -1 1 342.424 4.011 20 0 EIADMM C[C@@H](NC(=O)c1c(F)ccc([O-])c1F)c1cccc2ccccc21 ZINC000537732667 1040795661 /nfs/dbraw/zinc/79/56/61/1040795661.db2.gz UUWHYAJDRGPLFQ-LLVKDONJSA-N -1 1 327.330 4.315 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2cccc(C(C)(F)F)c2)cc1F ZINC000436165392 1040918122 /nfs/dbraw/zinc/91/81/22/1040918122.db2.gz XVXPYACHYSXEBX-UHFFFAOYSA-N -1 1 329.343 4.047 20 0 EIADMM CCc1cccc(S(=O)(=O)[N-]c2cccc(C(C)(F)F)c2)c1 ZINC000436184692 1040928814 /nfs/dbraw/zinc/92/88/14/1040928814.db2.gz VDXCCIREMMVHMI-UHFFFAOYSA-N -1 1 325.380 4.162 20 0 EIADMM CCc1cc(=O)[n-]c(SCC(=O)CC23CC4CC(CC(C4)C2)C3)n1 ZINC000436205643 1040955404 /nfs/dbraw/zinc/95/54/04/1040955404.db2.gz DBBSPHVUPDAMMV-UHFFFAOYSA-N -1 1 346.496 4.012 20 0 EIADMM CCCOc1ccc([N-]S(=O)(=O)c2cccc(C)c2)cc1Cl ZINC000515697000 1041003612 /nfs/dbraw/zinc/00/36/12/1041003612.db2.gz ILKZJJUJAKVMPP-UHFFFAOYSA-N -1 1 339.844 4.238 20 0 EIADMM CC[C@@H](C)c1ccc(S(=O)(=O)[N-]c2ccc3nc(C)oc3c2)cc1 ZINC000554360747 1041035722 /nfs/dbraw/zinc/03/57/22/1041035722.db2.gz OVHMFEOSXKSBAM-GFCCVEGCSA-N -1 1 344.436 4.451 20 0 EIADMM Cc1cnc(Cl)c(CN[C@@H](CC(=O)[O-])c2cccc(Cl)c2)c1 ZINC000903998240 1041244365 /nfs/dbraw/zinc/24/43/65/1041244365.db2.gz JDALJIPRHVCNIU-AWEZNQCLSA-N -1 1 339.222 4.002 20 0 EIADMM [O-]c1ccc(-c2noc(Cc3c[nH]c4cccc(Cl)c34)n2)c(F)c1 ZINC000436519699 1041302571 /nfs/dbraw/zinc/30/25/71/1041302571.db2.gz ACDPXCBVPBTQLD-UHFFFAOYSA-N -1 1 343.745 4.307 20 0 EIADMM Cc1c(NC(=O)c2c(F)ccc([O-])c2F)cccc1C(F)(F)F ZINC000538388345 1041304639 /nfs/dbraw/zinc/30/46/39/1041304639.db2.gz ZJGDDTNXTMJHHZ-UHFFFAOYSA-N -1 1 331.240 4.250 20 0 EIADMM O=C(Nc1cccc(OC(F)F)c1)c1ccc2ccccc2c1[O-] ZINC000436524124 1041308114 /nfs/dbraw/zinc/30/81/14/1041308114.db2.gz FRTRFEFVUXBVDC-UHFFFAOYSA-N -1 1 329.302 4.399 20 0 EIADMM CC(=O)Nc1ccc(C)c(NC(=O)c2ccc(C(C)C)cc2[O-])c1 ZINC000436531660 1041315681 /nfs/dbraw/zinc/31/56/81/1041315681.db2.gz ULOIXCGEPVZHPS-UHFFFAOYSA-N -1 1 326.396 4.035 20 0 EIADMM O=C(N=c1cc(-c2cccs2)[n-][nH]1)c1cc2ccccc2s1 ZINC000515987495 1041315836 /nfs/dbraw/zinc/31/58/36/1041315836.db2.gz IHWKHRNZFYOVLM-UHFFFAOYSA-N -1 1 325.418 4.027 20 0 EIADMM CN(C(=O)c1ccc2ccccc2c1[O-])[C@@H]1CCc2ccccc2C1 ZINC000436546779 1041322180 /nfs/dbraw/zinc/32/21/80/1041322180.db2.gz LKFVZVBLCJSZQF-GOSISDBHSA-N -1 1 331.415 4.175 20 0 EIADMM Cc1csc(C2(NC(=O)c3ccc4ccccc4c3[O-])CCC2)n1 ZINC000436550295 1041325375 /nfs/dbraw/zinc/32/53/75/1041325375.db2.gz SHHHCZOWZZWCKB-UHFFFAOYSA-N -1 1 338.432 4.120 20 0 EIADMM O=C(c1cc(F)ccc1[O-])N1CCC[C@@H]1Cc1ccccc1Cl ZINC000436540144 1041333738 /nfs/dbraw/zinc/33/37/38/1041333738.db2.gz NWWTVPSWVJIQDX-CQSZACIVSA-N -1 1 333.790 4.032 20 0 EIADMM CC(=O)Nc1ccc(Cl)c(NC(=O)c2ccc(C(C)C)cc2[O-])c1 ZINC000436543969 1041335603 /nfs/dbraw/zinc/33/56/03/1041335603.db2.gz ALEZGVIVNSMMEM-UHFFFAOYSA-N -1 1 346.814 4.380 20 0 EIADMM CC(C)[C@H](Cc1ccc(F)cc1)N(C)C(=O)c1cc(F)ccc1[O-] ZINC000436576800 1041341310 /nfs/dbraw/zinc/34/13/10/1041341310.db2.gz RGYMHZZOHBRPHY-KRWDZBQOSA-N -1 1 333.378 4.010 20 0 EIADMM CC[C@@H](NC(=O)c1cc2ccccc2cc1[O-])c1nc(C)cs1 ZINC000436566898 1041346690 /nfs/dbraw/zinc/34/66/90/1041346690.db2.gz NDOCYNMWSWIEGQ-OAHLLOKOSA-N -1 1 326.421 4.191 20 0 EIADMM C[C@H]1CN(C)c2ccccc2N(C(=O)c2cc3ccccc3cc2[O-])C1 ZINC000436593074 1041352482 /nfs/dbraw/zinc/35/24/82/1041352482.db2.gz CCTDXFTXBLZSFR-HNNXBMFYSA-N -1 1 346.430 4.278 20 0 EIADMM C[C@H]1CN(C(=O)c2cc3ccccc3cc2[O-])c2ccc(F)cc2O1 ZINC000436591465 1041352717 /nfs/dbraw/zinc/35/27/17/1041352717.db2.gz QGISTVIGKPKFQH-LBPRGKRZSA-N -1 1 337.350 4.112 20 0 EIADMM C[C@@]1(c2ccccc2)CCN(C(=O)c2ccc3ccccc3c2[O-])C1 ZINC000436581985 1041360846 /nfs/dbraw/zinc/36/08/46/1041360846.db2.gz KOAUZAQSVQAUKS-JOCHJYFZSA-N -1 1 331.415 4.349 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1CCC[C@@H](Nc2ccccc2)C1 ZINC000436601963 1041368267 /nfs/dbraw/zinc/36/82/67/1041368267.db2.gz IUZYPCHGFJAEJD-GOSISDBHSA-N -1 1 346.430 4.262 20 0 EIADMM O=C(c1cc(F)ccc1[O-])N1CCC[C@@H]1CCCc1ccccc1 ZINC000436607741 1041371181 /nfs/dbraw/zinc/37/11/81/1041371181.db2.gz TZGDYBSNBFRLEB-KRWDZBQOSA-N -1 1 327.399 4.159 20 0 EIADMM C[C@@H](C1CCCCC1)N(C)C(=O)c1cc(Br)ccc1[O-] ZINC000436635914 1041383174 /nfs/dbraw/zinc/38/31/74/1041383174.db2.gz PIPDHEXRUFRXEL-NSHDSACASA-N -1 1 340.261 4.196 20 0 EIADMM Cc1nc(C(F)(F)F)sc1-c1nc(-c2ccc([O-])cc2F)no1 ZINC000436656693 1041396631 /nfs/dbraw/zinc/39/66/31/1041396631.db2.gz NQZHCUOOURUGMR-UHFFFAOYSA-N -1 1 345.277 4.032 20 0 EIADMM Cc1cnn([C@@H]2CCCc3ccccc32)c1NC(=O)c1ccccc1[O-] ZINC000436640445 1041399680 /nfs/dbraw/zinc/39/96/80/1041399680.db2.gz HZKKZZQJSILISA-GOSISDBHSA-N -1 1 347.418 4.075 20 0 EIADMM O=C(Nc1cccc(-c2ncco2)c1)c1cc2ccccc2cc1[O-] ZINC000436662556 1041404535 /nfs/dbraw/zinc/40/45/35/1041404535.db2.gz JDUZOHXUKMCVQX-UHFFFAOYSA-N -1 1 330.343 4.453 20 0 EIADMM COc1ccc(C[C@H](C)CN(C)C(=O)c2cc(Cl)ccc2[O-])cc1 ZINC000436668447 1041408328 /nfs/dbraw/zinc/40/83/28/1041408328.db2.gz WTESGBOJOFJWLJ-ZDUSSCGKSA-N -1 1 347.842 4.005 20 0 EIADMM CC(=O)c1cc(F)c([N-]C(=O)c2c(F)ccc(C)c2F)c(F)c1 ZINC000538551103 1041415858 /nfs/dbraw/zinc/41/58/58/1041415858.db2.gz CRBWPLAAUDUOFZ-UHFFFAOYSA-N -1 1 325.261 4.006 20 0 EIADMM O=C(c1ccc([O-])cc1F)N1[C@@H]2CC[C@H]1C[C@@H](c1ccccc1)C2 ZINC000436676771 1041417174 /nfs/dbraw/zinc/41/71/74/1041417174.db2.gz SVIPDAFATDALFM-MUJYYYPQSA-N -1 1 325.383 4.082 20 0 EIADMM Cc1csc(CCCCNC(=O)c2ccc3ccccc3c2[O-])n1 ZINC000436693500 1041428058 /nfs/dbraw/zinc/42/80/58/1041428058.db2.gz AVHNIIGTGJDCQA-UHFFFAOYSA-N -1 1 340.448 4.063 20 0 EIADMM O=C(Nc1ccc([C@@H]2CCOC2)cc1)c1ccc2ccccc2c1[O-] ZINC000436696494 1041429062 /nfs/dbraw/zinc/42/90/62/1041429062.db2.gz HKTZCLXTLSMLFD-MRXNPFEDSA-N -1 1 333.387 4.302 20 0 EIADMM CC(C)c1ccc2nc(-c3ccc(Br)o3)[n-]c(=O)c2c1 ZINC000463220236 1041431325 /nfs/dbraw/zinc/43/13/25/1041431325.db2.gz QOOUPWYKDSVJDT-UHFFFAOYSA-N -1 1 333.185 4.069 20 0 EIADMM Cc1c(CSC(C)C)cccc1NC(=O)C(=O)c1ccc([O-])cc1 ZINC000436701233 1041433354 /nfs/dbraw/zinc/43/33/54/1041433354.db2.gz ZWKRPWVLPINEOT-UHFFFAOYSA-N -1 1 343.448 4.164 20 0 EIADMM COc1ccc(-c2ccc(-c3nc(=O)c4sccc4[n-]3)cc2)cc1 ZINC000463231383 1041438675 /nfs/dbraw/zinc/43/86/75/1041438675.db2.gz MKDZXJCHCBZTCH-UHFFFAOYSA-N -1 1 334.400 4.327 20 0 EIADMM O=C([N-]c1csnc1-c1ccccc1)c1cc(-c2cccnc2)on1 ZINC000436724455 1041444425 /nfs/dbraw/zinc/44/44/25/1041444425.db2.gz PWSBFMVWDDLILM-UHFFFAOYSA-N -1 1 348.387 4.112 20 0 EIADMM COc1cc(C)c(NC(=O)c2ccc(C(C)C)cc2[O-])cc1OC ZINC000436748472 1041462261 /nfs/dbraw/zinc/46/22/61/1041462261.db2.gz SVJNFUNMCQZOHG-UHFFFAOYSA-N -1 1 329.396 4.094 20 0 EIADMM O=C(N[C@@H](c1ccccc1)[C@@H]1CCOC1)c1ccc2ccccc2c1[O-] ZINC000436750975 1041463148 /nfs/dbraw/zinc/46/31/48/1041463148.db2.gz PZYWOMZMYLJHKW-XLIONFOSSA-N -1 1 347.414 4.053 20 0 EIADMM O=C(c1ccc(C(F)(F)F)cc1[O-])N1CC[C@H](Cc2ccccc2)C1 ZINC000436750897 1041463548 /nfs/dbraw/zinc/46/35/48/1041463548.db2.gz IKEREAXPSOJIOR-CQSZACIVSA-N -1 1 349.352 4.116 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1CCC[C@@H]1Cc1ccccc1 ZINC000436754974 1041467193 /nfs/dbraw/zinc/46/71/93/1041467193.db2.gz JWAPZPJZXGZVEB-GOSISDBHSA-N -1 1 331.415 4.393 20 0 EIADMM O=C(Nc1ccc2c(c1)CCCC(=O)N2)c1ccc2ccccc2c1[O-] ZINC000436775227 1041469226 /nfs/dbraw/zinc/46/92/26/1041469226.db2.gz ZCBMTIRLMSNAKB-UHFFFAOYSA-N -1 1 346.386 4.073 20 0 EIADMM C[C@@H](CN(C)C(=O)c1ccc(C(F)(F)F)cc1[O-])c1ccccc1 ZINC000436776549 1041470730 /nfs/dbraw/zinc/47/07/30/1041470730.db2.gz KOIOSLXFTNESBA-LBPRGKRZSA-N -1 1 337.341 4.287 20 0 EIADMM CC(C)N(Cc1ccco1)C(=O)c1ccc(C(F)(F)F)cc1[O-] ZINC000436763293 1041474503 /nfs/dbraw/zinc/47/45/03/1041474503.db2.gz JPJSVWNLHNGHJZ-UHFFFAOYSA-N -1 1 327.302 4.055 20 0 EIADMM CCN(C(=O)c1ccc(C(F)(F)F)cc1[O-])c1ccc(OC)cc1 ZINC000436790556 1041483331 /nfs/dbraw/zinc/48/33/31/1041483331.db2.gz GWIHFUBBGRGSHB-UHFFFAOYSA-N -1 1 339.313 4.086 20 0 EIADMM O=C(NCc1cc(-c2ccccc2)no1)c1ccc2ccccc2c1[O-] ZINC000436795372 1041485028 /nfs/dbraw/zinc/48/50/28/1041485028.db2.gz YKWUNRHGWYHVNA-UHFFFAOYSA-N -1 1 344.370 4.130 20 0 EIADMM C[C@@H](NC(=O)c1ccc(Cl)cc1[O-])c1nc(C(C)(C)C)cs1 ZINC000436819098 1041487166 /nfs/dbraw/zinc/48/71/66/1041487166.db2.gz NCFOEZQVDZVUFW-SECBINFHSA-N -1 1 338.860 4.291 20 0 EIADMM CC(C)c1ccc(C(=O)N2CC[C@@H](C)c3cccc(O)c32)c([O-])c1 ZINC000436819060 1041487361 /nfs/dbraw/zinc/48/73/61/1041487361.db2.gz MLGVTVQDTYYBND-CYBMUJFWSA-N -1 1 325.408 4.375 20 0 EIADMM O=C(Nc1nccn1Cc1ccccc1)c1ccc2ccccc2c1[O-] ZINC000436804933 1041489104 /nfs/dbraw/zinc/48/91/04/1041489104.db2.gz CFCLFKVAZLWCGH-UHFFFAOYSA-N -1 1 343.386 4.043 20 0 EIADMM C[C@@]1(c2ccccc2)CCCN(C(=O)c2ccc([O-])cc2F)CC1 ZINC000436853756 1041504097 /nfs/dbraw/zinc/50/40/97/1041504097.db2.gz SEZWIQOKOIJHHO-HXUWFJFHSA-N -1 1 327.399 4.115 20 0 EIADMM O=C(c1ccc(C(F)(F)F)cc1[O-])N1CCC[C@H](c2ccccc2)C1 ZINC000436852200 1041517658 /nfs/dbraw/zinc/51/76/58/1041517658.db2.gz OGDPIADPGPINFQ-AWEZNQCLSA-N -1 1 349.352 4.431 20 0 EIADMM [O-]c1ccc(-c2noc([C@@H]3CCCc4c(O)cccc43)n2)c(Cl)c1 ZINC000436870162 1041527918 /nfs/dbraw/zinc/52/79/18/1041527918.db2.gz PJDQKXHSBBIWSM-CYBMUJFWSA-N -1 1 342.782 4.269 20 0 EIADMM Cc1onc(-c2ccccc2)c1-c1nc(-c2ccc([O-])cc2F)no1 ZINC000436880588 1041538854 /nfs/dbraw/zinc/53/88/54/1041538854.db2.gz RUZWGTYDIGPPDF-UHFFFAOYSA-N -1 1 337.310 4.212 20 0 EIADMM O=C(c1ccc([O-])cc1F)N(C1CC1)[C@@H]1CCCc2ccccc21 ZINC000436881572 1041539127 /nfs/dbraw/zinc/53/91/27/1041539127.db2.gz SYACADLKNPIQMW-LJQANCHMSA-N -1 1 325.383 4.214 20 0 EIADMM O=C(Nc1ccccc1N1CCc2ccccc21)c1ccc([O-])cc1F ZINC000436880362 1041539486 /nfs/dbraw/zinc/53/94/86/1041539486.db2.gz NXAGZAYVRVPXRQ-UHFFFAOYSA-N -1 1 348.377 4.478 20 0 EIADMM CC(=O)Nc1ccc([O-])c(-c2nc(-c3ccc4ccccc4c3)no2)c1 ZINC000436888050 1041541894 /nfs/dbraw/zinc/54/18/94/1041541894.db2.gz SMRXSIAKQBUJAZ-UHFFFAOYSA-N -1 1 345.358 4.221 20 0 EIADMM Cc1ccc(-c2ncc[nH]2)cc1NC(=O)c1ccc2ccccc2c1[O-] ZINC000436906560 1041547126 /nfs/dbraw/zinc/54/71/26/1041547126.db2.gz COFBNCFQZFIJIR-UHFFFAOYSA-N -1 1 343.386 4.496 20 0 EIADMM COc1ccc(-c2nc(-c3ccc(OC(C)(C)C)cc3)no2)c([O-])c1 ZINC000436898877 1041551509 /nfs/dbraw/zinc/55/15/09/1041551509.db2.gz ASLLHSQANYJHRR-UHFFFAOYSA-N -1 1 340.379 4.295 20 0 EIADMM COc1ccc(-c2nc(-c3ccc4cc(OC)ccc4c3)no2)c([O-])c1 ZINC000436902137 1041554146 /nfs/dbraw/zinc/55/41/46/1041554146.db2.gz OQDGQXFCJDWGLO-UHFFFAOYSA-N -1 1 348.358 4.280 20 0 EIADMM CCOc1ccc(-c2noc(-c3ccc4ccccc4c3[O-])n2)cn1 ZINC000436921198 1041557125 /nfs/dbraw/zinc/55/71/25/1041557125.db2.gz VBCYNJKVXUPISH-UHFFFAOYSA-N -1 1 333.347 4.056 20 0 EIADMM CCCCCN(CCCOC)C(=O)c1cc2ccccc2cc1[O-] ZINC000436918054 1041557567 /nfs/dbraw/zinc/55/75/67/1041557567.db2.gz GBXFNJVFEHMBDC-UHFFFAOYSA-N -1 1 329.440 4.214 20 0 EIADMM CC[C@H](C)[C@H](C)N(C(=O)c1cc(Br)ccc1[O-])C1CC1 ZINC000436927258 1041562208 /nfs/dbraw/zinc/56/22/08/1041562208.db2.gz QPJALSXHRUSBSS-QWRGUYRKSA-N -1 1 340.261 4.194 20 0 EIADMM C[C@@]1(c2ccccc2)CCCN(C(=O)c2cc(Cl)ccc2[O-])C1 ZINC000436946408 1041568283 /nfs/dbraw/zinc/56/82/83/1041568283.db2.gz ASRNHNWFJSUIKR-LJQANCHMSA-N -1 1 329.827 4.240 20 0 EIADMM [O-]c1c(-c2nc(Cc3c[nH]c4ncccc34)no2)ccc2ccccc21 ZINC000436941693 1041568892 /nfs/dbraw/zinc/56/88/92/1041568892.db2.gz RDUNSVJOUQTHGK-UHFFFAOYSA-N -1 1 342.358 4.063 20 0 EIADMM COc1ccc(-c2nc(-c3ccc(SC)cc3Cl)no2)c([O-])c1 ZINC000436946567 1041570452 /nfs/dbraw/zinc/57/04/52/1041570452.db2.gz JQDSFNDEAUHXEF-UHFFFAOYSA-N -1 1 348.811 4.493 20 0 EIADMM O=C(c1cc(Cl)ccc1[O-])N1CC[C@@H](c2cccc(Cl)c2)C1 ZINC000436979670 1041580715 /nfs/dbraw/zinc/58/07/15/1041580715.db2.gz KZTAAFPZSHHTPB-GFCCVEGCSA-N -1 1 336.218 4.329 20 0 EIADMM CC(C)c1ccc([C@@H]2CCCN2C(=O)C(=O)c2ccc([O-])cc2)cc1 ZINC000436989444 1041583754 /nfs/dbraw/zinc/58/37/54/1041583754.db2.gz ZZKYAIZYUSPSPY-IBGZPJMESA-N -1 1 337.419 4.062 20 0 EIADMM Cc1nc(SCc2ncc(-c3ccc(Cl)cc3)o2)[n-]c(=O)c1C ZINC000540712568 1041620786 /nfs/dbraw/zinc/62/07/86/1041620786.db2.gz HWVFQNOJJMKROY-UHFFFAOYSA-N -1 1 347.827 4.400 20 0 EIADMM CCOc1ccc(OC(C)(C)C(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000540959480 1041754183 /nfs/dbraw/zinc/75/41/83/1041754183.db2.gz SZRHLZCSSZUPCR-UHFFFAOYSA-N -1 1 349.814 4.240 20 0 EIADMM CCc1cccc(C)c1[N-]S(=O)(=O)c1ccc(OC)cc1Cl ZINC000517051045 1041847270 /nfs/dbraw/zinc/84/72/70/1041847270.db2.gz SGDWJXHNXLGEGC-UHFFFAOYSA-N -1 1 339.844 4.020 20 0 EIADMM CO[C@@H](C)c1cccc([N-]S(=O)(=O)c2ccc(C3CC3)cc2)c1 ZINC000517216913 1041908207 /nfs/dbraw/zinc/90/82/07/1041908207.db2.gz OMGJLEPTFHSNAI-ZDUSSCGKSA-N -1 1 331.437 4.072 20 0 EIADMM Cc1cc(F)cc(S(=O)(=O)[N-]c2ccc(C(=O)C(C)(C)C)cc2)c1 ZINC000425942967 1042030894 /nfs/dbraw/zinc/03/08/94/1042030894.db2.gz OXHJEZCZWWHTJX-UHFFFAOYSA-N -1 1 349.427 4.164 20 0 EIADMM Cc1sc(NC(=O)c2ccccc2[O-])nc1-c1ccc(F)cc1 ZINC000302001032 1042049634 /nfs/dbraw/zinc/04/96/34/1042049634.db2.gz XVHCUCGTSPXOGM-UHFFFAOYSA-N -1 1 328.368 4.216 20 0 EIADMM CCC[C@@]1(C)CCCN(Cc2nc3cc(C(=O)[O-])ccc3n2CC)C1 ZINC000517949106 1042288871 /nfs/dbraw/zinc/28/88/71/1042288871.db2.gz RLCCRSZKWWXJNK-FQEVSTJZSA-N -1 1 343.471 4.157 20 0 EIADMM CC[C@@H](C)Oc1ccc([N-]S(=O)(=O)c2cccc(F)c2C)cc1 ZINC000438793317 1042351673 /nfs/dbraw/zinc/35/16/73/1042351673.db2.gz PHWQIIJZGQQXAJ-GFCCVEGCSA-N -1 1 337.416 4.112 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2cccc(C(F)F)c2)cc1Cl ZINC000509545550 1042366258 /nfs/dbraw/zinc/36/62/58/1042366258.db2.gz WAXFITKOYDSCIC-UHFFFAOYSA-N -1 1 331.771 4.387 20 0 EIADMM O=C(c1cc2ccccc2cc1[O-])N1CC[C@@H](Cc2ccccc2)C1 ZINC000303901646 1042528943 /nfs/dbraw/zinc/52/89/43/1042528943.db2.gz QAFYOOBZUYSYTI-KRWDZBQOSA-N -1 1 331.415 4.250 20 0 EIADMM CSc1ccc(OCCSc2nc(C(F)F)cc(=O)[n-]2)cc1 ZINC000518443088 1042529307 /nfs/dbraw/zinc/52/93/07/1042529307.db2.gz AGZPEWHWZRMGCJ-UHFFFAOYSA-N -1 1 344.408 4.013 20 0 EIADMM O=S(=O)([N-]c1c(F)cccc1Oc1ccccc1)c1ccsc1 ZINC000506611250 1042683323 /nfs/dbraw/zinc/68/33/23/1042683323.db2.gz LJMABNKGJVWMDC-UHFFFAOYSA-N -1 1 349.408 4.480 20 0 EIADMM C[C@]([N-]C(=O)C(F)(F)c1ccccc1)(c1ccccc1)C(F)(F)F ZINC001127259437 1042716196 /nfs/dbraw/zinc/71/61/96/1042716196.db2.gz KEFZWXDGQGRBHI-HNNXBMFYSA-N -1 1 343.295 4.372 20 0 EIADMM Cc1cnc(C(=O)N(C)[C@H](C)c2ccc(Cl)c(Cl)c2)c([O-])c1 ZINC000426452015 1042719454 /nfs/dbraw/zinc/71/94/54/1042719454.db2.gz UEMLDVWFGALLRP-SNVBAGLBSA-N -1 1 339.222 4.236 20 0 EIADMM O=C([N-]c1cc(-c2ccccc2)on1)c1cc(-c2ccccc2)no1 ZINC000176644522 1042814757 /nfs/dbraw/zinc/81/47/57/1042814757.db2.gz TYNMVNORDBFUCE-UHFFFAOYSA-N -1 1 331.331 4.249 20 0 EIADMM CC(C)CN(C(=O)c1ccc([O-])cc1F)[C@@H]1CCCc2cccnc21 ZINC000133863398 1042874561 /nfs/dbraw/zinc/87/45/61/1042874561.db2.gz XDTREFQWADXKCS-GOSISDBHSA-N -1 1 342.414 4.102 20 0 EIADMM CC[C@H](NCc1ccc(-c2ccc(Cl)c(Cl)c2)o1)C(=O)[O-] ZINC000417584513 1042892886 /nfs/dbraw/zinc/89/28/86/1042892886.db2.gz XVCJRBXUDOAXCB-ZDUSSCGKSA-N -1 1 328.195 4.206 20 0 EIADMM O=C(Nc1c(O)cccc1Cl)c1ccc(C(F)(F)F)cc1[O-] ZINC000516999014 1042913775 /nfs/dbraw/zinc/91/37/75/1042913775.db2.gz GXQJCAHKFVFEOE-UHFFFAOYSA-N -1 1 331.677 4.022 20 0 EIADMM Cc1ccccc1S(=O)(=O)[N-]c1ccc(-c2ccncc2)c(C)c1 ZINC000427626942 1043025155 /nfs/dbraw/zinc/02/51/55/1043025155.db2.gz VGZVTWFYOMYEJL-UHFFFAOYSA-N -1 1 338.432 4.166 20 0 EIADMM CCCCCc1nnc([N-]C(=O)c2ncoc2-c2ccccc2)s1 ZINC000112000534 1043049920 /nfs/dbraw/zinc/04/99/20/1043049920.db2.gz GJXKKSUNKKSBMC-UHFFFAOYSA-N -1 1 342.424 4.178 20 0 EIADMM CCc1ccc([N-]S(=O)(=O)c2cccc(C(F)F)c2)cc1F ZINC000780394860 1043075472 /nfs/dbraw/zinc/07/54/72/1043075472.db2.gz LMGBOWBWSKQQBD-UHFFFAOYSA-N -1 1 329.343 4.127 20 0 EIADMM CC(C)(C)c1nnc([N-]C(=O)c2cc(F)c(Cl)cc2F)s1 ZINC000137623828 1043087744 /nfs/dbraw/zinc/08/77/44/1043087744.db2.gz RRHLGJDROPYGBX-UHFFFAOYSA-N -1 1 331.775 4.020 20 0 EIADMM CCOc1cc(-c2nc([C@H]3CCCS3)no2)cc(Cl)c1[O-] ZINC000276984839 1043150915 /nfs/dbraw/zinc/15/09/15/1043150915.db2.gz WMTAFUVFVKSDKQ-LLVKDONJSA-N -1 1 326.805 4.062 20 0 EIADMM Cc1c(=O)[n-]c(SCc2nc3ccccc3o2)nc1-c1ccccc1 ZINC000185053110 1043153870 /nfs/dbraw/zinc/15/38/70/1043153870.db2.gz MOISKSQDNQTZAZ-UHFFFAOYSA-N -1 1 349.415 4.179 20 0 EIADMM CCc1cccc(C)c1[N-]S(=O)(=O)c1c(C)ccc2ncccc21 ZINC000673981302 1043233050 /nfs/dbraw/zinc/23/30/50/1043233050.db2.gz BOVKFNGNHDPMIW-UHFFFAOYSA-N -1 1 340.448 4.215 20 0 EIADMM COc1ccc2oc(C(=O)Nc3ccc(Cl)cc3[O-])c(C)c2c1 ZINC000533159182 1043296989 /nfs/dbraw/zinc/29/69/89/1043296989.db2.gz MOMZPYLDVFIYCV-UHFFFAOYSA-N -1 1 331.755 4.361 20 0 EIADMM O=S(=O)([N-]c1ccc(Sc2ccncc2)cc1)c1ccccc1 ZINC000152559316 1043381603 /nfs/dbraw/zinc/38/16/03/1043381603.db2.gz BXHCPPOPPBSBAH-UHFFFAOYSA-N -1 1 342.445 4.034 20 0 EIADMM CC(C)c1ccccc1S(=O)(=O)[N-]c1ccc(-c2ncco2)cc1 ZINC000189051664 1043412948 /nfs/dbraw/zinc/41/29/48/1043412948.db2.gz VAKFQIKCGWSAAR-UHFFFAOYSA-N -1 1 342.420 4.266 20 0 EIADMM O=C(c1c([O-])cccc1Cl)N1CCC[C@@H](Cc2ccccc2)C1 ZINC000730035906 1043432701 /nfs/dbraw/zinc/43/27/01/1043432701.db2.gz UGKVQSICUDAMES-HNNXBMFYSA-N -1 1 329.827 4.141 20 0 EIADMM Cc1ccc(C)c([N-]S(=O)(=O)c2ccc(CC(F)(F)F)cc2)c1 ZINC000189220336 1043490285 /nfs/dbraw/zinc/49/02/85/1043490285.db2.gz NCAIIFKHKMXNSK-UHFFFAOYSA-N -1 1 343.370 4.209 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2cc(Cl)cc(F)c2F)c(C)s1 ZINC000442230807 1043562512 /nfs/dbraw/zinc/56/25/12/1043562512.db2.gz GDNQYDWZYIPEOV-UHFFFAOYSA-N -1 1 337.800 4.097 20 0 EIADMM O=C(Nc1ccc(OC2CCCC2)c(Cl)c1)c1cncc([O-])c1 ZINC000521181747 1043623779 /nfs/dbraw/zinc/62/37/79/1043623779.db2.gz VTBZQRSMWQBSBB-UHFFFAOYSA-N -1 1 332.787 4.014 20 0 EIADMM Cc1nc(-c2ccc(C(=O)Nc3ccc(F)cc3[O-])cc2)cs1 ZINC000442565862 1043749584 /nfs/dbraw/zinc/74/95/84/1043749584.db2.gz IWXAPFSDTKBSDW-UHFFFAOYSA-N -1 1 328.368 4.216 20 0 EIADMM CSc1ccc(Cl)cc1[N-]C(=O)c1snnc1C(C)(C)C ZINC000191389653 1043813411 /nfs/dbraw/zinc/81/34/11/1043813411.db2.gz BCUBJRJKHIMFAB-UHFFFAOYSA-N -1 1 341.889 4.463 20 0 EIADMM COc1cc(C(=O)NCc2csc3ccccc23)cc(Cl)c1[O-] ZINC000442732142 1043818975 /nfs/dbraw/zinc/81/89/75/1043818975.db2.gz XODWBWLAOCCBKF-UHFFFAOYSA-N -1 1 347.823 4.199 20 0 EIADMM COc1cc(C(=O)N2CC[C@@H](C)c3ccccc32)cc(Cl)c1[O-] ZINC000442735415 1043820840 /nfs/dbraw/zinc/82/08/40/1043820840.db2.gz YDSDTBKNWWRFTB-LLVKDONJSA-N -1 1 331.799 4.208 20 0 EIADMM O=C([N-]c1nc(Sc2ccccc2)ns1)c1cc(F)ccc1F ZINC000521921246 1043836033 /nfs/dbraw/zinc/83/60/33/1043836033.db2.gz ZMYFDOSTLYJYRS-UHFFFAOYSA-N -1 1 349.387 4.220 20 0 EIADMM CC(C)c1ocnc1C(=O)[N-]c1nnc(-c2ccccc2Cl)s1 ZINC000731901585 1043843629 /nfs/dbraw/zinc/84/36/29/1043843629.db2.gz BIWIUELCNZBTKT-UHFFFAOYSA-N -1 1 348.815 4.222 20 0 EIADMM O=c1cc(CSCCCc2ccccc2)c2ccc([O-])cc2o1 ZINC000731937527 1043850575 /nfs/dbraw/zinc/85/05/75/1043850575.db2.gz KTUKMEZMJAQLHI-UHFFFAOYSA-N -1 1 326.417 4.365 20 0 EIADMM Cc1ccccc1CC1CN(C(=O)c2cc3ccccc3cc2[O-])C1 ZINC000674746488 1043860483 /nfs/dbraw/zinc/86/04/83/1043860483.db2.gz POFOBBYZKCMKQT-UHFFFAOYSA-N -1 1 331.415 4.169 20 0 EIADMM C[C@@H]1CO[C@@H](c2ccccc2)[C@@H](C)N1C(=O)c1cc(Cl)ccc1[O-] ZINC000732017014 1043870296 /nfs/dbraw/zinc/87/02/96/1043870296.db2.gz LDHHRTGYWBFVII-SNUQEOBHSA-N -1 1 345.826 4.036 20 0 EIADMM CC(C)c1ocnc1C(=O)[N-]c1nc(Sc2ccccc2)ns1 ZINC000732085585 1043875528 /nfs/dbraw/zinc/87/55/28/1043875528.db2.gz QQEIDYBKLFVRPU-UHFFFAOYSA-N -1 1 346.437 4.053 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)N[C@@H](C1CCCC1)C(F)(F)F ZINC000192266599 1043897868 /nfs/dbraw/zinc/89/78/68/1043897868.db2.gz FBGRZRPWZVICGM-LBPRGKRZSA-N -1 1 336.741 4.288 20 0 EIADMM COc1cc(C(=O)N[C@H]2c3ccccc3CC[C@H]2C)cc(Cl)c1[O-] ZINC000443059159 1043982098 /nfs/dbraw/zinc/98/20/98/1043982098.db2.gz BNSOHMLNQHQPCH-PIGZYNQJSA-N -1 1 345.826 4.108 20 0 EIADMM COc1cc(C(=O)N2CCCC[C@H]2CCC(C)C)cc(Cl)c1[O-] ZINC000443066889 1043986013 /nfs/dbraw/zinc/98/60/13/1043986013.db2.gz FUAWXSGESCIWQP-AWEZNQCLSA-N -1 1 339.863 4.485 20 0 EIADMM COc1ccc2nc(-c3nc4ccc(Cl)cc4c(=O)[n-]3)ccc2c1 ZINC000080128285 1044089016 /nfs/dbraw/zinc/08/90/16/1044089016.db2.gz CUVDQSITQFDPMQ-UHFFFAOYSA-N -1 1 337.766 4.213 20 0 EIADMM COc1cc(-c2nc([C@H](C)c3cccs3)no2)cc(Cl)c1[O-] ZINC000443202223 1044091764 /nfs/dbraw/zinc/09/17/64/1044091764.db2.gz JRUYUOYQAZEMLD-MRVPVSSYSA-N -1 1 336.800 4.318 20 0 EIADMM CCOc1cc(-c2nc(Cc3ccccc3F)no2)cc(Cl)c1[O-] ZINC000443205508 1044094520 /nfs/dbraw/zinc/09/45/20/1044094520.db2.gz TWXUWSNBZNXRHG-UHFFFAOYSA-N -1 1 348.761 4.224 20 0 EIADMM CCOc1cc(C(=O)N[C@@H]2CCC[C@@H](C)CC2)cc(Cl)c1[O-] ZINC000443385436 1044248803 /nfs/dbraw/zinc/24/88/03/1044248803.db2.gz PGUYFIOTQONGPH-DGCLKSJQSA-N -1 1 325.836 4.143 20 0 EIADMM C[C@H](C(=O)Nc1c([O-])cccc1F)c1ccc(Br)s1 ZINC000608366067 1044370162 /nfs/dbraw/zinc/37/01/62/1044370162.db2.gz MVYSDUQXCJUVMC-ZETCQYMHSA-N -1 1 344.205 4.098 20 0 EIADMM COCC[C@H](Sc1nc(C)c(C2CC2)c(=O)[n-]1)c1ccccc1 ZINC000631024262 1044480852 /nfs/dbraw/zinc/48/08/52/1044480852.db2.gz QQWFCBKGHAVFMS-HNNXBMFYSA-N -1 1 330.453 4.238 20 0 EIADMM O=S(=O)([N-]c1ccc(Cl)cc1Cl)c1cccc(F)c1F ZINC000509628497 1044513361 /nfs/dbraw/zinc/51/33/61/1044513361.db2.gz KNELGILHALMYTF-UHFFFAOYSA-N -1 1 338.162 4.072 20 0 EIADMM O=C(c1c([O-])cnc2ccc(Cl)cc21)N1CCC2(CCC2)CC1 ZINC000672254452 1044635016 /nfs/dbraw/zinc/63/50/16/1044635016.db2.gz SIUZHQZKPRSNOC-UHFFFAOYSA-N -1 1 330.815 4.000 20 0 EIADMM CCC1=NO[C@H](c2nc(=O)c3c(-c4ccc(C)cc4)csc3[n-]2)C1 ZINC000172996148 1044727207 /nfs/dbraw/zinc/72/72/07/1044727207.db2.gz HHYAWVUMZPDFEU-AWEZNQCLSA-N -1 1 339.420 4.187 20 0 EIADMM C[C@@H]1CCc2ccccc2N1C(=O)c1cc(Br)ccc1[O-] ZINC000220003091 1044849064 /nfs/dbraw/zinc/84/90/64/1044849064.db2.gz CXAADOZYFXWKLJ-LLVKDONJSA-N -1 1 346.224 4.136 20 0 EIADMM COc1cccc(Cc2noc(-c3ccc4ccccc4c3[O-])n2)c1 ZINC000327434602 1044934606 /nfs/dbraw/zinc/93/46/06/1044934606.db2.gz PKIHBGBWXZUDFA-UHFFFAOYSA-N -1 1 332.359 4.195 20 0 EIADMM CC[C@@H]([N-]C(=O)C(F)(F)c1ccc(F)cc1)c1ccc(F)cc1F ZINC000737645130 1045016245 /nfs/dbraw/zinc/01/62/45/1045016245.db2.gz LRJHKEFYEWBYJN-OAHLLOKOSA-N -1 1 343.295 4.463 20 0 EIADMM CC(C)(C)OC(=O)Nc1ccc(C(=O)NCC2(C)CCCC2)c([O-])c1 ZINC000740926849 1045245629 /nfs/dbraw/zinc/24/56/29/1045245629.db2.gz TVFKXUQTABVJAE-UHFFFAOYSA-N -1 1 348.443 4.049 20 0 EIADMM C[C@H]([N-]C(=O)C(F)(F)c1cccc(Cl)c1)c1ccc(Cl)cn1 ZINC000792447876 1045897492 /nfs/dbraw/zinc/89/74/92/1045897492.db2.gz MDRLHUPRQHTSCH-VIFPVBQESA-N -1 1 345.176 4.358 20 0 EIADMM Cc1ccc([C@H]2CCN(C(=O)c3c([O-])cccc3Cl)C2)c(C)c1 ZINC000792550007 1045910208 /nfs/dbraw/zinc/91/02/08/1045910208.db2.gz GCYMHLVDIGKXHS-AWEZNQCLSA-N -1 1 329.827 4.292 20 0 EIADMM C=CC(=O)Nc1cc(NC(=O)c2ccc(C(C)C)cc2[O-])ccc1F ZINC000769957766 1046110850 /nfs/dbraw/zinc/11/08/50/1046110850.db2.gz JTAGOCRRROVDIT-UHFFFAOYSA-N -1 1 342.370 4.032 20 0 EIADMM O=C(c1c([O-])cccc1Cl)N1CCCCC[C@H]1[C@@H]1CCCCC1=O ZINC000769973772 1046118058 /nfs/dbraw/zinc/11/80/58/1046118058.db2.gz HZGLFMILZWUCIK-ZFWWWQNUSA-N -1 1 349.858 4.190 20 0 EIADMM Cc1cccc(C2=CCN(C(=O)c3c([O-])cccc3Cl)CC2)c1 ZINC000771261439 1046361586 /nfs/dbraw/zinc/36/15/86/1046361586.db2.gz QTECRPBHGBOXQZ-UHFFFAOYSA-N -1 1 327.811 4.284 20 0 EIADMM C[C@H]1CN(Cc2cccc([O-])c2Cl)C[C@H](c2ccc(F)cc2)O1 ZINC000508720156 1046392838 /nfs/dbraw/zinc/39/28/38/1046392838.db2.gz PRVHEAOBEXRREM-YVEFUNNKSA-N -1 1 335.806 4.147 20 0 EIADMM Cc1cc([C@@H]2CN(Cc3cccc([O-])c3Cl)CCO2)ccc1F ZINC000508726321 1046451866 /nfs/dbraw/zinc/45/18/66/1046451866.db2.gz HNFHMKZTOBFWGI-KRWDZBQOSA-N -1 1 335.806 4.067 20 0 EIADMM Cc1coc(-c2cccc([N-]S(=O)(=O)c3cc(C)ccc3C)c2)n1 ZINC000126811020 1046559326 /nfs/dbraw/zinc/55/93/26/1046559326.db2.gz ISWGQJCSVPTBMR-UHFFFAOYSA-N -1 1 342.420 4.068 20 0 EIADMM CCc1cc(=O)[n-]c(SCCOc2cc(Cl)ccc2Cl)n1 ZINC000428697393 1046560903 /nfs/dbraw/zinc/56/09/03/1046560903.db2.gz ABJREJDYNBNZLP-UHFFFAOYSA-N -1 1 345.251 4.223 20 0 EIADMM C[C@@H]1[C@H](Cc2ccccc2)CCN1C(=O)c1c([O-])cccc1Cl ZINC000746693138 1047027836 /nfs/dbraw/zinc/02/78/36/1047027836.db2.gz BRBQGNWRNYNFAY-HIFRSBDPSA-N -1 1 329.827 4.139 20 0 EIADMM Cc1noc(-c2ccccc2)c1[N-]C(=O)c1nc(Cl)sc1C ZINC000788131635 1047113476 /nfs/dbraw/zinc/11/34/76/1047113476.db2.gz UBWAYANUATVRKB-UHFFFAOYSA-N -1 1 333.800 4.321 20 0 EIADMM COc1cc(C(=O)N[C@H](C)C(C)(C)c2ccccc2)cc(Cl)c1[O-] ZINC000460188663 1047170973 /nfs/dbraw/zinc/17/09/73/1047170973.db2.gz ULHJZGPEIPTLDG-GFCCVEGCSA-N -1 1 347.842 4.150 20 0 EIADMM Cc1nc(S[C@@H](C)c2ncc(-c3ccccc3)o2)[n-]c(=O)c1C ZINC000537415080 1047204357 /nfs/dbraw/zinc/20/43/57/1047204357.db2.gz DRMGBYFUIIMMPH-LBPRGKRZSA-N -1 1 327.409 4.307 20 0 EIADMM O=C(NNc1c(Cl)cc(Cl)cc1Cl)c1ccc([O-])cc1F ZINC000154750949 1047502735 /nfs/dbraw/zinc/50/27/35/1047502735.db2.gz WZVHHDWWLOOYRP-UHFFFAOYSA-N -1 1 349.576 4.248 20 0 EIADMM Cc1ccc(-c2c[nH]cc2C(=O)Nc2nc(Cl)ccc2[O-])s1 ZINC000790048867 1047509668 /nfs/dbraw/zinc/50/96/68/1047509668.db2.gz ZSPIOJKJZFOTGC-UHFFFAOYSA-N -1 1 333.800 4.058 20 0 EIADMM CC(C)(C)OCc1ccccc1C(=O)Nc1nc(Cl)ccc1[O-] ZINC000790055023 1047513034 /nfs/dbraw/zinc/51/30/34/1047513034.db2.gz AIOIABHEOACNJK-UHFFFAOYSA-N -1 1 334.803 4.008 20 0 EIADMM Cc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)c1ccccc1[O-] ZINC000130384765 1047705560 /nfs/dbraw/zinc/70/55/60/1047705560.db2.gz YJNMORNEFAULAD-UHFFFAOYSA-N -1 1 346.386 4.205 20 0 EIADMM C[C@@H]1CN(C(=O)c2ccc3ccccc3c2[O-])C[C@H](c2ccccc2)O1 ZINC000130976452 1047818061 /nfs/dbraw/zinc/81/80/61/1047818061.db2.gz VEDQKFOEGWSSPX-FOIQADDNSA-N -1 1 347.414 4.148 20 0 EIADMM C[C@@H]1c2ccc(Cl)n2CCN1C(=O)c1cc2ccccc2cc1[O-] ZINC000808250727 1047848014 /nfs/dbraw/zinc/84/80/14/1047848014.db2.gz TYHSUPSELXZNET-GFCCVEGCSA-N -1 1 340.810 4.217 20 0 EIADMM C[C@@H](CC(=O)OCc1cc(=O)oc2cc([O-])ccc12)CC(C)(C)C ZINC000919496275 1047857067 /nfs/dbraw/zinc/85/70/67/1047857067.db2.gz MEVOXLSRYNJOJK-LBPRGKRZSA-N -1 1 332.396 4.004 20 0 EIADMM O=C(Cc1ccc([O-])c(Cl)c1)N[C@H]1CCc2cc(Cl)ccc21 ZINC001171069101 1047949630 /nfs/dbraw/zinc/94/96/30/1047949630.db2.gz FROLUJYWHFIORR-HNNXBMFYSA-N -1 1 336.218 4.045 20 0 EIADMM Cc1ccc(CNc2cc(C)cc(C[N-]C(=O)C(F)(F)F)c2)s1 ZINC000825011848 1048006977 /nfs/dbraw/zinc/00/69/77/1048006977.db2.gz ZWFNRIAAOLERHT-UHFFFAOYSA-N -1 1 342.386 4.156 20 0 EIADMM CC[C@H](Cc1ccc(C)cc1)N(C)C(=O)c1ccc(Cl)cc1[O-] ZINC001137037111 1048092609 /nfs/dbraw/zinc/09/26/09/1048092609.db2.gz PQALXVDEHPZHTD-MRXNPFEDSA-N -1 1 331.843 4.447 20 0 EIADMM CC(F)(F)CCC(=O)Nc1c([O-])cc(Br)cc1Cl ZINC000843885970 1048137776 /nfs/dbraw/zinc/13/77/76/1048137776.db2.gz LOBMFGGGEHYGKJ-UHFFFAOYSA-N -1 1 342.567 4.182 20 0 EIADMM O=C([N-]c1cc(F)ccc1Oc1ccccc1)c1nnc(C2CC2)o1 ZINC001143709441 1048166991 /nfs/dbraw/zinc/16/69/91/1048166991.db2.gz KXKLRADFBXWRPU-UHFFFAOYSA-N -1 1 339.326 4.131 20 0 EIADMM O=C([N-]Cc1cccc(F)c1F)C(F)(F)c1cccc(Cl)c1 ZINC001131699048 1048359232 /nfs/dbraw/zinc/35/92/32/1048359232.db2.gz BZIMBVFICUMQCL-UHFFFAOYSA-N -1 1 331.696 4.026 20 0 EIADMM CN(Cc1ccc2ccccc2c1)C(=O)c1c([O-])cccc1Cl ZINC000920430547 1048679032 /nfs/dbraw/zinc/67/90/32/1048679032.db2.gz PXCDXAUBDXHNRO-UHFFFAOYSA-N -1 1 325.795 4.471 20 0 EIADMM Cc1c(CNC(=O)c2c([O-])cccc2Cl)oc2ccc(F)cc12 ZINC000920463278 1048679166 /nfs/dbraw/zinc/67/91/66/1048679166.db2.gz BUGCTCYAGDPTDY-UHFFFAOYSA-N -1 1 333.746 4.169 20 0 EIADMM [O-]c1cc(F)c(CN2CC[C@H](Sc3ccc(F)cc3)C2)c(F)c1 ZINC001144561705 1048729989 /nfs/dbraw/zinc/72/99/89/1048729989.db2.gz MIYNSVPBUAHECL-AWEZNQCLSA-N -1 1 339.382 4.176 20 0 EIADMM Cc1cccc(OC2CCN(Cc3cc(F)c([O-])cc3F)CC2)c1 ZINC001144657899 1048777520 /nfs/dbraw/zinc/77/75/20/1048777520.db2.gz MIGGZYHXVJOFOY-UHFFFAOYSA-N -1 1 333.378 4.022 20 0 EIADMM O=C([N-]Cc1cccc(C(F)(F)F)c1)C(F)(F)c1ccc(F)cc1 ZINC000920840181 1048800488 /nfs/dbraw/zinc/80/04/88/1048800488.db2.gz MTKRXTBIHMKMNU-UHFFFAOYSA-N -1 1 347.258 4.253 20 0 EIADMM [O-]c1cccc(CN2Cc3ccc(Br)cc3C2)c1Cl ZINC000816569934 1048838196 /nfs/dbraw/zinc/83/81/96/1048838196.db2.gz BTBAACSHGFTGKX-UHFFFAOYSA-N -1 1 338.632 4.324 20 0 EIADMM CCCCc1oc2ccccc2c1CN(C)C(=O)c1ncccc1[O-] ZINC001135681560 1048857226 /nfs/dbraw/zinc/85/72/26/1048857226.db2.gz WBDXSILAFBUPTB-UHFFFAOYSA-N -1 1 338.407 4.148 20 0 EIADMM O=C(Nc1cccc(C2SCCS2)c1)c1ccc(F)c([O-])c1 ZINC001135802544 1048890080 /nfs/dbraw/zinc/89/00/80/1048890080.db2.gz UZAXIOLEFGLVIO-UHFFFAOYSA-N -1 1 335.425 4.262 20 0 EIADMM Cc1cc(C)cc(Oc2cccc(F)c2[N-]C(=O)c2csnn2)c1 ZINC001144945103 1048899276 /nfs/dbraw/zinc/89/92/76/1048899276.db2.gz AVNQLNJXMGPGBZ-UHFFFAOYSA-N -1 1 343.383 4.339 20 0 EIADMM C[C@@]1(c2cccc(F)c2)CCN(C(=O)c2ccc3ccccc3c2[O-])C1 ZINC001145053215 1048977215 /nfs/dbraw/zinc/97/72/15/1048977215.db2.gz FWODDNTWWXQHTI-JOCHJYFZSA-N -1 1 349.405 4.488 20 0 EIADMM Cc1ccccc1[C@H](NC(=O)c1ncc2ccccc2c1[O-])C(C)C ZINC001145054072 1048983301 /nfs/dbraw/zinc/98/33/01/1048983301.db2.gz HCMQCGLWUGVARY-GOSISDBHSA-N -1 1 334.419 4.376 20 0 EIADMM CC(C)c1ccc2c(c1)CN(C(=O)c1ncc3ccccc3c1[O-])CC2 ZINC001146363686 1049018997 /nfs/dbraw/zinc/01/89/97/1049018997.db2.gz SWPXZZCJXGNURL-UHFFFAOYSA-N -1 1 346.430 4.262 20 0 EIADMM COc1ccc([C@@H](NC(=O)c2cc(Cl)ccc2[O-])C(C)C)cc1 ZINC001135978576 1049030324 /nfs/dbraw/zinc/03/03/24/1049030324.db2.gz RMBMIAVPUFGSGC-KRWDZBQOSA-N -1 1 333.815 4.181 20 0 EIADMM Cc1cccnc1[C@@H](NC(=O)c1ccc2ccccc2c1[O-])C(C)C ZINC001147035408 1049077694 /nfs/dbraw/zinc/07/76/94/1049077694.db2.gz VFPHEQPYJAGDRT-SFHVURJKSA-N -1 1 334.419 4.376 20 0 EIADMM CSc1ccc([O-])c(C(=O)Nc2ccc(OC(C)C)c(C)c2)c1 ZINC001147188760 1049099702 /nfs/dbraw/zinc/09/97/02/1049099702.db2.gz GVRWDISXTZOTAH-UHFFFAOYSA-N -1 1 331.437 4.462 20 0 EIADMM CC(=O)c1cc(F)c([N-]C(=O)c2cc(C)oc2C(F)(F)F)c(F)c1 ZINC000350625183 1049114191 /nfs/dbraw/zinc/11/41/91/1049114191.db2.gz IJZUFXOQJKBPLE-UHFFFAOYSA-N -1 1 347.239 4.340 20 0 EIADMM CC[C@@H](NC(=O)c1ccc(Cl)cc1[O-])c1ccc(F)cc1F ZINC001147228039 1049115771 /nfs/dbraw/zinc/11/57/71/1049115771.db2.gz YFERCFNVJRUWSD-CQSZACIVSA-N -1 1 325.742 4.205 20 0 EIADMM Cc1ccc(C[C@@H](C)N(C)C(=O)c2ccc3ccc(O)cc3c2[O-])cc1 ZINC001147276202 1049123867 /nfs/dbraw/zinc/12/38/67/1049123867.db2.gz GETYILRCXSKYBU-OAHLLOKOSA-N -1 1 349.430 4.263 20 0 EIADMM C[C@H]1CC(NC(=O)c2cc(-c3ccc(C=O)o3)ccc2[O-])C[C@H](C)C1 ZINC001147331812 1049126612 /nfs/dbraw/zinc/12/66/12/1049126612.db2.gz PUQXNQDADZMLAR-CHWSQXEVSA-N -1 1 341.407 4.019 20 0 EIADMM CC(C)Cc1ccc([C@H](NC(=O)c2ccc([O-])cn2)C(C)C)cc1 ZINC001136136053 1049146031 /nfs/dbraw/zinc/14/60/31/1049146031.db2.gz AZILAILXHIMINT-LJQANCHMSA-N -1 1 326.440 4.113 20 0 EIADMM CC(=CC(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)c1ccccc1C ZINC001136191097 1049270168 /nfs/dbraw/zinc/27/01/68/1049270168.db2.gz ZRPJPRMJXAKPQG-KAMYIIQDSA-N -1 1 333.391 4.133 20 0 EIADMM O=C(c1cc(Cl)ccc1[O-])N1CCCCC[C@@H]1c1ccncc1 ZINC001136232781 1049342222 /nfs/dbraw/zinc/34/22/22/1049342222.db2.gz VIBDQAVILIKHOI-MRXNPFEDSA-N -1 1 330.815 4.198 20 0 EIADMM O=C(CSCc1ccc(Cl)cc1)Nc1c([O-])cccc1F ZINC000609851208 1049356418 /nfs/dbraw/zinc/35/64/18/1049356418.db2.gz UCZSPKYEXYOYAQ-UHFFFAOYSA-N -1 1 325.792 4.057 20 0 EIADMM C[C@]1(CF)CC(F)(F)CN1C(=O)c1cccc(-c2ccccc2)c1[O-] ZINC001148867027 1049391063 /nfs/dbraw/zinc/39/10/63/1049391063.db2.gz KRDFDUYQIQAPCQ-GOSISDBHSA-N -1 1 349.352 4.269 20 0 EIADMM C[C@]1(F)CCCCN(C(=O)c2cccc(-c3ccccc3)c2[O-])C1 ZINC001148867460 1049391092 /nfs/dbraw/zinc/39/10/92/1049391092.db2.gz VQQSOJIXUYRTRS-FQEVSTJZSA-N -1 1 327.399 4.414 20 0 EIADMM Cc1cc2c(cn1)[C@H](NC(=O)c1cccc(-c3ccccc3)c1[O-])CC2 ZINC001148872944 1049392770 /nfs/dbraw/zinc/39/27/70/1049392770.db2.gz METPSKCAERTKCS-HXUWFJFHSA-N -1 1 344.414 4.180 20 0 EIADMM Cc1cc(Cl)cnc1[N-]S(=O)(=O)/C=C\c1ccccc1Cl ZINC000812331016 1049430499 /nfs/dbraw/zinc/43/04/99/1049430499.db2.gz FEBRUBQTJFOARR-SREVYHEPSA-N -1 1 343.235 4.109 20 0 EIADMM CCCCOc1ccccc1NC(=O)Cc1ccc([O-])c(Cl)c1 ZINC001136369174 1049544034 /nfs/dbraw/zinc/54/40/34/1049544034.db2.gz AXBULTQRNLBWIS-UHFFFAOYSA-N -1 1 333.815 4.406 20 0 EIADMM Cc1ncoc1-c1noc(-c2cc(Oc3ccccc3)ccc2[O-])n1 ZINC000820897184 1049575653 /nfs/dbraw/zinc/57/56/53/1049575653.db2.gz GRLNSKZAGPTUPG-UHFFFAOYSA-N -1 1 335.319 4.198 20 0 EIADMM COc1cnc(C=Cc2ccc(-c3ccc(F)cc3)s2)[n-]c1=O ZINC000821009281 1049593993 /nfs/dbraw/zinc/59/39/93/1049593993.db2.gz YSMKGDALNAVBAD-CLFYSBASSA-N -1 1 328.368 4.229 20 0 EIADMM CCOc1ccccc1[C@H](CC)NC(=O)Cc1ccc([O-])c(Cl)c1 ZINC001136504448 1049696996 /nfs/dbraw/zinc/69/69/96/1049696996.db2.gz BEFOBTXOGAEVAN-INIZCTEOSA-N -1 1 347.842 4.254 20 0 EIADMM CC(C)[C@H]1CCC[C@@H](NC(=O)c2cc(Br)ccc2[O-])C1 ZINC001136701879 1049839541 /nfs/dbraw/zinc/83/95/41/1049839541.db2.gz OSSOVKOVCRFPSX-WCQYABFASA-N -1 1 340.261 4.099 20 0 EIADMM O=C(c1ccc(C(F)(F)F)c([O-])c1)N1CCC(c2ccco2)CC1 ZINC000617386066 1049987508 /nfs/dbraw/zinc/98/75/08/1049987508.db2.gz VDDJKLOGJNAGOD-UHFFFAOYSA-N -1 1 339.313 4.024 20 0 EIADMM O=C(Nc1cc([O-])c(Cl)cc1F)Nc1c(F)cc(F)cc1F ZINC001186056610 1050229585 /nfs/dbraw/zinc/22/95/85/1050229585.db2.gz ICVLALORLOLOTQ-UHFFFAOYSA-N -1 1 334.656 4.246 20 0 EIADMM Cc1ccc(-c2noc(-c3ncc(C(F)(F)F)[n-]3)n2)cc1Cl ZINC001212689432 1050229816 /nfs/dbraw/zinc/22/98/16/1050229816.db2.gz DRYYWDLPZLKAEA-UHFFFAOYSA-N -1 1 328.681 4.107 20 0 EIADMM Cc1ccc(-c2noc(-c3nc(C(F)(F)F)c[n-]3)n2)cc1Cl ZINC001212689432 1050229825 /nfs/dbraw/zinc/22/98/25/1050229825.db2.gz DRYYWDLPZLKAEA-UHFFFAOYSA-N -1 1 328.681 4.107 20 0 EIADMM CCCCOc1c(NC(=O)c2ccc([O-])cc2F)ccc(F)c1F ZINC001186328482 1050286882 /nfs/dbraw/zinc/28/68/82/1050286882.db2.gz DGBSZOCMCGYQTC-UHFFFAOYSA-N -1 1 339.313 4.241 20 0 EIADMM C[C@H](NC(=O)Nc1cccc([O-])c1Br)C1CCCCC1 ZINC001186398390 1050308802 /nfs/dbraw/zinc/30/88/02/1050308802.db2.gz KKDPUEVGZYTVMB-JTQLQIEISA-N -1 1 341.249 4.245 20 0 EIADMM O=S(=O)([N-]c1ccc(-c2ncc[nH]2)cc1)c1cccc2ccccc21 ZINC000145985051 1050319112 /nfs/dbraw/zinc/31/91/12/1050319112.db2.gz ZJIVEEYINWUOSY-UHFFFAOYSA-N -1 1 349.415 4.031 20 0 EIADMM O=C(Nc1cc([O-])c(Cl)cc1F)N[C@@H]1CCCc2ccccc21 ZINC001186458326 1050340880 /nfs/dbraw/zinc/34/08/80/1050340880.db2.gz SWRITRUAZGDNOY-CQSZACIVSA-N -1 1 334.778 4.384 20 0 EIADMM O=C(NCc1ccc(C(F)(F)F)cc1)Nc1ccc(Cl)cc1[O-] ZINC001186816068 1050425505 /nfs/dbraw/zinc/42/55/05/1050425505.db2.gz OHRZQSZSYUIOJF-UHFFFAOYSA-N -1 1 344.720 4.386 20 0 EIADMM [O-]c1cnccc1-c1nc(-c2ccc(Oc3ccc(F)cc3)cc2)no1 ZINC001212721256 1050430534 /nfs/dbraw/zinc/43/05/34/1050430534.db2.gz GRPAFGOWCGMUAE-UHFFFAOYSA-N -1 1 349.321 4.436 20 0 EIADMM CC(C)c1ccc(C(=O)Nc2ccc(F)cc2NC2CC2)c([O-])c1 ZINC001150789381 1050435853 /nfs/dbraw/zinc/43/58/53/1050435853.db2.gz GHFIFHZEKRJDCY-UHFFFAOYSA-N -1 1 328.387 4.481 20 0 EIADMM O=C(Nc1cccc(Br)c1)Nc1cc(F)cc(F)c1[O-] ZINC001187469147 1050545262 /nfs/dbraw/zinc/54/52/62/1050545262.db2.gz DCUTZGWIVQOJLF-UHFFFAOYSA-N -1 1 343.127 4.077 20 0 EIADMM COc1ccc(S(=O)(=O)[N-]c2ccc(F)cc2C)c2ccccc12 ZINC000055564358 1050554049 /nfs/dbraw/zinc/55/40/49/1050554049.db2.gz CFSBRGMYPMWPKU-UHFFFAOYSA-N -1 1 345.395 4.097 20 0 EIADMM Cc1ccccc1-c1cccc(NC(=O)c2n[n-]nc2C(F)(F)F)c1 ZINC001187766025 1050621464 /nfs/dbraw/zinc/62/14/64/1050621464.db2.gz BVULXLIBYGMIOL-UHFFFAOYSA-N -1 1 346.312 4.051 20 0 EIADMM COc1cc(OC)c(Nc2c(Cl)ccc([O-])c2Cl)c(OC)c1 ZINC001173910429 1050622913 /nfs/dbraw/zinc/62/29/13/1050622913.db2.gz VKGBFQHSLJINPL-UHFFFAOYSA-N -1 1 344.194 4.468 20 0 EIADMM O=C(N[C@@H]1CCC[C@@H](c2ccccc2)CC1)c1cc(F)ccc1[O-] ZINC001179337232 1050677366 /nfs/dbraw/zinc/67/73/66/1050677366.db2.gz ZEJZNHYUGVBTCV-NVXWUHKLSA-N -1 1 327.399 4.378 20 0 EIADMM COc1ccc(OC)c(OC)c1Nc1cc(Cl)c([O-])cc1Cl ZINC001174055242 1050693883 /nfs/dbraw/zinc/69/38/83/1050693883.db2.gz SHKZLMISCIFOBC-UHFFFAOYSA-N -1 1 344.194 4.468 20 0 EIADMM COc1ccc(Nc2ccc(F)c(Br)c2[O-])c(C)c1 ZINC001174023256 1050707101 /nfs/dbraw/zinc/70/71/01/1050707101.db2.gz AIUIJMMJVYAXOU-UHFFFAOYSA-N -1 1 326.165 4.354 20 0 EIADMM Cc1cc(Br)oc1C(=O)Nc1cc(F)c([O-])cc1Cl ZINC001179656796 1050739164 /nfs/dbraw/zinc/73/91/64/1050739164.db2.gz WPCASTMFJKINQR-UHFFFAOYSA-N -1 1 348.555 4.101 20 0 EIADMM O=C(Nc1cc(F)c([O-])cc1Cl)[C@H]1C[C@H]1c1c(F)cccc1F ZINC001179657050 1050741119 /nfs/dbraw/zinc/74/11/19/1050741119.db2.gz ZWURZPSWTPDKLW-SFYZADRCSA-N -1 1 341.716 4.205 20 0 EIADMM Cn1c(NC(=O)c2ccc([O-])c(C(F)(F)F)c2)cc2ccccc21 ZINC001188571782 1050795421 /nfs/dbraw/zinc/79/54/21/1050795421.db2.gz DKDVBWULMFSIPW-UHFFFAOYSA-N -1 1 334.297 4.155 20 0 EIADMM O=C(Nc1ccccc1-c1ncc[nH]1)c1ccc([O-])c(C(F)(F)F)c1 ZINC001188589301 1050810961 /nfs/dbraw/zinc/81/09/61/1050810961.db2.gz QTHGFFAEBLMAES-UHFFFAOYSA-N -1 1 347.296 4.053 20 0 EIADMM O=C(c1cccc(Nc2ccc(F)c(F)c2[O-])c1)N1CCCCC1 ZINC001174174858 1050816308 /nfs/dbraw/zinc/81/63/08/1050816308.db2.gz BGHUEPCCTIZYBO-UHFFFAOYSA-N -1 1 332.350 4.040 20 0 EIADMM O=S(=O)([N-]C/C=C/c1ccccc1)c1cc(Cl)sc1Cl ZINC001188634103 1050819059 /nfs/dbraw/zinc/81/90/59/1050819059.db2.gz OGCDDDUIVCNRIU-QPJJXVBHSA-N -1 1 348.276 4.047 20 0 EIADMM [O-]c1c(Cl)cc(Br)cc1Nc1ccc2n[nH]cc2c1 ZINC001174275780 1050877623 /nfs/dbraw/zinc/87/76/23/1050877623.db2.gz IDESOCDXSNVQNW-UHFFFAOYSA-N -1 1 338.592 4.428 20 0 EIADMM CC(C)(C)c1cccc(C(=O)Nc2ccc(-n3ccc(=O)[n-]3)cc2)c1 ZINC001188984387 1050878074 /nfs/dbraw/zinc/87/80/74/1050878074.db2.gz YYUWNBSEDOZIRB-UHFFFAOYSA-N -1 1 335.407 4.128 20 0 EIADMM CCOc1ccc(C(F)(F)F)cc1NC(=O)c1ccccc1[O-] ZINC000619905026 1050940245 /nfs/dbraw/zinc/94/02/45/1050940245.db2.gz PPOMHBHXMJRUOW-UHFFFAOYSA-N -1 1 325.286 4.062 20 0 EIADMM COc1ccc([N-]S(=O)(=O)c2ccc(F)c3ccccc32)c(C)c1 ZINC001189346928 1050956352 /nfs/dbraw/zinc/95/63/52/1050956352.db2.gz ATPXGUQURUWQPF-UHFFFAOYSA-N -1 1 345.395 4.097 20 0 EIADMM COC(=O)c1ccc(Nc2c(Cl)ccc([O-])c2Cl)cc1OC ZINC001174429563 1050961758 /nfs/dbraw/zinc/96/17/58/1050961758.db2.gz GVTIMXBTBQRNFC-UHFFFAOYSA-N -1 1 342.178 4.238 20 0 EIADMM COc1ccc([N-]S(=O)(=O)c2ccc(F)c3ccccc32)cc1C ZINC001189386002 1050976383 /nfs/dbraw/zinc/97/63/83/1050976383.db2.gz RRJGJQMJMBUCSJ-UHFFFAOYSA-N -1 1 345.395 4.097 20 0 EIADMM CCS(=O)(=O)c1ccc(Nc2cc(Cl)c([O-])cc2Cl)cc1 ZINC001174464293 1051009758 /nfs/dbraw/zinc/00/97/58/1051009758.db2.gz VZEMHHRRJDJESM-UHFFFAOYSA-N -1 1 346.235 4.236 20 0 EIADMM O=C(CCn1ccc2ccccc21)Nc1cccc(C(F)(F)F)c1[O-] ZINC001180669486 1051052239 /nfs/dbraw/zinc/05/22/39/1051052239.db2.gz UEZGEMXOFGKDHK-UHFFFAOYSA-N -1 1 348.324 4.395 20 0 EIADMM O=C(NCc1ccc(Cl)cc1Cl)Nc1cc(F)c(F)cc1[O-] ZINC001190093531 1051112633 /nfs/dbraw/zinc/11/26/33/1051112633.db2.gz RJQKGMJJOOPDIA-UHFFFAOYSA-N -1 1 347.148 4.299 20 0 EIADMM O=C(NCc1ccc(Cl)cc1Cl)Nc1cc([O-])c(F)cc1F ZINC001190093223 1051112745 /nfs/dbraw/zinc/11/27/45/1051112745.db2.gz KZMRQGRMARYHCE-UHFFFAOYSA-N -1 1 347.148 4.299 20 0 EIADMM O=c1cc(-c2ccccc2)nc(SCc2ncc(Cl)s2)[n-]1 ZINC001190200749 1051137056 /nfs/dbraw/zinc/13/70/56/1051137056.db2.gz CLCVYWHNSBDXQT-UHFFFAOYSA-N -1 1 335.841 4.251 20 0 EIADMM [O-]c1c(Cl)cc(Br)cc1Nc1ccc(O)c(F)c1 ZINC001174740808 1051157562 /nfs/dbraw/zinc/15/75/62/1051157562.db2.gz RRGDEMCARHZVJA-UHFFFAOYSA-N -1 1 332.556 4.396 20 0 EIADMM CCC(C)(C)c1ccc(S(=O)(=O)[N-]c2cccc([C@H](C)O)c2)cc1 ZINC001190423352 1051180459 /nfs/dbraw/zinc/18/04/59/1051180459.db2.gz SLBRFGIQEPFPQS-AWEZNQCLSA-N -1 1 347.480 4.228 20 0 EIADMM CCC(C)(C)c1ccc(S(=O)(=O)[N-]c2ncc(C)cc2F)cc1 ZINC001190432151 1051183609 /nfs/dbraw/zinc/18/36/09/1051183609.db2.gz PPYGUQFPHRLXIJ-UHFFFAOYSA-N -1 1 336.432 4.018 20 0 EIADMM CC1(C)CCC[C@H]1C[N-]S(=O)(=O)c1cc(Cl)sc1Cl ZINC001190611969 1051232597 /nfs/dbraw/zinc/23/25/97/1051232597.db2.gz KAAQMGFYVZJUGG-QMMMGPOBSA-N -1 1 342.313 4.160 20 0 EIADMM CC[C@H](c1ccncc1)N(CC)C(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC000153871581 1051237922 /nfs/dbraw/zinc/23/79/22/1051237922.db2.gz BVUROCGBALQHKW-OAHLLOKOSA-N -1 1 348.830 4.063 20 0 EIADMM Cc1ncc(NC(=O)c2ccc(C(C)C)cc2[O-])cc1Br ZINC001181532796 1051246907 /nfs/dbraw/zinc/24/69/07/1051246907.db2.gz YQVYPSUCEAXBJS-UHFFFAOYSA-N -1 1 349.228 4.234 20 0 EIADMM O=C(Nc1ccc(OC(F)(F)F)cc1)Nc1cc([O-])c(F)cc1F ZINC001190746008 1051270698 /nfs/dbraw/zinc/27/06/98/1051270698.db2.gz NATQFQQHDFMVDM-UHFFFAOYSA-N -1 1 348.227 4.213 20 0 EIADMM COc1cc(C(=O)Nc2cccc3cc(O)ccc32)cc(Cl)c1[O-] ZINC001191148734 1051364987 /nfs/dbraw/zinc/36/49/87/1051364987.db2.gz QTQYSIBECDAAKZ-UHFFFAOYSA-N -1 1 343.766 4.165 20 0 EIADMM COc1cc(C(=O)Nc2cc3ccccc3cc2O)cc(Cl)c1[O-] ZINC001191146301 1051380731 /nfs/dbraw/zinc/38/07/31/1051380731.db2.gz DRWUWHJBBHCTFU-UHFFFAOYSA-N -1 1 343.766 4.165 20 0 EIADMM CCCCc1ccc(S(=O)(=O)[N-]c2ccc3c(c2)N=NC3)cc1 ZINC001191253245 1051396227 /nfs/dbraw/zinc/39/62/27/1051396227.db2.gz KFZIJQHIURKASY-UHFFFAOYSA-N -1 1 329.425 4.427 20 0 EIADMM O=C(Nc1cc(F)cc(C(F)(F)F)c1)Nc1ccc(F)cc1[O-] ZINC001191590160 1051483781 /nfs/dbraw/zinc/48/37/81/1051483781.db2.gz YNFAERIMLOPARB-UHFFFAOYSA-N -1 1 332.228 4.333 20 0 EIADMM O=C(Nc1cc(F)cc(C(F)(F)F)c1)Nc1c([O-])cccc1F ZINC001191589150 1051484091 /nfs/dbraw/zinc/48/40/91/1051484091.db2.gz MQINTBGDFGVALT-UHFFFAOYSA-N -1 1 332.228 4.333 20 0 EIADMM CCS(=O)(=O)c1ccc([O-])c(Nc2ccc(CC(C)C)cc2)c1 ZINC001175295407 1051492091 /nfs/dbraw/zinc/49/20/91/1051492091.db2.gz BJBAOWNXXCFSNB-UHFFFAOYSA-N -1 1 333.453 4.128 20 0 EIADMM C=Cc1ccc([N-]S(=O)(=O)c2ccc3cc(OC)ccc3c2)cc1 ZINC001191963830 1051601383 /nfs/dbraw/zinc/60/13/83/1051601383.db2.gz VBMVVUIJEIZAPL-UHFFFAOYSA-N -1 1 339.416 4.292 20 0 EIADMM Cc1c(Cl)cccc1S(=O)(=O)[N-]c1ccc(-c2ncco2)cc1 ZINC000157755696 1051671391 /nfs/dbraw/zinc/67/13/91/1051671391.db2.gz HRGMVEUZMORUSC-UHFFFAOYSA-N -1 1 348.811 4.104 20 0 EIADMM CC(C)(C)c1ccc(C(=O)Nc2cccc(Cl)c2CO)c([O-])c1 ZINC001192322937 1051691631 /nfs/dbraw/zinc/69/16/31/1051691631.db2.gz SWXFTRKYMMVMED-UHFFFAOYSA-N -1 1 333.815 4.088 20 0 EIADMM CSc1ncc(Nc2c(Cl)ccc(Br)c2[O-])cn1 ZINC001175652141 1051693191 /nfs/dbraw/zinc/69/31/91/1051693191.db2.gz WHTKLCHFZWPLBU-UHFFFAOYSA-N -1 1 346.637 4.064 20 0 EIADMM COc1cc(Nc2cc(Br)cc(Cl)c2[O-])c(F)cn1 ZINC001175692709 1051731726 /nfs/dbraw/zinc/73/17/26/1051731726.db2.gz GLOSECAJJLHRSR-UHFFFAOYSA-N -1 1 347.571 4.094 20 0 EIADMM Nc1cc(C(F)(F)F)c(Nc2cc(Cl)cc(Cl)c2[O-])cn1 ZINC001175717397 1051738575 /nfs/dbraw/zinc/73/85/75/1051738575.db2.gz JEVRJCJHDWSDEO-UHFFFAOYSA-N -1 1 338.116 4.439 20 0 EIADMM CC[C@@H](CCc1ccccc1)[N-]S(=O)(=O)c1cc2ccccc2o1 ZINC001192551008 1051756373 /nfs/dbraw/zinc/75/63/73/1051756373.db2.gz AALRVGIKKKBDFJ-KRWDZBQOSA-N -1 1 343.448 4.123 20 0 EIADMM O=C(NC1c2ccccc2-c2ccccc21)c1c(F)ccc([O-])c1F ZINC001192553076 1051757446 /nfs/dbraw/zinc/75/74/46/1051757446.db2.gz VQLJYCTWZVEBSS-UHFFFAOYSA-N -1 1 337.325 4.170 20 0 EIADMM O=C(Nc1cnc2cc(Cl)ccc2c1)c1c(F)ccc([O-])c1F ZINC001192525653 1051761879 /nfs/dbraw/zinc/76/18/79/1051761879.db2.gz YKZPMKAAPVFEDD-UHFFFAOYSA-N -1 1 334.709 4.124 20 0 EIADMM C[C@@H](Cc1ccccc1)n1cccc1C(=O)Nc1ccc(F)cc1[O-] ZINC001183054800 1051779028 /nfs/dbraw/zinc/77/90/28/1051779028.db2.gz UJDOVJZVMFJDAT-AWEZNQCLSA-N -1 1 338.382 4.389 20 0 EIADMM O=C(Nc1ccccc1-c1nccs1)c1cc([O-])cc(F)c1F ZINC001192670761 1051788466 /nfs/dbraw/zinc/78/84/66/1051788466.db2.gz NJMQELDJZVJVKX-UHFFFAOYSA-N -1 1 332.331 4.046 20 0 EIADMM O=C(NCc1cccc(-c2cccs2)c1)c1cc([O-])cc(F)c1F ZINC001192678442 1051790613 /nfs/dbraw/zinc/79/06/13/1051790613.db2.gz BBGZBTIFHCYVTP-UHFFFAOYSA-N -1 1 345.370 4.329 20 0 EIADMM Cc1c(Cl)cc(NC(=O)Cc2ccc([S-])cc2)c(O)c1Cl ZINC001183190037 1051804175 /nfs/dbraw/zinc/80/41/75/1051804175.db2.gz ZFECXSJRLWAFFT-UHFFFAOYSA-N -1 1 342.247 4.477 20 0 EIADMM [O-]c1c(F)c(F)ccc1Nc1cccnc1OCc1ccccc1 ZINC001175876676 1051808313 /nfs/dbraw/zinc/80/83/13/1051808313.db2.gz COEZLTYKQFVTNA-UHFFFAOYSA-N -1 1 328.318 4.388 20 0 EIADMM [O-]c1cc(F)cc(F)c1Nc1cccnc1OCc1ccccc1 ZINC001175876985 1051809758 /nfs/dbraw/zinc/80/97/58/1051809758.db2.gz RHLJQYYHYIRYER-UHFFFAOYSA-N -1 1 328.318 4.388 20 0 EIADMM Cc1ccc(/C=C/S(=O)(=O)[N-]c2ccccc2OC(F)F)cc1 ZINC000071974347 1051891451 /nfs/dbraw/zinc/89/14/51/1051891451.db2.gz JIKRNUCYXCSKTF-ZHACJKMWSA-N -1 1 339.363 4.009 20 0 EIADMM CN(C)C(=O)c1ccc(F)c(Nc2c(Cl)ccc([O-])c2Cl)c1 ZINC001176047348 1051894893 /nfs/dbraw/zinc/89/48/93/1051894893.db2.gz ZDSXHCNGZPTOLV-UHFFFAOYSA-N -1 1 343.185 4.284 20 0 EIADMM O=C(Nc1cccc2c1C(=O)CCC2)c1ccc([O-])cc1C(F)(F)F ZINC001193747665 1051992464 /nfs/dbraw/zinc/99/24/64/1051992464.db2.gz MTMQWMAGMKANIM-UHFFFAOYSA-N -1 1 349.308 4.182 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2cccc([C@H](C)O)c2)c2ccccc12 ZINC001193825006 1052005199 /nfs/dbraw/zinc/00/51/99/1052005199.db2.gz REUVFRZJGVYEOJ-AWEZNQCLSA-N -1 1 341.432 4.002 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2cccc3cnccc32)c2ccccc12 ZINC001193824965 1052005903 /nfs/dbraw/zinc/00/59/03/1052005903.db2.gz PEQBLAYTLJECHK-UHFFFAOYSA-N -1 1 348.427 4.497 20 0 EIADMM CC(=O)OCc1cccc(Cl)c1[N-]c1nc(C(C)(C)C)ns1 ZINC001212774527 1052040370 /nfs/dbraw/zinc/04/03/70/1052040370.db2.gz ROWKFZZUSGTRIX-UHFFFAOYSA-N -1 1 339.848 4.296 20 0 EIADMM Cc1c(Cl)cccc1NC(=O)Nc1ccc(-n2ccc(=O)[n-]2)cc1 ZINC001184687445 1052090919 /nfs/dbraw/zinc/09/09/19/1052090919.db2.gz YUIVXUVNVWEBIR-UHFFFAOYSA-N -1 1 342.786 4.184 20 0 EIADMM CSc1ncc(C(=O)Nc2cccc(C(F)(F)F)c2[O-])cc1C ZINC001194333106 1052133228 /nfs/dbraw/zinc/13/32/28/1052133228.db2.gz YGKRYZPYFUUKHQ-UHFFFAOYSA-N -1 1 342.342 4.089 20 0 EIADMM CCc1cc(Nc2c(F)cc(F)c([O-])c2F)n(-c2ccccc2)n1 ZINC001176664927 1052157237 /nfs/dbraw/zinc/15/72/37/1052157237.db2.gz YUJPLVHFURZOLT-UHFFFAOYSA-N -1 1 333.313 4.301 20 0 EIADMM [O-]c1c(F)cc(F)c(Nc2ccnn2-c2ccccc2Cl)c1F ZINC001176664266 1052157518 /nfs/dbraw/zinc/15/75/18/1052157518.db2.gz RRRBZBUJVVIVFA-UHFFFAOYSA-N -1 1 339.704 4.392 20 0 EIADMM Cc1cnn(-c2ccccc2F)c1Nc1c(F)cc(F)c([O-])c1F ZINC001176664692 1052158138 /nfs/dbraw/zinc/15/81/38/1052158138.db2.gz XOZPKZPPYIMRBJ-UHFFFAOYSA-N -1 1 337.276 4.186 20 0 EIADMM COc1ccc(-c2cc(Nc3c(F)cc(F)c([O-])c3F)on2)cc1 ZINC001176663869 1052158229 /nfs/dbraw/zinc/15/82/29/1052158229.db2.gz MSLVJUYHKHGFFN-UHFFFAOYSA-N -1 1 336.269 4.217 20 0 EIADMM [O-]c1c(F)cc(F)c(Nc2cc(F)cc(Br)c2)c1F ZINC001176672046 1052159053 /nfs/dbraw/zinc/15/90/53/1052159053.db2.gz RVPJADJDBIWTAW-UHFFFAOYSA-N -1 1 336.082 4.455 20 0 EIADMM CC1(C)COC(c2ccc(Nc3c(F)cc(F)c([O-])c3F)cc2)=N1 ZINC001176673080 1052159424 /nfs/dbraw/zinc/15/94/24/1052159424.db2.gz DLEGIVHICORCBH-UHFFFAOYSA-N -1 1 336.313 4.109 20 0 EIADMM COCCCOc1ccc(Nc2c(F)cc(F)c([O-])c2F)cc1F ZINC001176671365 1052159772 /nfs/dbraw/zinc/15/97/72/1052159772.db2.gz BBTLMEAZLFDDLX-UHFFFAOYSA-N -1 1 345.292 4.108 20 0 EIADMM Cc1cc(N)c(Nc2c(F)cc(F)c([O-])c2F)c(Br)c1 ZINC001176672425 1052160251 /nfs/dbraw/zinc/16/02/51/1052160251.db2.gz KLGXSAHHQCWCKF-UHFFFAOYSA-N -1 1 347.134 4.206 20 0 EIADMM [O-]c1c(F)cc(F)c(Nc2cccc(F)c2N2CCCC2)c1F ZINC001176674108 1052161187 /nfs/dbraw/zinc/16/11/87/1052161187.db2.gz PYIKRGLGIWHIHC-UHFFFAOYSA-N -1 1 326.293 4.292 20 0 EIADMM CCOC(=O)CCc1ccc(Nc2c(F)cc(F)c([O-])c2F)cc1 ZINC001176674830 1052161418 /nfs/dbraw/zinc/16/14/18/1052161418.db2.gz XMMMDHAGRIMFPD-UHFFFAOYSA-N -1 1 339.313 4.049 20 0 EIADMM [O-]c1c(F)cc(F)c(Nc2cc3nsnc3cc2Cl)c1F ZINC001176674134 1052161505 /nfs/dbraw/zinc/16/15/05/1052161505.db2.gz RAEYGOCYKGEASX-UHFFFAOYSA-N -1 1 331.706 4.211 20 0 EIADMM Cc1nc(Nc2c(F)cc(F)c([O-])c2F)ccc1Br ZINC001176661777 1052171368 /nfs/dbraw/zinc/17/13/68/1052171368.db2.gz CWNMZCWUOYFCBK-UHFFFAOYSA-N -1 1 333.107 4.019 20 0 EIADMM COc1ccc(-n2ncc(C)c2Nc2c(F)cc(F)c([O-])c2F)cc1 ZINC001176662843 1052173213 /nfs/dbraw/zinc/17/32/13/1052173213.db2.gz AJELSHNJGLMWRF-UHFFFAOYSA-N -1 1 349.312 4.056 20 0 EIADMM Cc1cccc(C)c1S(=O)(=O)[N-]c1ccc(-c2nccs2)cc1 ZINC001194639828 1052183593 /nfs/dbraw/zinc/18/35/93/1052183593.db2.gz VATUPWFTYXSTIG-UHFFFAOYSA-N -1 1 344.461 4.228 20 0 EIADMM Cc1noc(C)c1NC(=O)Nc1c([O-])cc(C(F)(F)F)cc1Cl ZINC001185182657 1052187613 /nfs/dbraw/zinc/18/76/13/1052187613.db2.gz AAKDEJHCVHRUGD-UHFFFAOYSA-N -1 1 349.696 4.313 20 0 EIADMM Cc1c(Cl)cccc1[N-]S(=O)(=O)c1ccc(-c2cnco2)cc1 ZINC001185186111 1052189566 /nfs/dbraw/zinc/18/95/66/1052189566.db2.gz SNKKWBPCWHQLDN-UHFFFAOYSA-N -1 1 348.811 4.104 20 0 EIADMM CCC(CC)Oc1ccc([N-]S(=O)(=O)c2ccsc2)cc1 ZINC001185392082 1052227674 /nfs/dbraw/zinc/22/76/74/1052227674.db2.gz JDNCXKZNUWLKHS-UHFFFAOYSA-N -1 1 325.455 4.116 20 0 EIADMM COc1ccc(C(=O)Nc2ccc(NC3CCCCC3)cc2)c([O-])c1 ZINC000623833863 1052822053 /nfs/dbraw/zinc/82/20/53/1052822053.db2.gz YJDSPHDKEBHQOY-UHFFFAOYSA-N -1 1 340.423 4.398 20 0 EIADMM CC1(C)[C@@H](C(F)(F)F)CCN1Cc1cccc(C(=O)[O-])c1Cl ZINC000382211068 1053160917 /nfs/dbraw/zinc/16/09/17/1053160917.db2.gz SQWBCVYSVQXJHQ-NSHDSACASA-N -1 1 335.753 4.201 20 0 EIADMM CC(C)c1cccc(S(=O)(=O)[N-]c2ccc3ccncc3c2)c1 ZINC001195156061 1053306690 /nfs/dbraw/zinc/30/66/90/1053306690.db2.gz FOOUBPRRDGTMBC-UHFFFAOYSA-N -1 1 326.421 4.159 20 0 EIADMM O=C(N[C@H](c1ccccc1)C1CCCC1)c1cc([O-])cnc1Cl ZINC001195313197 1053374809 /nfs/dbraw/zinc/37/48/09/1053374809.db2.gz SDMWPTPYGGGVNX-MRXNPFEDSA-N -1 1 330.815 4.102 20 0 EIADMM O=C(NCc1cccc(-c2cccs2)c1)c1cc([O-])cnc1Cl ZINC001195312446 1053374980 /nfs/dbraw/zinc/37/49/80/1053374980.db2.gz GLUJQQKPVMEDPP-UHFFFAOYSA-N -1 1 344.823 4.099 20 0 EIADMM O=C(NCc1ccc(OC(F)F)cc1)c1cc2ccccc2cc1[O-] ZINC000011510312 1053613537 /nfs/dbraw/zinc/61/35/37/1053613537.db2.gz YPTKUFYRRKCUOU-UHFFFAOYSA-N -1 1 343.329 4.077 20 0 EIADMM Cc1c(F)ccc(F)c1C(=O)Nc1cccc(C(F)(F)F)c1[O-] ZINC001196742035 1053746099 /nfs/dbraw/zinc/74/60/99/1053746099.db2.gz ZRLMJTHEGJNCOS-UHFFFAOYSA-N -1 1 331.240 4.250 20 0 EIADMM O=C(Nc1cc(F)c([O-])cc1Cl)[C@H]1CCC[C@H](C(F)(F)F)C1 ZINC000885674348 1053788119 /nfs/dbraw/zinc/78/81/19/1053788119.db2.gz LZIAEALDUDBVIX-YUMQZZPRSA-N -1 1 339.716 4.492 20 0 EIADMM CC[C@@H](OC1CCCCC1)C(=O)Nc1cc(F)c([O-])cc1Cl ZINC000885676926 1053799640 /nfs/dbraw/zinc/79/96/40/1053799640.db2.gz WVVWBCXZRDWBBY-OAHLLOKOSA-N -1 1 329.799 4.251 20 0 EIADMM CC1(C)CC[C@H]1C(=O)Nc1c([O-])cc(Br)cc1Cl ZINC000854432021 1053814203 /nfs/dbraw/zinc/81/42/03/1053814203.db2.gz HZKYDVLPXLFBPH-QMMMGPOBSA-N -1 1 332.625 4.183 20 0 EIADMM [O-]c1cc(F)ccc1NC(=S)Nc1cccc(Br)c1 ZINC001197002569 1053820949 /nfs/dbraw/zinc/82/09/49/1053820949.db2.gz ULAXEVGBCQEHDV-UHFFFAOYSA-N -1 1 341.205 4.103 20 0 EIADMM C[C@H]1CCC(C)(C)N1C(=O)c1ccc(NC(=O)OC(C)(C)C)cc1[O-] ZINC000854898041 1053856686 /nfs/dbraw/zinc/85/66/86/1053856686.db2.gz NPSZDPYQKBLTFX-LBPRGKRZSA-N -1 1 348.443 4.142 20 0 EIADMM [O-]c1c(F)cccc1NC(=S)Nc1ccc(OC(F)(F)F)cc1 ZINC001197516012 1053922557 /nfs/dbraw/zinc/92/25/57/1053922557.db2.gz NDDCIAZJZJEEEL-UHFFFAOYSA-N -1 1 346.305 4.239 20 0 EIADMM O=S(=O)([N-]c1cccc(-c2cc[nH]n2)c1)c1ccc2ccccc2c1 ZINC000031534581 1054071083 /nfs/dbraw/zinc/07/10/83/1054071083.db2.gz YPHJOJLMZOFPSE-UHFFFAOYSA-N -1 1 349.415 4.031 20 0 EIADMM [O-]c1c(F)cccc1NC(=S)Nc1ccccc1OC(F)(F)F ZINC001198167880 1054087943 /nfs/dbraw/zinc/08/79/43/1054087943.db2.gz FFBCIFYPYHKTCE-UHFFFAOYSA-N -1 1 346.305 4.239 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2c(C)cc(C(C)(C)C)cc2C)cn1 ZINC001198314868 1054122371 /nfs/dbraw/zinc/12/23/71/1054122371.db2.gz JZCMOJCNUKZHGO-UHFFFAOYSA-N -1 1 332.469 4.105 20 0 EIADMM O=C(OCc1cc(=O)oc2cc([O-])ccc12)c1cccc2ccccc21 ZINC000011340938 1054139919 /nfs/dbraw/zinc/13/99/19/1054139919.db2.gz NBPWPHXSBWYOTM-UHFFFAOYSA-N -1 1 346.338 4.009 20 0 EIADMM CCS[C@H]1CCC[C@@H](NC(=O)c2ccc3ccccc3c2[O-])C1 ZINC001149045316 1054170182 /nfs/dbraw/zinc/17/01/82/1054170182.db2.gz SYRQOAAZQVAGEP-CABCVRRESA-N -1 1 329.465 4.340 20 0 EIADMM O=C([O-])c1c(F)cc(Nc2ccncc2Oc2ccccc2)cc1F ZINC001203316734 1054223451 /nfs/dbraw/zinc/22/34/51/1054223451.db2.gz STLDDUMVGLTBIT-UHFFFAOYSA-N -1 1 342.301 4.016 20 0 EIADMM O=C([O-])CC[C@H]1CCCN(Cc2cc(C(F)(F)F)ccc2Cl)C1 ZINC000871621298 1054233286 /nfs/dbraw/zinc/23/32/86/1054233286.db2.gz YBUMHDIVPLJTPB-LLVKDONJSA-N -1 1 349.780 4.436 20 0 EIADMM Cc1c(=O)[n-]c(SC2CC(CF)(CF)C2)nc1-c1ccccc1 ZINC000871668131 1054243124 /nfs/dbraw/zinc/24/31/24/1054243124.db2.gz UXYUUMGOEVYDJR-UHFFFAOYSA-N -1 1 336.407 4.338 20 0 EIADMM CN(C)c1ccc(NC(=S)Nc2cc([O-])c(Cl)cc2F)cc1 ZINC001198758594 1054254465 /nfs/dbraw/zinc/25/44/65/1054254465.db2.gz KVSYTYVNYCLVGO-UHFFFAOYSA-N -1 1 339.823 4.060 20 0 EIADMM O=C([N-]Cc1ccc(Cl)cc1F)C(F)(F)c1ccccc1F ZINC000857490545 1054278087 /nfs/dbraw/zinc/27/80/87/1054278087.db2.gz PJVALJAMNGVAIF-UHFFFAOYSA-N -1 1 331.696 4.026 20 0 EIADMM COc1ccc(S(=O)(=O)[N-]c2c(C)ccc3ccccc32)c(C)c1 ZINC001198896186 1054289068 /nfs/dbraw/zinc/28/90/68/1054289068.db2.gz ITADJJUFIJUDLJ-UHFFFAOYSA-N -1 1 341.432 4.266 20 0 EIADMM O=S(=O)([N-]c1ccc2c(c1)CCCC2)c1ccc2occc2c1 ZINC001198869481 1054296512 /nfs/dbraw/zinc/29/65/12/1054296512.db2.gz UIYQWWSVCJAALO-UHFFFAOYSA-N -1 1 327.405 4.112 20 0 EIADMM CCS(=O)(=O)c1ccc([O-])c(Nc2cc(C)cc(C)c2Cl)c1 ZINC001201598128 1054847366 /nfs/dbraw/zinc/84/73/66/1054847366.db2.gz XVXLUODAAJDGAQ-UHFFFAOYSA-N -1 1 339.844 4.200 20 0 EIADMM C[C@@H](c1ccco1)N(C(=O)NCc1ccc([O-])c(Cl)c1)C1CC1 ZINC000876394378 1054893462 /nfs/dbraw/zinc/89/34/62/1054893462.db2.gz UMZVNIUIKIACMB-NSHDSACASA-N -1 1 334.803 4.074 20 0 EIADMM O=C(Nc1ccc(Oc2ccc(Cl)cn2)cc1)c1ccccc1[O-] ZINC001137114413 1054983508 /nfs/dbraw/zinc/98/35/08/1054983508.db2.gz MDTXKLJKAUNXLC-UHFFFAOYSA-N -1 1 340.766 4.485 20 0 EIADMM Cc1ccc(-c2nsc([N-]C(=O)c3c(C)noc3C(C)C)n2)s1 ZINC000066413226 1055002365 /nfs/dbraw/zinc/00/23/65/1055002365.db2.gz FYYOVOUTINZGFM-UHFFFAOYSA-N -1 1 348.453 4.247 20 0 EIADMM CCC1=NO[C@H](c2nc(=O)c3c(C[C@H](C)CC)c(C)sc3[n-]2)C1 ZINC000126617238 1055090782 /nfs/dbraw/zinc/09/07/82/1055090782.db2.gz VNMLZFUBNHKQOD-RNCFNFMXSA-N -1 1 333.457 4.109 20 0 EIADMM O=C(Nc1cccc(C(F)(F)F)c1)Nc1cc(Cl)ncc1[O-] ZINC001202292186 1055128543 /nfs/dbraw/zinc/12/85/43/1055128543.db2.gz ZEWKJPGTTVSSIL-UHFFFAOYSA-N -1 1 331.681 4.103 20 0 EIADMM CCOc1cc(-c2nc(-c3coc(C4CC4)n3)no2)cc(Cl)c1[O-] ZINC000624716650 1055665418 /nfs/dbraw/zinc/66/54/18/1055665418.db2.gz YQTJZMUMMUACPB-UHFFFAOYSA-N -1 1 347.758 4.027 20 0 EIADMM CCCCc1nc(C(=O)OCC)c(NC(=O)[C@@H](C)CC2CCCC2)[nH]1 ZINC001128074518 1055714927 /nfs/dbraw/zinc/71/49/27/1055714927.db2.gz ZUDKZIUMYOYORL-ZDUSSCGKSA-N -1 1 349.475 4.084 20 0 EIADMM CCCCc1nc(C(=O)OCC)c(NC(=O)[C@@H]2CCCCC2(C)C)[nH]1 ZINC001128072954 1055716554 /nfs/dbraw/zinc/71/65/54/1055716554.db2.gz BMAHBHHHNUKLIF-ZDUSSCGKSA-N -1 1 349.475 4.084 20 0 EIADMM CCCc1nc(C(=O)[N-]c2nnc(-c3ccc(Cl)cc3)s2)co1 ZINC000510324047 1056336567 /nfs/dbraw/zinc/33/65/67/1056336567.db2.gz OQNJFXKVXRFLHK-UHFFFAOYSA-N -1 1 348.815 4.051 20 0 EIADMM CSCc1cccc([N-]S(=O)(=O)c2ccc(SC)cc2)c1 ZINC000109245435 1056402585 /nfs/dbraw/zinc/40/25/85/1056402585.db2.gz TZQSAFFUSVDQAF-UHFFFAOYSA-N -1 1 339.507 4.072 20 0 EIADMM COc1cc(Nc2cc(F)c([O-])c(Cl)c2)c(Br)cn1 ZINC001214482717 1056735755 /nfs/dbraw/zinc/73/57/55/1056735755.db2.gz KGNKORQFROYCBU-UHFFFAOYSA-N -1 1 347.571 4.094 20 0 EIADMM C[C@@H](OC(=O)c1c([O-])cc(F)cc1F)c1ncc(-c2ccccc2)o1 ZINC000741311543 1058190086 /nfs/dbraw/zinc/19/00/86/1058190086.db2.gz AOFUZKCJWSMPRL-SNVBAGLBSA-N -1 1 345.301 4.243 20 0 EIADMM Cn1c2ccccc2c2cc(C(=O)Nc3c([O-])cccc3F)sc21 ZINC000743417640 1058993738 /nfs/dbraw/zinc/99/37/38/1058993738.db2.gz ZMJPKLVZGBOZIM-UHFFFAOYSA-N -1 1 340.379 4.490 20 0 EIADMM CC(C)c1ocnc1C(=O)[N-]c1nnc(-c2ccc(Cl)cc2)s1 ZINC000766705990 1060817033 /nfs/dbraw/zinc/81/70/33/1060817033.db2.gz PPXACGZTKMJIOP-UHFFFAOYSA-N -1 1 348.815 4.222 20 0 EIADMM Nc1ccc2c(c1)c(-c1ccncc1)nn2-c1ccc(Cl)c([O-])c1 ZINC001212595509 1060990356 /nfs/dbraw/zinc/99/03/56/1060990356.db2.gz XHMVPBPAKBOSHP-UHFFFAOYSA-N -1 1 336.782 4.029 20 0 EIADMM COC(=O)c1cnc(S[C@H](c2ccccc2)c2ccc(F)cc2)[n-]1 ZINC000193535434 1032158279 /nfs/dbraw/zinc/15/82/79/1032158279.db2.gz NDNJOAZQOJAEOA-MRXNPFEDSA-N -1 1 342.395 4.217 20 0 EIADMM COC(=O)c1c[n-]c(S[C@H](c2ccccc2)c2ccc(F)cc2)n1 ZINC000193535434 1032158289 /nfs/dbraw/zinc/15/82/89/1032158289.db2.gz NDNJOAZQOJAEOA-MRXNPFEDSA-N -1 1 342.395 4.217 20 0 EIADMM CCC[C@H](CCc1ccccc1)NC(=O)c1c(F)ccc([O-])c1F ZINC000449992649 1032201974 /nfs/dbraw/zinc/20/19/74/1032201974.db2.gz OLQSVYMBDXVUNT-CQSZACIVSA-N -1 1 333.378 4.202 20 0 EIADMM CC[C@H]1C[C@@H](C(=O)Nc2cc(Cl)c([O-])c3ccccc23)CCO1 ZINC000529538818 1032429143 /nfs/dbraw/zinc/42/91/43/1032429143.db2.gz KRPMQNDJAFXDRL-RYUDHWBXSA-N -1 1 333.815 4.343 20 0 EIADMM O=C([O-])c1ccccc1CN1CCC[C@@H]1c1nc2ccccc2s1 ZINC000579722933 1018815160 /nfs/dbraw/zinc/81/51/60/1018815160.db2.gz SUABKQFPKJKDGN-MRXNPFEDSA-N -1 1 338.432 4.332 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2cccc(C(F)(F)F)c2C)ccc1F ZINC000471123895 1019019943 /nfs/dbraw/zinc/01/99/43/1019019943.db2.gz IKQHZRIFEIYOAA-UHFFFAOYSA-N -1 1 347.333 4.262 20 0 EIADMM CCc1ccc(S(=O)(=O)[N-]c2cc(Cl)ccc2Cl)s1 ZINC000048652413 1032823409 /nfs/dbraw/zinc/82/34/09/1032823409.db2.gz CKGSHPXLFNGPFZ-UHFFFAOYSA-N -1 1 336.265 4.418 20 0 EIADMM CC[C@@H](C)[C@H](C)[N-]S(=O)(=O)c1sc2ccccc2c1Cl ZINC001209868646 1020558522 /nfs/dbraw/zinc/55/85/22/1020558522.db2.gz FITJRFRLACGOEK-ZJUUUORDSA-N -1 1 331.890 4.268 20 0 EIADMM CCOc1cc(-c2noc([C@H](C)c3ccco3)n2)cc(Cl)c1[O-] ZINC000683589327 1020943029 /nfs/dbraw/zinc/94/30/29/1020943029.db2.gz MEIRJNUBSIKBAN-SECBINFHSA-N -1 1 334.759 4.239 20 0 EIADMM Cc1oc(C(=O)[O-])cc1CN1CC=C(c2cc(C)cc(C)c2)CC1 ZINC000580085693 1021627200 /nfs/dbraw/zinc/62/72/00/1021627200.db2.gz ZKMWRBVQRDFMEC-UHFFFAOYSA-N -1 1 325.408 4.192 20 0 EIADMM O=C(CCSc1ccccc1Cl)Nc1c([O-])cccc1F ZINC000089493326 1021846467 /nfs/dbraw/zinc/84/64/67/1021846467.db2.gz IJJFGUZIISSDEN-UHFFFAOYSA-N -1 1 325.792 4.306 20 0 EIADMM Cc1nnc(-c2cccc(NC(=O)c3cc4ccccc4cc3[O-])c2)o1 ZINC000174352741 1022059172 /nfs/dbraw/zinc/05/91/72/1022059172.db2.gz BMUFATGHFHVZRW-UHFFFAOYSA-N -1 1 345.358 4.156 20 0 EIADMM CCCCCC[C@@H](C)CC(=O)NCc1n[n-]c(=S)n1C(C)C ZINC000066639887 1022173262 /nfs/dbraw/zinc/17/32/62/1022173262.db2.gz HUIMASFVOCGFNP-CYBMUJFWSA-N -1 1 326.510 4.134 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1CCS[C@H]2CCCC[C@H]21 ZINC000175404436 1022355745 /nfs/dbraw/zinc/35/57/45/1022355745.db2.gz SULBZELOPPAWMO-SJORKVTESA-N -1 1 327.449 4.046 20 0 EIADMM CCOc1cc(C(=O)N[C@H]2CCc3cc(F)ccc32)cc(Cl)c1[O-] ZINC000186688644 1022720504 /nfs/dbraw/zinc/72/05/04/1022720504.db2.gz FTHCUQDLDJBUIF-HNNXBMFYSA-N -1 1 349.789 4.001 20 0 EIADMM Cc1nc(C)c(CC(=O)Nc2cc(Cl)c([O-])c3ccccc23)s1 ZINC001167444392 1022817705 /nfs/dbraw/zinc/81/77/05/1022817705.db2.gz CDLKIAYHVYQQCY-UHFFFAOYSA-N -1 1 346.839 4.453 20 0 EIADMM Cc1cccc(C(=O)Nc2ccc([O-])c(Cl)c2)c1Br ZINC000182861254 1022831085 /nfs/dbraw/zinc/83/10/85/1022831085.db2.gz CBKSSLPGTMYPIX-UHFFFAOYSA-N -1 1 340.604 4.369 20 0 EIADMM Cc1c(=O)[n-]c(SC2CC(OC(C)C)C2)nc1-c1ccccc1 ZINC000581297284 1022973868 /nfs/dbraw/zinc/97/38/68/1022973868.db2.gz HMOOSLSATNIKRV-UHFFFAOYSA-N -1 1 330.453 4.206 20 0 EIADMM C[C@@H](NC(=O)c1ccc([O-])cc1F)c1cccc(C(F)(F)F)c1 ZINC000181048085 1023235664 /nfs/dbraw/zinc/23/56/64/1023235664.db2.gz AXFFCPQDHKJEEV-SECBINFHSA-N -1 1 327.277 4.041 20 0 EIADMM Cc1ccc(NC(=O)c2ccc([O-])cc2F)c(OCC(F)(F)F)c1 ZINC000181909912 1023274727 /nfs/dbraw/zinc/27/47/27/1023274727.db2.gz VLQAHVHDSXVVSB-UHFFFAOYSA-N -1 1 343.276 4.033 20 0 EIADMM O=C([O-])CC[C@H](NCc1ccco1)c1ccc(Cl)c(Cl)c1 ZINC000417578762 1023363036 /nfs/dbraw/zinc/36/30/36/1023363036.db2.gz ZHAXFJCOYLRHHG-AWEZNQCLSA-N -1 1 328.195 4.282 20 0 EIADMM CC(C)=CCSC[C@H](NCc1ccc(C(C)(C)C)s1)C(=O)[O-] ZINC000417632141 1023382758 /nfs/dbraw/zinc/38/27/58/1023382758.db2.gz WIGIFAODWGMPCU-AWEZNQCLSA-N -1 1 341.542 4.288 20 0 EIADMM O=C(c1ccc([O-])c(F)c1)N1CCC(c2cccc(Cl)c2)CC1 ZINC000684514203 1024092234 /nfs/dbraw/zinc/09/22/34/1024092234.db2.gz MJWYOWMJJQQBRT-UHFFFAOYSA-N -1 1 333.790 4.205 20 0 EIADMM O=C([O-])c1ccc2c(c1)CN(CCCSCc1ccccc1)C2 ZINC000595280347 1024231269 /nfs/dbraw/zinc/23/12/69/1024231269.db2.gz DSVDRKMKZDBRLB-UHFFFAOYSA-N -1 1 327.449 4.024 20 0 EIADMM O=C([O-])CCCN1CCc2sccc2[C@H]1c1ccc(Cl)cc1 ZINC000661792331 1024506679 /nfs/dbraw/zinc/50/66/79/1024506679.db2.gz SIBICCCIJIGMRB-QGZVFWFLSA-N -1 1 335.856 4.214 20 0 EIADMM O=C(c1cc(F)ccc1[O-])N1CC=C(c2ccccc2Cl)CC1 ZINC000092029899 1024536708 /nfs/dbraw/zinc/53/67/08/1024536708.db2.gz LUACMNKGQBZALQ-UHFFFAOYSA-N -1 1 331.774 4.114 20 0 EIADMM O=S(=O)([N-]c1cccc(F)c1F)c1cc(Cl)ccc1Cl ZINC000049375352 1024565494 /nfs/dbraw/zinc/56/54/94/1024565494.db2.gz FBCGHDMOTSQEOK-UHFFFAOYSA-N -1 1 338.162 4.072 20 0 EIADMM O=S(=O)([N-]c1cc(F)cc(F)c1F)c1csc2ccccc21 ZINC000431148940 1024708173 /nfs/dbraw/zinc/70/81/73/1024708173.db2.gz ZWLKORSVLNILQX-UHFFFAOYSA-N -1 1 343.351 4.119 20 0 EIADMM Cc1cc(C)c(S(=O)(=O)[N-]c2ccc(OC(C)C)cc2F)s1 ZINC000431163197 1024753343 /nfs/dbraw/zinc/75/33/43/1024753343.db2.gz MVHBGGLJLPGLBX-UHFFFAOYSA-N -1 1 343.445 4.092 20 0 EIADMM CCc1ccc(-c2nc(CN(C[C@@H](C)C(=O)[O-])C3CC3)cs2)cc1 ZINC000652489444 1024856048 /nfs/dbraw/zinc/85/60/48/1024856048.db2.gz PQMUQIGXEBWXPU-CYBMUJFWSA-N -1 1 344.480 4.058 20 0 EIADMM C[C@@H]1CO[C@@H](c2ccccc2)CN1C(=O)c1cc2ccccc2cc1[O-] ZINC000110315572 1033266074 /nfs/dbraw/zinc/26/60/74/1033266074.db2.gz QJJPDAQSPBNJRQ-QVKFZJNVSA-N -1 1 347.414 4.148 20 0 EIADMM O=S(=O)([N-]c1cc(Cl)c(Cl)cc1Cl)c1ccoc1 ZINC000506814812 1025805495 /nfs/dbraw/zinc/80/54/95/1025805495.db2.gz KMOFHWJXZFLBJM-UHFFFAOYSA-N -1 1 326.588 4.041 20 0 EIADMM Cc1c(-c2ccccc2)sc2[n-]c(-c3nccc(C)n3)nc(=O)c12 ZINC000432493568 1026174451 /nfs/dbraw/zinc/17/44/51/1026174451.db2.gz KIZDBUXDNKRIKV-UHFFFAOYSA-N -1 1 334.404 4.138 20 0 EIADMM C[C@H](Oc1ccccc1Cl)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000111666561 1026314183 /nfs/dbraw/zinc/31/41/83/1026314183.db2.gz RFVJIXIDGZDMLF-VIFPVBQESA-N -1 1 326.179 4.105 20 0 EIADMM O=C(COc1cccc(C(F)(F)F)c1)Nc1ccc([O-])c(Cl)c1 ZINC000111666840 1026315247 /nfs/dbraw/zinc/31/52/47/1026315247.db2.gz SOUKQDHGZUPAOZ-UHFFFAOYSA-N -1 1 345.704 4.082 20 0 EIADMM Cc1ccc(-c2nnc(SCC(=O)c3ccc([O-])cc3)o2)cc1C ZINC000007736659 1026432909 /nfs/dbraw/zinc/43/29/09/1026432909.db2.gz OEMVRQPSGMTSQG-UHFFFAOYSA-N -1 1 340.404 4.034 20 0 EIADMM O=C([O-])c1coc(CNCc2cccc(OCC3CCCCC3)c2)c1 ZINC000426699968 1026484338 /nfs/dbraw/zinc/48/43/38/1026484338.db2.gz NJCZHTRYDFAJIY-UHFFFAOYSA-N -1 1 343.423 4.227 20 0 EIADMM O=C([O-])[C@@H](NCc1ccc(Cl)cc1F)c1cccc(Cl)c1 ZINC000426732624 1026514118 /nfs/dbraw/zinc/51/41/18/1026514118.db2.gz URJZQTXTZJUKDK-AWEZNQCLSA-N -1 1 328.170 4.048 20 0 EIADMM Cc1cc(C(F)(F)F)ccc1CN[C@H](C(=O)[O-])c1ccccc1F ZINC000426779712 1026555497 /nfs/dbraw/zinc/55/54/97/1026555497.db2.gz KOHUTCSLXJMFER-HNNXBMFYSA-N -1 1 341.304 4.068 20 0 EIADMM O=C([O-])[C@@H](NCc1ccc(-c2ccccc2)cc1F)c1ccccc1 ZINC000426765627 1026557820 /nfs/dbraw/zinc/55/78/20/1026557820.db2.gz QOJXPMHZRHLUCE-FQEVSTJZSA-N -1 1 335.378 4.408 20 0 EIADMM O=C([O-])C[C@@H](NCc1cc2ccccc2o1)c1cccc(Cl)c1 ZINC000426806183 1026560332 /nfs/dbraw/zinc/56/03/32/1026560332.db2.gz IMDMRHDILYPENI-MRXNPFEDSA-N -1 1 329.783 4.392 20 0 EIADMM O=C([O-])C[C@@H](NCc1ccc(Cl)cc1F)c1cccc(Cl)c1 ZINC000426796883 1026566897 /nfs/dbraw/zinc/56/68/97/1026566897.db2.gz DQGUSMUMVOCDCT-OAHLLOKOSA-N -1 1 342.197 4.438 20 0 EIADMM O=C([O-])C[C@H](NCc1cc2ccccc2s1)c1ccc(F)cc1F ZINC000426811645 1026574808 /nfs/dbraw/zinc/57/48/08/1026574808.db2.gz UXCJCJGEXLKFPE-INIZCTEOSA-N -1 1 347.386 4.485 20 0 EIADMM O=C(c1ccc(C(F)(F)F)c([O-])c1)N1CCC[C@@H]1Cc1ccccc1 ZINC000684870702 1026633680 /nfs/dbraw/zinc/63/36/80/1026633680.db2.gz KLYDCIOAHLRZLD-OAHLLOKOSA-N -1 1 349.352 4.258 20 0 EIADMM O=C(NCCc1ccc(Cl)s1)c1ccc(C(F)(F)F)c([O-])c1 ZINC000684873250 1026637111 /nfs/dbraw/zinc/63/71/11/1026637111.db2.gz UGWKGZYBNPYCEI-UHFFFAOYSA-N -1 1 349.761 4.098 20 0 EIADMM CN(C(=O)c1cc2ccccc2cc1[O-])c1cccc2cccnc21 ZINC000684935276 1026853422 /nfs/dbraw/zinc/85/34/22/1026853422.db2.gz WYBBGRMCBHVGBT-UHFFFAOYSA-N -1 1 328.371 4.370 20 0 EIADMM CN(Cc1nc2ccccc2s1)C(=O)c1ccc2ccccc2c1[O-] ZINC000010287305 1026870672 /nfs/dbraw/zinc/87/06/72/1026870672.db2.gz LDRILEIZZHEEAM-UHFFFAOYSA-N -1 1 348.427 4.427 20 0 EIADMM CC(C)(Oc1ccc(Cl)cc1)C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000440941791 1027147885 /nfs/dbraw/zinc/14/78/85/1027147885.db2.gz DKPNKESZSYSNNV-UHFFFAOYSA-N -1 1 340.206 4.495 20 0 EIADMM Cc1nc(-c2ccc(N[C@@H]3CCC[C@H](C)CC3)nc2)[n-]c(=O)c1C ZINC000302662120 1027356076 /nfs/dbraw/zinc/35/60/76/1027356076.db2.gz LWWLHYQZHHSLBX-BLLLJJGKSA-N -1 1 326.444 4.242 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc(-c3nccs3)cc2)cc1F ZINC000614761165 1027554192 /nfs/dbraw/zinc/55/41/92/1027554192.db2.gz DYGFUKHHBBCAIL-UHFFFAOYSA-N -1 1 348.424 4.058 20 0 EIADMM COc1cc(C(=O)N(C)[C@H](C)c2ccccc2F)cc(Cl)c1[O-] ZINC000153548311 1027585411 /nfs/dbraw/zinc/58/54/11/1027585411.db2.gz JDEAJTACMYDDEP-SNVBAGLBSA-N -1 1 337.778 4.027 20 0 EIADMM O=C(c1ncccc1[O-])N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000188443816 1027642152 /nfs/dbraw/zinc/64/21/52/1027642152.db2.gz SYWLJXYCDBMFNZ-CYBMUJFWSA-N -1 1 337.206 4.071 20 0 EIADMM COc1cc(C(=O)N2CCC[C@@H]2c2cccc(F)c2)cc(Cl)c1[O-] ZINC000153628193 1027794239 /nfs/dbraw/zinc/79/42/39/1027794239.db2.gz ZJJSNPHUNSJJJI-OAHLLOKOSA-N -1 1 349.789 4.171 20 0 EIADMM COc1cc(C(=O)Nc2nc(C3CCC3)cs2)cc(Cl)c1[O-] ZINC000444523893 1027856167 /nfs/dbraw/zinc/85/61/67/1027856167.db2.gz GPALOAMGYUSGCP-UHFFFAOYSA-N -1 1 338.816 4.031 20 0 EIADMM COc1cc(C(=O)Nc2cccc3ccc(C)nc32)cc(Cl)c1[O-] ZINC000153739543 1027900124 /nfs/dbraw/zinc/90/01/24/1027900124.db2.gz KKLMLYQHQXZRLX-UHFFFAOYSA-N -1 1 342.782 4.163 20 0 EIADMM O=C(Nc1ccccc1OC(F)F)c1ccc2ccccc2c1[O-] ZINC000324120681 1028135490 /nfs/dbraw/zinc/13/54/90/1028135490.db2.gz PXCGPCOZNVQNFA-UHFFFAOYSA-N -1 1 329.302 4.399 20 0 EIADMM O=C([O-])c1sccc1CN1CCC[C@@H]1c1nc2ccccc2s1 ZINC000583268147 1028380415 /nfs/dbraw/zinc/38/04/15/1028380415.db2.gz LLCXLFOAFNIOIB-CYBMUJFWSA-N -1 1 344.461 4.393 20 0 EIADMM Cc1ccc(F)c(C(=O)[N-]c2nnc(/C=C/c3ccco3)s2)c1F ZINC000346540839 1028489328 /nfs/dbraw/zinc/48/93/28/1028489328.db2.gz XPROEHCSWGPMEG-FNORWQNLSA-N -1 1 347.346 4.140 20 0 EIADMM CCc1nc2c(s1)[C@@H]([N@@H+](C)Cc1ccc(F)cc1C(=O)[O-])CCC2 ZINC000583327339 1028508790 /nfs/dbraw/zinc/50/87/90/1028508790.db2.gz JXAKKJKNMAVRCW-HNNXBMFYSA-N -1 1 348.443 4.052 20 0 EIADMM CCCc1nc(C)c(-c2nc(-c3ccc([O-])cc3Cl)no2)s1 ZINC000445452900 1028550699 /nfs/dbraw/zinc/55/06/99/1028550699.db2.gz GBXXRSMDMZFZRW-UHFFFAOYSA-N -1 1 335.816 4.480 20 0 EIADMM [O-]c1ccc(-c2noc(Cc3ccc(F)cc3Cl)n2)c(Cl)c1 ZINC000445444868 1028573530 /nfs/dbraw/zinc/57/35/30/1028573530.db2.gz HKVOBVZHMFBSKS-UHFFFAOYSA-N -1 1 339.153 4.479 20 0 EIADMM COc1ccc(/C=C(\C)c2nc(-c3ccc([O-])c(F)c3)no2)cc1F ZINC000445469188 1028597250 /nfs/dbraw/zinc/59/72/50/1028597250.db2.gz ARBZMNRXYBQNOE-JXMROGBWSA-N -1 1 344.317 4.290 20 0 EIADMM COc1ccc(/C(C)=C\c2nc(-c3ccc([O-])cc3F)no2)cc1 ZINC000445456816 1028609387 /nfs/dbraw/zinc/60/93/87/1028609387.db2.gz QEOZQTJEVKXXAL-LUAWRHEFSA-N -1 1 326.327 4.150 20 0 EIADMM [O-]c1ccc(-c2noc(COc3cccc4ccccc43)n2)c(F)c1 ZINC000445460072 1028618788 /nfs/dbraw/zinc/61/87/88/1028618788.db2.gz MNXCYNZGKBAQEV-UHFFFAOYSA-N -1 1 336.322 4.314 20 0 EIADMM [O-]c1ccc(-c2noc([C@@H]3C[C@@H]3c3cccc(F)c3F)n2)c(F)c1 ZINC000445460393 1028619663 /nfs/dbraw/zinc/61/96/63/1028619663.db2.gz ACDFMVMFGNDJFH-VXGBXAGGSA-N -1 1 332.281 4.131 20 0 EIADMM [O-]c1ccc(-c2noc(/C=C/c3nc4ccccc4s3)n2)c(F)c1 ZINC000445462193 1028621649 /nfs/dbraw/zinc/62/16/49/1028621649.db2.gz JOVUSCGGXRVOJH-BQYQJAHWSA-N -1 1 339.351 4.361 20 0 EIADMM CCC(CC)n1nc(-c2nc(-c3ccc([O-])c(F)c3)no2)cc1C ZINC000445480120 1028627340 /nfs/dbraw/zinc/62/73/40/1028627340.db2.gz YOUMICSIRXKCRP-UHFFFAOYSA-N -1 1 330.363 4.114 20 0 EIADMM [O-]c1ccc(-c2noc([C@@H]3C[C@]34CCCc3ccccc34)n2)cc1F ZINC000445482656 1028631460 /nfs/dbraw/zinc/63/14/60/1028631460.db2.gz SXLSZTIEEKKONR-YWZLYKJASA-N -1 1 336.366 4.343 20 0 EIADMM [O-]c1ccc(-c2noc(-c3[nH]c4ccccc4c3Cl)n2)cc1F ZINC000445483299 1028633743 /nfs/dbraw/zinc/63/37/43/1028633743.db2.gz SPYVOVYAQZXQKA-UHFFFAOYSA-N -1 1 329.718 4.383 20 0 EIADMM [O-]c1ccc(-c2noc(-c3cc(-c4ccc(F)cc4)on3)n2)cc1F ZINC000445476780 1028647964 /nfs/dbraw/zinc/64/79/64/1028647964.db2.gz HZHOSWHOODYPLA-UHFFFAOYSA-N -1 1 341.273 4.042 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2ccc(CC(F)(F)F)cc2)ccc1F ZINC000583596811 1028906745 /nfs/dbraw/zinc/90/67/45/1028906745.db2.gz DKYDJQRZCHEWAJ-UHFFFAOYSA-N -1 1 347.333 4.040 20 0 EIADMM COc1ccc(SCCCC(=O)Nc2ccc(F)cc2[O-])cc1 ZINC000444250877 1029114731 /nfs/dbraw/zinc/11/47/31/1029114731.db2.gz SRUZSCASWRJXDJ-UHFFFAOYSA-N -1 1 335.400 4.051 20 0 EIADMM O=S(=O)([N-]c1ccc(Cl)cc1F)c1cc(F)ccc1Cl ZINC000103057846 1029159731 /nfs/dbraw/zinc/15/97/31/1029159731.db2.gz HCDUWFWXHVRDKZ-UHFFFAOYSA-N -1 1 338.162 4.072 20 0 EIADMM CSc1ccc([O-])c(-c2nc([C@@H]3CCOC4(CCCC4)C3)no2)c1 ZINC000897178782 1029508439 /nfs/dbraw/zinc/50/84/39/1029508439.db2.gz GGDJUZGRDYYNSI-GFCCVEGCSA-N -1 1 346.452 4.371 20 0 EIADMM Cc1cccc([N-]S(=O)(=O)c2cccc(Cl)c2F)c1Cl ZINC000525310930 1029567435 /nfs/dbraw/zinc/56/74/35/1029567435.db2.gz BOCYFVUEMZUJEU-UHFFFAOYSA-N -1 1 334.199 4.242 20 0 EIADMM Cc1ccc(Cl)c([N-]S(=O)(=O)c2cccc(C)c2F)c1C ZINC000446949870 1029654263 /nfs/dbraw/zinc/65/42/63/1029654263.db2.gz KGRGYIDNDUVSNM-UHFFFAOYSA-N -1 1 327.808 4.205 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2ccc(CC(F)(F)F)cc2)c(C)s1 ZINC000525532098 1029672167 /nfs/dbraw/zinc/67/21/67/1029672167.db2.gz ZPIYTAFCURDMAK-UHFFFAOYSA-N -1 1 349.399 4.271 20 0 EIADMM Cc1ccc([C@@H](C)Nc2ccc(-c3nc(C)c(C)c(=O)[n-]3)cn2)s1 ZINC000301329334 1029708875 /nfs/dbraw/zinc/70/88/75/1029708875.db2.gz AVAXYRSJLKHNNW-CYBMUJFWSA-N -1 1 340.452 4.404 20 0 EIADMM CC(C)c1cccc(Oc2nc3c(cnn3-c3ccccc3)c(=O)[n-]2)c1 ZINC000301326695 1029709319 /nfs/dbraw/zinc/70/93/19/1029709319.db2.gz BGKWQOYQLSDLQC-UHFFFAOYSA-N -1 1 346.390 4.437 20 0 EIADMM Cc1nc(-c2ccc(N3CCC[C@H]3CC(C)(C)C)nc2)[n-]c(=O)c1C ZINC000301413417 1029727373 /nfs/dbraw/zinc/72/73/73/1029727373.db2.gz QBYSZVKHNIFLDK-INIZCTEOSA-N -1 1 340.471 4.266 20 0 EIADMM CCN(Cc1ccc(C)cc1)C(=O)c1cc(Cl)c([O-])c(OC)c1 ZINC000525956746 1030124797 /nfs/dbraw/zinc/12/47/97/1030124797.db2.gz HENRYKHHWKMBCB-UHFFFAOYSA-N -1 1 333.815 4.025 20 0 EIADMM Cc1cc(Cl)ccc1C1=CCN(Cc2ccc(C(=O)[O-])cn2)CC1 ZINC000530171819 1030189371 /nfs/dbraw/zinc/18/93/71/1030189371.db2.gz GLGUDIWTJGRRBM-UHFFFAOYSA-N -1 1 342.826 4.031 20 0 EIADMM [O-]c1c(-c2nc(Cc3ccc(F)cc3F)no2)ccc2ccccc21 ZINC000392623503 1030367790 /nfs/dbraw/zinc/36/77/90/1030367790.db2.gz ONXVOWNBBPRTPY-UHFFFAOYSA-N -1 1 338.313 4.464 20 0 EIADMM O=C(NCc1cccc2cccnc21)c1ccc2ccccc2c1[O-] ZINC000392737205 1030456122 /nfs/dbraw/zinc/45/61/22/1030456122.db2.gz PUCLFYJQPZQASL-UHFFFAOYSA-N -1 1 328.371 4.024 20 0 EIADMM CC(C)c1ccc(S(=O)(=O)[N-]c2cccc(OC(F)F)c2)cc1 ZINC000614813282 1030761611 /nfs/dbraw/zinc/76/16/11/1030761611.db2.gz LYRBDIAHGKXSSM-UHFFFAOYSA-N -1 1 341.379 4.212 20 0 EIADMM Cc1c(Cl)cccc1S(=O)(=O)[N-]c1cccc(OC(F)F)c1 ZINC000614813127 1030765331 /nfs/dbraw/zinc/76/53/31/1030765331.db2.gz IZLIDQSFEJEPQU-UHFFFAOYSA-N -1 1 347.770 4.051 20 0 EIADMM CCC1(C(=O)Nc2ccc(-c3cc(=O)[nH][n-]3)cc2)CCC(F)(F)CC1 ZINC000666314595 1030839241 /nfs/dbraw/zinc/83/92/41/1030839241.db2.gz UORDCDUGSLREJN-UHFFFAOYSA-N -1 1 349.381 4.327 20 0 EIADMM C[C@@H]1CC[C@@H](C(=O)[O-])CN1Cc1cc(C(F)(F)F)ccc1Cl ZINC000263396032 1030848355 /nfs/dbraw/zinc/84/83/55/1030848355.db2.gz ZKHQTHXMYNJPRU-NXEZZACHSA-N -1 1 335.753 4.044 20 0 EIADMM O=C([O-])c1cccc(CN2CCCC[C@@H]2c2nc3ccccc3o2)c1 ZINC000263444615 1030871994 /nfs/dbraw/zinc/87/19/94/1030871994.db2.gz FOTLIKVNDOQENR-QGZVFWFLSA-N -1 1 336.391 4.253 20 0 EIADMM Cc1csc(Nc2ccc(C(=O)Nc3c([O-])cccc3F)cc2)n1 ZINC000685743403 1031198071 /nfs/dbraw/zinc/19/80/71/1031198071.db2.gz ZPACSEZHAIFPKU-UHFFFAOYSA-N -1 1 343.383 4.292 20 0 EIADMM CCOc1cc(-c2noc(C[C@@H](C)c3ccco3)n2)cc(Cl)c1[O-] ZINC000528166426 1031198663 /nfs/dbraw/zinc/19/86/63/1031198663.db2.gz KOFCJNPDQBKHOG-SNVBAGLBSA-N -1 1 348.786 4.434 20 0 EIADMM COc1cc(C(=O)Nc2ccc(F)cc2[O-])ccc1OCCC(C)C ZINC000532013000 1031975902 /nfs/dbraw/zinc/97/59/02/1031975902.db2.gz YFYVRGCERLXFCO-UHFFFAOYSA-N -1 1 347.386 4.217 20 0 EIADMM CCOc1ccc([N-]S(=O)(=O)c2cc(C)sc2C)cc1Cl ZINC000614840917 1032013530 /nfs/dbraw/zinc/01/35/30/1032013530.db2.gz FASSQYNTJDFBEI-UHFFFAOYSA-N -1 1 345.873 4.218 20 0 EIADMM CCNC(=O)Nc1cccc(NCc2cccc([O-])c2Cl)c1C ZINC000645177340 1033989074 /nfs/dbraw/zinc/98/90/74/1033989074.db2.gz WDMSYZIYRFRFDW-UHFFFAOYSA-N -1 1 333.819 4.108 20 0 EIADMM CCc1cccc(S(=O)(=O)[N-]c2cccc(-c3nccs3)c2)c1 ZINC000433525137 1034629484 /nfs/dbraw/zinc/62/94/84/1034629484.db2.gz MYELWVYKOSAFRT-UHFFFAOYSA-N -1 1 344.461 4.173 20 0 EIADMM CCC(=O)c1cccc([N-]S(=O)(=O)c2cccc(C(C)C)c2)c1 ZINC000433616754 1034840331 /nfs/dbraw/zinc/84/03/31/1034840331.db2.gz NOKXOSLERBQWQJ-UHFFFAOYSA-N -1 1 331.437 4.204 20 0 EIADMM O=C(c1ccc(F)cc1)C1CCN(Cc2cccc([O-])c2Cl)CC1 ZINC000513317671 1034880601 /nfs/dbraw/zinc/88/06/01/1034880601.db2.gz OCIAQNCPPHWSRK-UHFFFAOYSA-N -1 1 347.817 4.280 20 0 EIADMM CC(C)[C@@H](NCc1ccc(-c2ccc(C(C)(C)C)cc2)o1)C(=O)[O-] ZINC000262723592 1034970569 /nfs/dbraw/zinc/97/05/69/1034970569.db2.gz XDLIFBKIYBCOPF-GOSISDBHSA-N -1 1 329.440 4.443 20 0 EIADMM COC(=O)c1[n-]c(=N[C@H](C)c2cccc(Cl)c2Cl)sc1C ZINC000434089772 1035158411 /nfs/dbraw/zinc/15/84/11/1035158411.db2.gz BQXHRIGPRVGNKX-SSDOTTSWSA-N -1 1 345.251 4.140 20 0 EIADMM O=C(Cc1ccc([O-])c(Cl)c1)NC[C@@H]1CCCC[C@@H]1C(F)(F)F ZINC000631627227 1035417265 /nfs/dbraw/zinc/41/72/65/1035417265.db2.gz YOGTVVMRPPJQJF-RYUDHWBXSA-N -1 1 349.780 4.073 20 0 EIADMM [O-]c1ccc(-c2noc(C3(C(F)(F)F)CCCC3)n2)c(Cl)c1 ZINC000420494040 1035644144 /nfs/dbraw/zinc/64/41/44/1035644144.db2.gz PQVDWZPTEJEMTF-UHFFFAOYSA-N -1 1 332.709 4.470 20 0 EIADMM COc1cc([C@H](C)NCc2cc(C(=O)[O-])c(C)o2)cc2ccccc21 ZINC000905797581 1035894678 /nfs/dbraw/zinc/89/46/78/1035894678.db2.gz DFXSNNUFDYAVCH-LBPRGKRZSA-N -1 1 339.391 4.299 20 0 EIADMM COc1cc(C(=O)N[C@H](c2ccc(C)cc2)C2CC2)cc(Cl)c1[O-] ZINC000571113332 1035945824 /nfs/dbraw/zinc/94/58/24/1035945824.db2.gz GKMRZFPFRUAIEU-QGZVFWFLSA-N -1 1 345.826 4.244 20 0 EIADMM O=C(NCc1ccccc1N1CCCC1)c1ccc2ccccc2c1[O-] ZINC000596748380 1036001618 /nfs/dbraw/zinc/00/16/18/1036001618.db2.gz HEOUBGCRTKREPH-UHFFFAOYSA-N -1 1 346.430 4.076 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1ccn(Cc2ccccc2)c1 ZINC000513744109 1036173742 /nfs/dbraw/zinc/17/37/42/1036173742.db2.gz HBMYPZJRPHKFAN-UHFFFAOYSA-N -1 1 326.783 4.148 20 0 EIADMM CCOCc1cccc([N-]S(=O)(=O)c2ccc(CC(C)C)cc2)c1 ZINC000588077484 1036203655 /nfs/dbraw/zinc/20/36/55/1036203655.db2.gz KDFKHVWEYLJAMY-UHFFFAOYSA-N -1 1 347.480 4.222 20 0 EIADMM Cc1sc(Br)c(C(=O)Nc2c([O-])cccc2F)c1C ZINC000669612376 1036229292 /nfs/dbraw/zinc/22/92/92/1036229292.db2.gz IMZGOXHHIMZLKJ-UHFFFAOYSA-N -1 1 344.205 4.224 20 0 EIADMM O=C(CSCc1ccc(Br)cc1)c1ccc([O-])cc1 ZINC000602212361 1036356191 /nfs/dbraw/zinc/35/61/91/1036356191.db2.gz GDHIRLZQDOQPSO-UHFFFAOYSA-N -1 1 337.238 4.271 20 0 EIADMM CCC[C@@H](C)c1cc([N-]S(=O)(=O)c2ccc(C(F)F)cc2)[nH]n1 ZINC000572199011 1036463881 /nfs/dbraw/zinc/46/38/81/1036463881.db2.gz BBUNTYLDVMLLSJ-SNVBAGLBSA-N -1 1 343.399 4.052 20 0 EIADMM CO[C@@H](C)c1cccc([N-]S(=O)(=O)c2ccc(Cl)cc2C)c1 ZINC000588833033 1036561721 /nfs/dbraw/zinc/56/17/21/1036561721.db2.gz DJFYACPMVWOZCQ-LBPRGKRZSA-N -1 1 339.844 4.157 20 0 EIADMM CCOC(=O)c1noc([N-]c2cnc(C)s2)c1-c1ccccc1 ZINC001212133005 1036731971 /nfs/dbraw/zinc/73/19/71/1036731971.db2.gz KMGWAIBGVAVLIA-UHFFFAOYSA-N -1 1 329.381 4.027 20 0 EIADMM O=c1cc(C(F)F)nc(SCc2ccc(OC(F)F)cc2)[n-]1 ZINC000572803907 1036826314 /nfs/dbraw/zinc/82/63/14/1036826314.db2.gz GKLPBZWHJYQTLC-UHFFFAOYSA-N -1 1 334.294 4.014 20 0 EIADMM O=C(Nc1cccc(-n2cccc2)c1)Nc1ccc([O-])c(Cl)c1 ZINC000486923549 1036892209 /nfs/dbraw/zinc/89/22/09/1036892209.db2.gz APOHUXVLRIVMPN-UHFFFAOYSA-N -1 1 327.771 4.480 20 0 EIADMM COc1ccc2cc(NC(=O)Nc3ccc([O-])c(Cl)c3)ccc2n1 ZINC000486942727 1036897812 /nfs/dbraw/zinc/89/78/12/1036897812.db2.gz NBTWOBUWHSUDKM-UHFFFAOYSA-N -1 1 343.770 4.246 20 0 EIADMM CC[C@@H](CC(F)(F)F)C(=O)Nc1cccc([O-])c1Br ZINC000908706976 1036920334 /nfs/dbraw/zinc/92/03/34/1036920334.db2.gz GKINZSIMKJDBHJ-ZETCQYMHSA-N -1 1 340.139 4.072 20 0 EIADMM O=C(Nc1cccc([O-])c1Br)[C@H]1CCCC[C@@H]1C1CC1 ZINC000908706381 1036920381 /nfs/dbraw/zinc/92/03/81/1036920381.db2.gz AJWKQGXHYHBTGO-NEPJUHHUSA-N -1 1 338.245 4.310 20 0 EIADMM C[C@@H](CC1CCCC1)C(=O)Nc1cccc([O-])c1Br ZINC000908714019 1036923144 /nfs/dbraw/zinc/92/31/44/1036923144.db2.gz ZBDJMEMJLQAYMK-JTQLQIEISA-N -1 1 326.234 4.310 20 0 EIADMM O=C(CCc1ccc2ccccc2n1)Nc1ccc([O-])c(Cl)c1 ZINC000486984849 1036934530 /nfs/dbraw/zinc/93/45/30/1036934530.db2.gz GCFQDVBUGBDEOB-UHFFFAOYSA-N -1 1 326.783 4.165 20 0 EIADMM O=C([O-])C[C@@H](NCc1cccc(Cl)c1Cl)c1cccs1 ZINC000037087820 1036968533 /nfs/dbraw/zinc/96/85/33/1036968533.db2.gz GMKQHYRAGSLAKX-LLVKDONJSA-N -1 1 330.236 4.361 20 0 EIADMM O=C(Nc1ccc2nc(C3CCC3)[nH]c2c1)c1c([O-])cc(F)cc1F ZINC000590107081 1036978489 /nfs/dbraw/zinc/97/84/89/1036978489.db2.gz KKOGICABSJRGSJ-UHFFFAOYSA-N -1 1 343.333 4.067 20 0 EIADMM CC[C@@H](CC(F)(F)F)[N-]C(=O)C(F)(F)c1cccc(Cl)c1 ZINC000760765128 1037003378 /nfs/dbraw/zinc/00/33/78/1037003378.db2.gz IPGXTEVLYUIVMI-JTQLQIEISA-N -1 1 329.696 4.279 20 0 EIADMM CSc1cccc(NC(=O)c2c(C)nc(C(C)(C)C)[n-]c2=O)c1C ZINC000272082233 1037095912 /nfs/dbraw/zinc/09/59/12/1037095912.db2.gz HNVLOGBNFIFNKN-UHFFFAOYSA-N -1 1 345.468 4.071 20 0 EIADMM CCc1ccc(-c2nc(CN3C[C@H](C(=O)[O-])CC[C@H]3C)cs2)cc1 ZINC000573723027 1037678968 /nfs/dbraw/zinc/67/89/68/1037678968.db2.gz QJIKUBAFWTYWKH-CZUORRHYSA-N -1 1 344.480 4.058 20 0 EIADMM CC(C)(C)CC[C@H](NCc1ccc(-c2ccc(F)cc2)o1)C(=O)[O-] ZINC000414655953 1037693716 /nfs/dbraw/zinc/69/37/16/1037693716.db2.gz KDTKFXHNTQKAII-INIZCTEOSA-N -1 1 333.403 4.455 20 0 EIADMM CCCN(CC(=O)[O-])Cc1ccc(-c2ccc(C(F)(F)F)cc2)o1 ZINC000414679500 1037791235 /nfs/dbraw/zinc/79/12/35/1037791235.db2.gz KBJYAXXTJKITOB-UHFFFAOYSA-N -1 1 341.329 4.262 20 0 EIADMM C[C@@H](c1ccc(C(=O)[O-])o1)N1CCC[C@@H](Oc2ccccc2Cl)C1 ZINC000574406461 1038212180 /nfs/dbraw/zinc/21/21/80/1038212180.db2.gz QDJVNGSYUHWHOT-QWHCGFSZSA-N -1 1 349.814 4.236 20 0 EIADMM Cc1ccc(C)c(S(=O)(=O)[N-]c2ccc(CC(F)(F)F)cc2)c1 ZINC000607615872 1038241008 /nfs/dbraw/zinc/24/10/08/1038241008.db2.gz WSPSIJRMVRPNBQ-UHFFFAOYSA-N -1 1 343.370 4.209 20 0 EIADMM O=S(=O)([N-]c1ccc(COC2CCCC2)cc1)c1cccc(F)c1 ZINC000606827694 1038264921 /nfs/dbraw/zinc/26/49/21/1038264921.db2.gz ATBUCANXXCNHHI-UHFFFAOYSA-N -1 1 349.427 4.086 20 0 EIADMM Cc1nc(S(=O)(=O)Cc2ccccc2Cl)[nH]c1-c1ccccc1 ZINC000490414179 1038617964 /nfs/dbraw/zinc/61/79/64/1038617964.db2.gz MWBYMDAZAAHPLL-UHFFFAOYSA-N -1 1 346.839 4.012 20 0 EIADMM COc1ccc(CCCCCC(=O)Nc2c([O-])cccc2F)cc1 ZINC000608365753 1038803499 /nfs/dbraw/zinc/80/34/99/1038803499.db2.gz BDPMQMAQPFQOIW-UHFFFAOYSA-N -1 1 331.387 4.282 20 0 EIADMM Cc1cccc(-c2nc(CC(=O)Nc3c([O-])cccc3F)cs2)c1 ZINC000608366290 1038803608 /nfs/dbraw/zinc/80/36/08/1038803608.db2.gz IBZICGKNVDUHLD-UHFFFAOYSA-N -1 1 342.395 4.144 20 0 EIADMM O=C(Nc1c([O-])cccc1F)c1cc2cc(Br)ccc2[nH]1 ZINC000608366336 1038803666 /nfs/dbraw/zinc/80/36/66/1038803666.db2.gz SADBHEKUPLXEIS-UHFFFAOYSA-N -1 1 349.159 4.027 20 0 EIADMM COc1cc(NC(=O)Nc2ccc([O-])c(Cl)c2)c(C)c(OC)c1 ZINC000504971433 1038872051 /nfs/dbraw/zinc/87/20/51/1038872051.db2.gz RISWZEFGXJXGFO-UHFFFAOYSA-N -1 1 336.775 4.015 20 0 EIADMM CSCc1ccc([N-]S(=O)(=O)c2cccc(Cl)c2C)cc1 ZINC000608955627 1038989588 /nfs/dbraw/zinc/98/95/88/1038989588.db2.gz HKHBAYGRTAHBBX-UHFFFAOYSA-N -1 1 341.885 4.312 20 0 EIADMM CSCCc1ccc([N-]S(=O)(=O)c2ccc(Cl)cc2)cc1 ZINC000609016018 1038993795 /nfs/dbraw/zinc/99/37/95/1038993795.db2.gz RUMUNFONHQMUHA-UHFFFAOYSA-N -1 1 341.885 4.046 20 0 EIADMM Cc1cscc1C(=O)Nc1c([O-])cc(Br)cc1Cl ZINC000552197039 1039233204 /nfs/dbraw/zinc/23/32/04/1039233204.db2.gz MPVVRRBIHSNHEQ-UHFFFAOYSA-N -1 1 346.633 4.430 20 0 EIADMM Cc1cc(C)c(C(=O)Nc2c([O-])cc(Br)cc2Cl)o1 ZINC000552209813 1039286616 /nfs/dbraw/zinc/28/66/16/1039286616.db2.gz XYCCNGGCQXXAQI-UHFFFAOYSA-N -1 1 344.592 4.270 20 0 EIADMM Cc1ccc([C@@H]2OCCC[C@@H]2C(=O)Nc2ccc([O-])c(F)c2F)cc1 ZINC000456780955 1039599269 /nfs/dbraw/zinc/59/92/69/1039599269.db2.gz JHWDKAFXIWZHOC-UGSOOPFHSA-N -1 1 347.361 4.085 20 0 EIADMM C[C@@H]1C[C@@H]1c1ccc([C@@H]2C[C@@H]2C(=O)Nc2ccc([O-])c(F)c2F)o1 ZINC000456793747 1039612921 /nfs/dbraw/zinc/61/29/21/1039612921.db2.gz OGOHNSVZJATQBM-YTWAJWBKSA-N -1 1 333.334 4.129 20 0 EIADMM COc1cc(C2(C(=O)Nc3ccc([O-])c(F)c3F)CCC2)ccc1C ZINC000456792754 1039613183 /nfs/dbraw/zinc/61/31/83/1039613183.db2.gz KGPKCNSQIVKGIL-UHFFFAOYSA-N -1 1 347.361 4.048 20 0 EIADMM COc1ccc2c(c1)CCC[C@@H]2CC(=O)Nc1ccc([O-])c(F)c1F ZINC000456795880 1039613334 /nfs/dbraw/zinc/61/33/34/1039613334.db2.gz VRPTVXJTLRYUSY-GFCCVEGCSA-N -1 1 347.361 4.128 20 0 EIADMM O=C(c1cc(F)ccc1[O-])N1CCC[C@H]1c1nc2ccccc2s1 ZINC000093908803 1039771664 /nfs/dbraw/zinc/77/16/64/1039771664.db2.gz WMLNDJQFUDWCBW-AWEZNQCLSA-N -1 1 342.395 4.118 20 0 EIADMM CCCn1ccc2cc(NC(=O)c3c(F)ccc([O-])c3F)ccc21 ZINC000553259946 1040073632 /nfs/dbraw/zinc/07/36/32/1040073632.db2.gz OWVVFNDXMDJHPH-UHFFFAOYSA-N -1 1 330.334 4.287 20 0 EIADMM Cc1oc([C@@H](C)[N@H+]2CC[C@@H](C(F)(F)F)C3(CCC3)C2)cc1C(=O)[O-] ZINC000518201345 1040083824 /nfs/dbraw/zinc/08/38/24/1040083824.db2.gz WNZILTIDIOPEED-QMTHXVAHSA-N -1 1 345.361 4.402 20 0 EIADMM Cc1oc([C@@H](C)N2CC[C@@H](C(F)(F)F)C3(CCC3)C2)cc1C(=O)[O-] ZINC000518201345 1040083843 /nfs/dbraw/zinc/08/38/43/1040083843.db2.gz WNZILTIDIOPEED-QMTHXVAHSA-N -1 1 345.361 4.402 20 0 EIADMM CC[C@@H](C)c1ccc(S(=O)(=O)[N-]c2cc3c[nH]nc3cc2C)cc1 ZINC000479139256 1040150529 /nfs/dbraw/zinc/15/05/29/1040150529.db2.gz VPUNBXLHRFVNQR-GFCCVEGCSA-N -1 1 343.452 4.186 20 0 EIADMM CC(=O)c1ccc([N-]S(=O)(=O)c2ccc3ccccc3c2)cc1C ZINC000535348868 1040211483 /nfs/dbraw/zinc/21/14/83/1040211483.db2.gz FORIHGWNZWUCOI-UHFFFAOYSA-N -1 1 339.416 4.152 20 0 EIADMM Cc1ccc(C)c(C(=O)[C@@H](C)Sc2nc(C(F)F)cc(=O)[n-]2)c1 ZINC000515051118 1040449782 /nfs/dbraw/zinc/44/97/82/1040449782.db2.gz QIKZQNDZUWZWSX-SNVBAGLBSA-N -1 1 338.379 4.100 20 0 EIADMM Cc1nc(C(C)(C)C)[n-]c(=O)c1C(=O)NC1CC(C)(C)CC(C)(C)C1 ZINC000539700753 1040724031 /nfs/dbraw/zinc/72/40/31/1040724031.db2.gz UMEJJNKYRUKQBC-UHFFFAOYSA-N -1 1 347.503 4.123 20 0 EIADMM CC(F)(F)c1cccc([N-]S(=O)(=O)c2ccc3ncccc3c2)c1 ZINC000436157404 1040909461 /nfs/dbraw/zinc/90/94/61/1040909461.db2.gz UWEHSBDPDGVSHU-UHFFFAOYSA-N -1 1 348.374 4.147 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2cc(F)c(F)cc2Cl)sc1C ZINC000538012919 1040987410 /nfs/dbraw/zinc/98/74/10/1040987410.db2.gz WRUZUOQPTKCBIZ-UHFFFAOYSA-N -1 1 337.800 4.097 20 0 EIADMM CC(C)(C)c1ccccc1S(=O)(=O)[N-]c1cccc2[nH]ccc21 ZINC000460829382 1040990854 /nfs/dbraw/zinc/99/08/54/1040990854.db2.gz LVSVZIVBNVWXEL-UHFFFAOYSA-N -1 1 328.437 4.266 20 0 EIADMM Cc1cc(N2CCCC[C@@H]2C)ccc1NC(=O)c1ccc(O)cc1[O-] ZINC000163416463 1041110921 /nfs/dbraw/zinc/11/09/21/1041110921.db2.gz LAMGKEZBDJYBIT-AWEZNQCLSA-N -1 1 340.423 4.037 20 0 EIADMM C/C(=C/c1ccc(Cl)cc1)CN[C@@H](C)c1ncc(C(=O)[O-])s1 ZINC000904021610 1041265267 /nfs/dbraw/zinc/26/52/67/1041265267.db2.gz ZFOMOSNYIXKLOC-BRNRAETOSA-N -1 1 336.844 4.249 20 0 EIADMM C/C(=C/c1ccc(Cl)cc1)CN[C@@H](C)c1nc(C(=O)[O-])cs1 ZINC000904024333 1041269734 /nfs/dbraw/zinc/26/97/34/1041269734.db2.gz QAEFKRVMHMLUEO-BRNRAETOSA-N -1 1 336.844 4.249 20 0 EIADMM O=C(Nc1ccc2nc(C(F)F)[nH]c2c1)c1ccc(Cl)cc1[O-] ZINC000436513815 1041296094 /nfs/dbraw/zinc/29/60/94/1041296094.db2.gz MWGGVIGTBKFGNH-UHFFFAOYSA-N -1 1 337.713 4.112 20 0 EIADMM O=C(Nc1ccc(NCCc2ccccc2)cc1)c1ccccc1[O-] ZINC000436524714 1041307058 /nfs/dbraw/zinc/30/70/58/1041307058.db2.gz KEJWLRBYMOUXFA-UHFFFAOYSA-N -1 1 332.403 4.299 20 0 EIADMM O=C(c1ccc(C(F)(F)F)cc1[O-])N1CCc2cc(Cl)ccc21 ZINC000436553270 1041328980 /nfs/dbraw/zinc/32/89/80/1041328980.db2.gz FEYIELPMDONZPV-UHFFFAOYSA-N -1 1 341.716 4.267 20 0 EIADMM Cc1ccc([C@H]2CCC[C@@H]2N(C)C(=O)c2cc(F)ccc2[O-])cc1 ZINC000436592555 1041350819 /nfs/dbraw/zinc/35/08/19/1041350819.db2.gz WLWVEPDQYNNPDQ-AEFFLSMTSA-N -1 1 327.399 4.248 20 0 EIADMM Cc1c(COC(C)(C)C)cccc1NC(=O)c1cc(F)ccc1[O-] ZINC000436580350 1041357141 /nfs/dbraw/zinc/35/71/41/1041357141.db2.gz ZWZUGUWNCZEVLT-UHFFFAOYSA-N -1 1 331.387 4.407 20 0 EIADMM O=C(NC1CCC2(CCOCC2)CC1)c1cc2ccccc2cc1[O-] ZINC000436585869 1041361255 /nfs/dbraw/zinc/36/12/55/1041361255.db2.gz RJTOLELTHBWMQN-UHFFFAOYSA-N -1 1 339.435 4.015 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N(Cc1cccc(O)c1)CC1CC1 ZINC000436583836 1041361376 /nfs/dbraw/zinc/36/13/76/1041361376.db2.gz LGKBDLAVEPJLKJ-UHFFFAOYSA-N -1 1 347.414 4.303 20 0 EIADMM C[C@@H]1CN(C(=O)c2ccc3ccccc3c2[O-])c2ccc(F)cc2O1 ZINC000436586236 1041363273 /nfs/dbraw/zinc/36/32/73/1041363273.db2.gz AXJLCIPJGGQWOJ-GFCCVEGCSA-N -1 1 337.350 4.112 20 0 EIADMM Cc1nnc(-c2cccc(NC(=O)c3ccc(C(C)C)cc3[O-])c2)o1 ZINC000436590839 1041365075 /nfs/dbraw/zinc/36/50/75/1041365075.db2.gz ODIOATILIYCFKS-UHFFFAOYSA-N -1 1 337.379 4.126 20 0 EIADMM C[C@H](Oc1ccccc1NC(=O)c1ccc(O)cc1[O-])c1ccccc1 ZINC000436624238 1041377738 /nfs/dbraw/zinc/37/77/38/1041377738.db2.gz IYXIVQZMVZNWFV-AWEZNQCLSA-N -1 1 349.386 4.490 20 0 EIADMM COc1c(C)cc(CN(C)C(=O)c2ccc3ccccc3c2[O-])cc1C ZINC000436633921 1041383471 /nfs/dbraw/zinc/38/34/71/1041383471.db2.gz DUQICDYXURCMLR-UHFFFAOYSA-N -1 1 349.430 4.443 20 0 EIADMM CC1(C)CCc2sc(NC(=O)c3ccc4ccccc4c3[O-])nc21 ZINC001142601752 1041392826 /nfs/dbraw/zinc/39/28/26/1041392826.db2.gz MQNJOTHOIRVSLO-UHFFFAOYSA-N -1 1 338.432 4.478 20 0 EIADMM Cc1nc(S[C@H](C)C(=O)Nc2ccccc2C(C)C)[n-]c(=O)c1C ZINC000538517333 1041401421 /nfs/dbraw/zinc/40/14/21/1041401421.db2.gz VQBRCTRWDNKXBQ-CYBMUJFWSA-N -1 1 345.468 4.042 20 0 EIADMM Cc1[nH]nc(-c2ccccc2)c1NC(=O)c1cc2ccccc2cc1[O-] ZINC000436665397 1041406382 /nfs/dbraw/zinc/40/63/82/1041406382.db2.gz OALAHQQWPIKXKT-UHFFFAOYSA-N -1 1 343.386 4.496 20 0 EIADMM COc1ccc(C(=O)Nc2cccc(-c3nc(C)cs3)c2)c([O-])c1 ZINC000436712107 1041438732 /nfs/dbraw/zinc/43/87/32/1041438732.db2.gz MJLTZHRHIXGPDG-UHFFFAOYSA-N -1 1 340.404 4.085 20 0 EIADMM O=C(Nc1cccc(CSc2ccccn2)c1)c1ccccc1[O-] ZINC000436717547 1041441215 /nfs/dbraw/zinc/44/12/15/1041441215.db2.gz HJGKJSRGSNMZPT-UHFFFAOYSA-N -1 1 336.416 4.332 20 0 EIADMM C[C@@H]1CN(C(=O)c2ccc(C(F)(F)F)cc2[O-])[C@@H]2CCCC[C@@H]21 ZINC000436736006 1041445863 /nfs/dbraw/zinc/44/58/63/1041445863.db2.gz FJEPIBQKYWRXST-MPKXVKKWSA-N -1 1 327.346 4.062 20 0 EIADMM O=C(NCc1cnc2ccccc2c1)c1ccc2ccccc2c1[O-] ZINC000436739322 1041448282 /nfs/dbraw/zinc/44/82/82/1041448282.db2.gz WAOUHTMDBPAMQH-UHFFFAOYSA-N -1 1 328.371 4.024 20 0 EIADMM CC(C)(C)c1nc2ccc(NC(=O)c3ccc([O-])c(Cl)c3)cc2[nH]1 ZINC000436729141 1041454388 /nfs/dbraw/zinc/45/43/88/1041454388.db2.gz FYJBNOJLGOUBAU-UHFFFAOYSA-N -1 1 343.814 4.472 20 0 EIADMM CC(C)c1ccc(C(=O)Nc2cccc(Oc3cnccn3)c2)c([O-])c1 ZINC000436760089 1041457926 /nfs/dbraw/zinc/45/79/26/1041457926.db2.gz LQSPSRJFCHRNLN-UHFFFAOYSA-N -1 1 349.390 4.350 20 0 EIADMM C[C@H](c1c(F)cccc1F)N(C)C(=O)c1ccc(Cl)cc1[O-] ZINC000436760056 1041458214 /nfs/dbraw/zinc/45/82/14/1041458214.db2.gz LEVIVKPJOQWTHB-SECBINFHSA-N -1 1 325.742 4.157 20 0 EIADMM Cc1ccsc1C(=O)Nc1c([O-])cc(Br)cc1Cl ZINC000552022719 1041461178 /nfs/dbraw/zinc/46/11/78/1041461178.db2.gz PSXHOQVQRUWMOO-UHFFFAOYSA-N -1 1 346.633 4.430 20 0 EIADMM O=C(N[C@@H](c1ccccc1)[C@H]1CCOC1)c1cc2ccccc2cc1[O-] ZINC000436750664 1041463083 /nfs/dbraw/zinc/46/30/83/1041463083.db2.gz OPCQVNUKUNYUEQ-RXVVDRJESA-N -1 1 347.414 4.053 20 0 EIADMM CN(C(=O)c1ccc(C(F)(F)F)cc1[O-])[C@H]1CCc2ccccc2C1 ZINC000436749380 1041463419 /nfs/dbraw/zinc/46/34/19/1041463419.db2.gz ANOUBYKVXFQHPX-HNNXBMFYSA-N -1 1 349.352 4.041 20 0 EIADMM O=C(c1ccc(C(F)(F)F)cc1[O-])N1CCC[C@]2(CC=CCC2)C1 ZINC000436750886 1041463441 /nfs/dbraw/zinc/46/34/41/1041463441.db2.gz IEKZLGOMQKPLLW-QGZVFWFLSA-N -1 1 339.357 4.374 20 0 EIADMM O=C(Nc1c([O-])cc(Br)cc1Cl)[C@H]1[C@@H]2CCCC[C@@H]21 ZINC000552022371 1041463788 /nfs/dbraw/zinc/46/37/88/1041463788.db2.gz IRUADNRIYCDKNO-GDGBQDQQSA-N -1 1 344.636 4.183 20 0 EIADMM CC[C@@]1(C(=O)[O-])CCCN(Cc2cc(Cl)c(OC)cc2Cl)C1 ZINC000904402425 1041469092 /nfs/dbraw/zinc/46/90/92/1041469092.db2.gz XKYQBHUUMJQWIA-MRXNPFEDSA-N -1 1 346.254 4.079 20 0 EIADMM C[C@@H]1CCN(C(=O)c2ccc(C(F)(F)F)cc2[O-])CC12CCC2 ZINC000436774212 1041469350 /nfs/dbraw/zinc/46/93/50/1041469350.db2.gz SOSARSHIVRTYGV-LLVKDONJSA-N -1 1 327.346 4.063 20 0 EIADMM CC[C@@H](NC(=O)c1ccc(C(F)(F)F)cc1[O-])c1nc(C)cs1 ZINC000436764307 1041474259 /nfs/dbraw/zinc/47/42/59/1041474259.db2.gz QDHRUURXTLAQJK-LLVKDONJSA-N -1 1 344.358 4.057 20 0 EIADMM O=C(c1ccc(C(F)(F)F)cc1[O-])N1CCC[C@@H]1C1CCCC1 ZINC000436765757 1041474670 /nfs/dbraw/zinc/47/46/70/1041474670.db2.gz YMGKSVFGRWDGQE-CQSZACIVSA-N -1 1 327.346 4.206 20 0 EIADMM O=C(c1cc(Cl)ccc1[O-])N1CCC[C@H](c2ccccc2)CC1 ZINC000436792255 1041484035 /nfs/dbraw/zinc/48/40/35/1041484035.db2.gz MTGQHJKKQNRIGU-HNNXBMFYSA-N -1 1 329.827 4.456 20 0 EIADMM CCN(Cc1c[nH]c2ccccc12)C(=O)c1ccc(Cl)cc1[O-] ZINC000436796094 1041485636 /nfs/dbraw/zinc/48/56/36/1041485636.db2.gz TYVVSMVGEQXEJV-UHFFFAOYSA-N -1 1 328.799 4.189 20 0 EIADMM [O-]c1ccc(Cc2nc(Cc3ccc(Cl)cc3)no2)cc1Cl ZINC000904545371 1041524441 /nfs/dbraw/zinc/52/44/41/1041524441.db2.gz ZLFNSOXQFKPZKM-UHFFFAOYSA-N -1 1 335.190 4.264 20 0 EIADMM CCOc1cc(-c2noc(/C=C/c3cncs3)n2)cc(Cl)c1[O-] ZINC000436874334 1041531083 /nfs/dbraw/zinc/53/10/83/1041531083.db2.gz SVKDWNXXLGZQJR-ONEGZZNKSA-N -1 1 349.799 4.121 20 0 EIADMM COc1ccc(-c2nc(-c3ccc([O-])cc3F)no2)cc1C1CC1 ZINC000436875978 1041532707 /nfs/dbraw/zinc/53/27/07/1041532707.db2.gz WFDURAJTTOPVHC-UHFFFAOYSA-N -1 1 326.327 4.134 20 0 EIADMM C[C@H](NC(=O)c1ccc([O-])cc1F)c1cccc(Cl)c1Cl ZINC000436877614 1041537624 /nfs/dbraw/zinc/53/76/24/1041537624.db2.gz BJGBUZRTRZFWFC-QMMMGPOBSA-N -1 1 328.170 4.329 20 0 EIADMM [O-]c1ccc(-c2noc(/C=C\c3cc(F)c(F)c(F)c3)n2)cc1F ZINC000436880892 1041539451 /nfs/dbraw/zinc/53/94/51/1041539451.db2.gz UHBKPDQDOKQUCQ-RJRFIUFISA-N -1 1 336.244 4.169 20 0 EIADMM COc1cccc(C2(c3noc(-c4cc(F)ccc4[O-])n3)CCC2)c1 ZINC000436885946 1041540259 /nfs/dbraw/zinc/54/02/59/1041540259.db2.gz LPQZEJMMZCLCAC-UHFFFAOYSA-N -1 1 340.354 4.060 20 0 EIADMM CN(Cc1ccc(Cl)c(Cl)c1)C(=O)c1c(F)ccc([O-])c1F ZINC000538834070 1041555387 /nfs/dbraw/zinc/55/53/87/1041555387.db2.gz QIWNPMYVCPMQRO-UHFFFAOYSA-N -1 1 346.160 4.249 20 0 EIADMM COc1cc(-c2nc(-c3ccc(C)cc3OC)no2)cc(Cl)c1[O-] ZINC000436951037 1041563972 /nfs/dbraw/zinc/56/39/72/1041563972.db2.gz OZMIEIGZICBRSE-UHFFFAOYSA-N -1 1 346.770 4.088 20 0 EIADMM C[C@@H]1C[C@@H](c2ccccc2)[C@H](C)N1C(=O)c1cc(Cl)ccc1[O-] ZINC000436939554 1041567534 /nfs/dbraw/zinc/56/75/34/1041567534.db2.gz OTBNVFXIASVBLV-DVOMOZLQSA-N -1 1 329.827 4.452 20 0 EIADMM COc1ccc(C(=O)N2CC3(CCCC3)c3cccc(F)c32)c([O-])c1 ZINC000436947286 1041570378 /nfs/dbraw/zinc/57/03/78/1041570378.db2.gz GJFJAJUAVCWCQJ-UHFFFAOYSA-N -1 1 341.382 4.012 20 0 EIADMM O=C([N-]c1c(F)cc(F)cc1F)c1cc(-c2ccccc2)ns1 ZINC000437030532 1041605632 /nfs/dbraw/zinc/60/56/32/1041605632.db2.gz UDSCXVYFLFNDCF-UHFFFAOYSA-N -1 1 334.322 4.480 20 0 EIADMM Cc1cc([N-]S(=O)(=O)c2cccc(Cl)c2)c2cccnc2c1C ZINC000437310624 1041757042 /nfs/dbraw/zinc/75/70/42/1041757042.db2.gz XCVYXNXHXFQCQH-UHFFFAOYSA-N -1 1 346.839 4.306 20 0 EIADMM CC(C)c1cccc(S(=O)(=O)[N-]c2ccccc2N2CCCC2)c1 ZINC000437332462 1041762654 /nfs/dbraw/zinc/76/26/54/1041762654.db2.gz JMTLRQTXUBDVIR-UHFFFAOYSA-N -1 1 344.480 4.211 20 0 EIADMM CCc1n[nH]c([N-]S(=O)(=O)c2ccc(C3CCCCC3)cc2)c1C ZINC000438227799 1042096340 /nfs/dbraw/zinc/09/63/40/1042096340.db2.gz YLOSMMMLLDUWSC-UHFFFAOYSA-N -1 1 347.484 4.129 20 0 EIADMM O=C(C[C@@H]1CC[C@@H]2C[C@@H]21)Nc1c([O-])cc(Br)cc1Cl ZINC000517744063 1042165366 /nfs/dbraw/zinc/16/53/66/1042165366.db2.gz KDKRHBAZIMRGQA-WEDXCCLWSA-N -1 1 344.636 4.183 20 0 EIADMM CCC[C@]1(C)CCCN(Cc2nc3cc(C(=O)[O-])ccc3n2CC)C1 ZINC000517949108 1042288676 /nfs/dbraw/zinc/28/86/76/1042288676.db2.gz RLCCRSZKWWXJNK-HXUWFJFHSA-N -1 1 343.471 4.157 20 0 EIADMM Cc1c(F)cccc1S(=O)(=O)[N-]c1cccc(CC(F)(F)F)c1 ZINC000438769885 1042341838 /nfs/dbraw/zinc/34/18/38/1042341838.db2.gz INBZKNHGPWPOGL-UHFFFAOYSA-N -1 1 347.333 4.040 20 0 EIADMM CC[C@@H](C)Oc1cccc([N-]S(=O)(=O)c2cccc(F)c2C)c1 ZINC000438809003 1042358213 /nfs/dbraw/zinc/35/82/13/1042358213.db2.gz HAQWARHYWFKCPI-GFCCVEGCSA-N -1 1 337.416 4.112 20 0 EIADMM Cc1c(F)cccc1S(=O)(=O)[N-]c1cccc(-c2nccs2)c1 ZINC000438808302 1042358809 /nfs/dbraw/zinc/35/88/09/1042358809.db2.gz SMHOWNCKTYHTQG-UHFFFAOYSA-N -1 1 348.424 4.058 20 0 EIADMM CCc1cc(=O)[n-]c(SCc2nc(-c3ccc(C)cc3)cs2)n1 ZINC000506438474 1042421229 /nfs/dbraw/zinc/42/12/29/1042421229.db2.gz IZCQYNJGKYRFTE-UHFFFAOYSA-N -1 1 343.477 4.469 20 0 EIADMM Cc1nc2[nH]c(-c3ccc([O-])c(Cl)c3)nc2cc1Br ZINC000404674989 1042756832 /nfs/dbraw/zinc/75/68/32/1042756832.db2.gz XKBBMCAUVVDKHQ-UHFFFAOYSA-N -1 1 338.592 4.055 20 0 EIADMM O=S(=O)([N-]c1ccc(-c2ncc[nH]2)cc1)c1ccc2ccccc2c1 ZINC000178189735 1042860723 /nfs/dbraw/zinc/86/07/23/1042860723.db2.gz PKELTFGCCLPLKC-UHFFFAOYSA-N -1 1 349.415 4.031 20 0 EIADMM CC(C)(C)OCc1cc(C(=O)[N-]c2cc(Cl)cc(F)c2F)no1 ZINC000441576951 1042891893 /nfs/dbraw/zinc/89/18/93/1042891893.db2.gz SICIEFIWZOUGBJ-UHFFFAOYSA-N -1 1 344.745 4.174 20 0 EIADMM Cc1c(=O)[n-]c(SCc2cccc(F)c2F)nc1-c1ccccc1 ZINC000185058998 1043154294 /nfs/dbraw/zinc/15/42/94/1043154294.db2.gz GYYYDDUDZZNHSD-UHFFFAOYSA-N -1 1 344.386 4.316 20 0 EIADMM CC(C)S(=O)(=O)c1ccc(Nc2cc(F)c([O-])c(Cl)c2)cc1 ZINC001214486748 1043168506 /nfs/dbraw/zinc/16/85/06/1043168506.db2.gz XNNWOVCOYDKUOE-UHFFFAOYSA-N -1 1 343.807 4.110 20 0 EIADMM CCOc1cc(C(=O)Nc2ccc(Cl)cc2)cc(Cl)c1[O-] ZINC000215914482 1043169162 /nfs/dbraw/zinc/16/91/62/1043169162.db2.gz JELKXYXQUZDGSR-UHFFFAOYSA-N -1 1 326.179 4.350 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2cccc(SC(F)F)c2)cc1C ZINC000727362916 1043208887 /nfs/dbraw/zinc/20/88/87/1043208887.db2.gz HZUCLYQAHMVCAI-UHFFFAOYSA-N -1 1 343.420 4.419 20 0 EIADMM CCOc1cc(-c2nc([C@@H]3Cc4ccccc43)no2)cc(Cl)c1[O-] ZINC000525956527 1043236973 /nfs/dbraw/zinc/23/69/73/1043236973.db2.gz BOGKPNUUBNKBCL-CYBMUJFWSA-N -1 1 342.782 4.182 20 0 EIADMM CS(=O)(=O)c1ccc([O-])c(Nc2ccc(C3CCCC3)cc2)c1 ZINC001212457854 1043241339 /nfs/dbraw/zinc/24/13/39/1043241339.db2.gz RUKRSEUMAUOIPH-UHFFFAOYSA-N -1 1 331.437 4.197 20 0 EIADMM CC(C)c1ccccc1S(=O)(=O)[N-]c1cccc(-c2ncco2)c1 ZINC000189045374 1043412126 /nfs/dbraw/zinc/41/21/26/1043412126.db2.gz NRQZWMBKHOBJMN-UHFFFAOYSA-N -1 1 342.420 4.266 20 0 EIADMM [O-]c1cccnc1-c1nc(-c2ccc(C(F)(F)F)c(Cl)c2)no1 ZINC001212481058 1043435881 /nfs/dbraw/zinc/43/58/81/1043435881.db2.gz YDQOSNRTMHMERV-UHFFFAOYSA-N -1 1 341.676 4.176 20 0 EIADMM [O-]c1cccnc1-c1nc(-c2cccc(Oc3ccccc3)c2)no1 ZINC001212480779 1043437952 /nfs/dbraw/zinc/43/79/52/1043437952.db2.gz IGVLRNAVJQAXGA-UHFFFAOYSA-N -1 1 331.331 4.297 20 0 EIADMM Cc1ccc(C)c(S(=O)(=O)[N-]c2ccc(F)cc2C(F)(F)F)c1 ZINC000442103845 1043489546 /nfs/dbraw/zinc/48/95/46/1043489546.db2.gz AEBUNZDQCZHZIF-UHFFFAOYSA-N -1 1 347.333 4.262 20 0 EIADMM O=C(OCc1ccnc(Cl)c1)c1ccc(Cl)c(Cl)c1[O-] ZINC000730358963 1043503599 /nfs/dbraw/zinc/50/35/99/1043503599.db2.gz FYCMKRLURBDNHV-UHFFFAOYSA-N -1 1 332.570 4.104 20 0 EIADMM COc1cc2ccccc2cc1C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000732309811 1043895343 /nfs/dbraw/zinc/89/53/43/1043895343.db2.gz XORWWGUFAGSVEF-UHFFFAOYSA-N -1 1 327.767 4.460 20 0 EIADMM Cc1c(NC(=O)Nc2ccc([O-])c(Cl)c2)cnn1-c1ccccc1 ZINC000192237898 1043896310 /nfs/dbraw/zinc/89/63/10/1043896310.db2.gz MUJYMMOHGAYAPC-UHFFFAOYSA-N -1 1 342.786 4.184 20 0 EIADMM Cc1ccccc1-n1nccc1NC(=O)Nc1ccc([O-])c(Cl)c1 ZINC000192249383 1043896452 /nfs/dbraw/zinc/89/64/52/1043896452.db2.gz NRWIOVOFYCKOQA-UHFFFAOYSA-N -1 1 342.786 4.184 20 0 EIADMM Cc1ccn(-c2ccccc2NC(=O)Nc2ccc([O-])c(Cl)c2)n1 ZINC000192235651 1043896615 /nfs/dbraw/zinc/89/66/15/1043896615.db2.gz UYKVQZCZIXFILY-UHFFFAOYSA-N -1 1 342.786 4.184 20 0 EIADMM COc1cc(C(=O)N2CCC[C@@H]2CC(C)(C)C)cc(Cl)c1[O-] ZINC000442942525 1043909881 /nfs/dbraw/zinc/90/98/81/1043909881.db2.gz PVTNJPDNGXHLGZ-GFCCVEGCSA-N -1 1 325.836 4.095 20 0 EIADMM COc1cc(C(=O)N[C@H]2c3ccccc3CC[C@@H]2C)cc(Cl)c1[O-] ZINC000443059156 1043981608 /nfs/dbraw/zinc/98/16/08/1043981608.db2.gz BNSOHMLNQHQPCH-APPDUMDISA-N -1 1 345.826 4.108 20 0 EIADMM CC(C)c1ccc2nc(-c3ccc(OCC(F)F)cn3)[n-]c(=O)c2c1 ZINC000443053341 1043990749 /nfs/dbraw/zinc/99/07/49/1043990749.db2.gz AVWXRHSLCOBRLU-UHFFFAOYSA-N -1 1 345.349 4.165 20 0 EIADMM COc1cc(-c2nc(-c3cccc(Cl)c3)no2)cc(Cl)c1[O-] ZINC000443088575 1043999207 /nfs/dbraw/zinc/99/92/07/1043999207.db2.gz MYJNXYQHGKDXQJ-UHFFFAOYSA-N -1 1 337.162 4.425 20 0 EIADMM COc1cc(-c2nc([C@H](C)Oc3ccccc3)no2)cc(Cl)c1[O-] ZINC000443195021 1044081684 /nfs/dbraw/zinc/08/16/84/1044081684.db2.gz JQWQMOYJGSCJEL-JTQLQIEISA-N -1 1 346.770 4.244 20 0 EIADMM COc1cc(-c2nc(-c3ccc4[nH]ccc4c3)no2)cc(Cl)c1[O-] ZINC000443219434 1044103062 /nfs/dbraw/zinc/10/30/62/1044103062.db2.gz UZXJIUQKPKNPRO-UHFFFAOYSA-N -1 1 341.754 4.253 20 0 EIADMM COc1cc(-c2nc(Cc3cc(C)cc(C)c3)no2)cc(Cl)c1[O-] ZINC000443228213 1044112991 /nfs/dbraw/zinc/11/29/91/1044112991.db2.gz WJLIKDOXQGTHAM-UHFFFAOYSA-N -1 1 344.798 4.312 20 0 EIADMM Cc1cc(CSc2nc([O-])cc(=O)n2C2CCCC2)c(C)s1 ZINC000194323878 1044287749 /nfs/dbraw/zinc/28/77/49/1044287749.db2.gz MUFUYSMCEDTRCW-UHFFFAOYSA-N -1 1 336.482 4.035 20 0 EIADMM C[C@H](C(=O)Nc1ccc(F)cc1[O-])c1ccccc1C(F)(F)F ZINC000676056272 1044621917 /nfs/dbraw/zinc/62/19/17/1044621917.db2.gz XBYYLRZBLJXACQ-VIFPVBQESA-N -1 1 327.277 4.292 20 0 EIADMM CN(C(=O)c1ccc(Br)c([O-])c1)C1CCC(C)(C)CC1 ZINC000231350465 1044846245 /nfs/dbraw/zinc/84/62/45/1044846245.db2.gz HJSSDDFACJLWAN-UHFFFAOYSA-N -1 1 340.261 4.196 20 0 EIADMM Cc1cccc(S(=O)(=O)[N-]c2cc(C)c(O)c(C)c2C)c1Cl ZINC000187061600 1044898107 /nfs/dbraw/zinc/89/81/07/1044898107.db2.gz VSRVXQORAWRNNN-UHFFFAOYSA-N -1 1 339.844 4.080 20 0 EIADMM CSc1cccc(S(=O)(=O)[N-]c2ccc3occ(C)c3c2)c1 ZINC000509377363 1045061347 /nfs/dbraw/zinc/06/13/47/1045061347.db2.gz GMPJTLJNYMCSTB-UHFFFAOYSA-N -1 1 333.434 4.264 20 0 EIADMM C[C@@H](NC(=O)c1c([O-])cccc1Cl)c1ncc(-c2ccccc2)o1 ZINC000740142664 1045183611 /nfs/dbraw/zinc/18/36/11/1045183611.db2.gz UUJVNCAGQGHSHN-LLVKDONJSA-N -1 1 342.782 4.192 20 0 EIADMM CC(=O)c1ccc([O-])c(CCOC(=O)c2scc(C)c2Cl)c1 ZINC000791596013 1045780988 /nfs/dbraw/zinc/78/09/88/1045780988.db2.gz RFNSZBHFRHGYIJ-UHFFFAOYSA-N -1 1 338.812 4.018 20 0 EIADMM N#C[C@@H](c1ccccc1)c1ccc([N-]S(=O)(=O)c2ccccc2)cc1 ZINC000032631261 1045808634 /nfs/dbraw/zinc/80/86/34/1045808634.db2.gz ZDNLWCLJLZUDQR-FQEVSTJZSA-N -1 1 348.427 4.143 20 0 EIADMM COCCCC[C@H](NC(=O)c1c([O-])cccc1Cl)c1ccccc1 ZINC000792556538 1045915585 /nfs/dbraw/zinc/91/55/85/1045915585.db2.gz NMVBQQKERREBJD-INIZCTEOSA-N -1 1 347.842 4.333 20 0 EIADMM Cc1ccccc1C[C@H]1CCCN1C(=O)c1c([O-])cccc1Cl ZINC000769859017 1046081626 /nfs/dbraw/zinc/08/16/26/1046081626.db2.gz KDHUTDCXIJRVMV-OAHLLOKOSA-N -1 1 329.827 4.201 20 0 EIADMM CN(C)c1cccc([C@H]2CCCN2C(=O)c2c([O-])cccc2Cl)c1 ZINC000769873695 1046102708 /nfs/dbraw/zinc/10/27/08/1046102708.db2.gz VIUHBILHHCBDCW-MRXNPFEDSA-N -1 1 344.842 4.089 20 0 EIADMM C[C@@H](Cc1ccc(Cl)cc1)N(C)C(=O)c1c([O-])cccc1Cl ZINC000769891293 1046106715 /nfs/dbraw/zinc/10/67/15/1046106715.db2.gz XZAHYKBKTFDSRJ-NSHDSACASA-N -1 1 338.234 4.402 20 0 EIADMM C[C@H](Cc1ccc(Cl)cc1)N(C)C(=O)c1c([O-])cccc1Cl ZINC000769891291 1046106964 /nfs/dbraw/zinc/10/69/64/1046106964.db2.gz XZAHYKBKTFDSRJ-LLVKDONJSA-N -1 1 338.234 4.402 20 0 EIADMM O=C(c1ccc2ccccc2c1[O-])N1CCC(c2ccc(O)cc2)CC1 ZINC000125159193 1046286653 /nfs/dbraw/zinc/28/66/53/1046286653.db2.gz FYECTTKKTALJPU-UHFFFAOYSA-N -1 1 347.414 4.271 20 0 EIADMM C[C@@H](C(=O)[O-])N(C)Cc1ccc(-c2ccc(C(F)(F)F)cc2)s1 ZINC000263441789 1046289332 /nfs/dbraw/zinc/28/93/32/1046289332.db2.gz WUNDSQIZAMMWHO-JTQLQIEISA-N -1 1 343.370 4.339 20 0 EIADMM CC(C)N(CC(=O)[O-])Cc1ccc(-c2cccc(C(F)(F)F)c2)o1 ZINC000263516802 1046300987 /nfs/dbraw/zinc/30/09/87/1046300987.db2.gz PBGZSOKRXMTANY-UHFFFAOYSA-N -1 1 341.329 4.260 20 0 EIADMM Cc1ccc(-c2nnc([N-]C(=O)c3ccc(Cl)o3)s2)c(C)c1 ZINC000065083955 1046380892 /nfs/dbraw/zinc/38/08/92/1046380892.db2.gz GRXVXSWTMMCMQB-UHFFFAOYSA-N -1 1 333.800 4.321 20 0 EIADMM Cc1cccnc1[C@@H]([NH2+]Cc1cccc(O)c1Br)C(C)C ZINC000459416902 1046643497 /nfs/dbraw/zinc/64/34/97/1046643497.db2.gz TYXAGGZSINWLCX-INIZCTEOSA-N -1 1 349.272 4.345 20 0 EIADMM CCc1ccc(S(=O)(=O)[N-]c2cccc(-c3ncc(C)o3)c2)cc1 ZINC000066814866 1046673492 /nfs/dbraw/zinc/67/34/92/1046673492.db2.gz LBHNJUQUGGMETO-UHFFFAOYSA-N -1 1 342.420 4.013 20 0 EIADMM Cc1ccc(-c2noc([N-][C@@H]3CCCc4cn(C(C)C)nc43)n2)cc1 ZINC000785845574 1046765092 /nfs/dbraw/zinc/76/50/92/1046765092.db2.gz SRIHUYGQRVCZIW-MRXNPFEDSA-N -1 1 337.427 4.312 20 0 EIADMM CCC(CC)CN(CC)c1ccc(-c2nc(C)c(C)c(=O)[n-]2)cn1 ZINC000536994664 1046884987 /nfs/dbraw/zinc/88/49/87/1046884987.db2.gz KWMYFWNYEWEPBC-UHFFFAOYSA-N -1 1 328.460 4.124 20 0 EIADMM Cc1c(=O)[n-]c(SC[C@@H]2CC[C@@H](C3CC3)O2)nc1-c1ccccc1 ZINC000917467627 1046910080 /nfs/dbraw/zinc/91/00/80/1046910080.db2.gz FWWOSRXHMYOTDA-HOTGVXAUSA-N -1 1 342.464 4.207 20 0 EIADMM C[C@@H](NC(=O)c1c(F)ccc([O-])c1F)c1cccc(Cl)c1Cl ZINC000537233288 1047047973 /nfs/dbraw/zinc/04/79/73/1047047973.db2.gz ZRHJSXRDAJTKTA-SSDOTTSWSA-N -1 1 346.160 4.468 20 0 EIADMM Cc1onc(OC(F)F)c1[N-]C(=O)c1cc2cc(Cl)ccc2o1 ZINC000788109377 1047101730 /nfs/dbraw/zinc/10/17/30/1047101730.db2.gz AQVDQMGOZNLENC-UHFFFAOYSA-N -1 1 342.685 4.236 20 0 EIADMM CCOc1cccc(NC(=O)c2ccc(C(F)(F)F)c([O-])c2)c1 ZINC000670414734 1047181952 /nfs/dbraw/zinc/18/19/52/1047181952.db2.gz DCVVACRBTGELHE-UHFFFAOYSA-N -1 1 325.286 4.062 20 0 EIADMM Cc1ccc(Cl)c(S(=O)(=O)[N-]c2cc(Cl)ccc2F)c1 ZINC000498031839 1047298724 /nfs/dbraw/zinc/29/87/24/1047298724.db2.gz BSYMIZFWBHQLDD-UHFFFAOYSA-N -1 1 334.199 4.242 20 0 EIADMM Cc1nc(C(C)C)[n-]c(=O)c1C(=O)NC[C@H]1CCCC[C@H]1C(C)(C)C ZINC000747366120 1047391109 /nfs/dbraw/zinc/39/11/09/1047391109.db2.gz UKNYZUCHFCLKNR-HUUCEWRRSA-N -1 1 347.503 4.196 20 0 EIADMM Cc1nc(C(C)C)[n-]c(=O)c1C(=O)Nc1ccc(CCC(C)C)cc1 ZINC000747370254 1047404781 /nfs/dbraw/zinc/40/47/81/1047404781.db2.gz NTBCXNIXPQVHSR-UHFFFAOYSA-N -1 1 341.455 4.455 20 0 EIADMM Cc1ccc(-c2ocnc2C(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000129636086 1047451625 /nfs/dbraw/zinc/45/16/25/1047451625.db2.gz DJXAUGDACOWGLO-UHFFFAOYSA-N -1 1 328.755 4.261 20 0 EIADMM O=C(Nc1cc(F)cc(F)c1[O-])c1cc2sccc2nc1Cl ZINC001142546301 1047599267 /nfs/dbraw/zinc/59/92/67/1047599267.db2.gz UUTIIZHWVNISAJ-UHFFFAOYSA-N -1 1 340.738 4.186 20 0 EIADMM C/C(=C\C(=O)Nc1c([O-])cc(Br)cc1Cl)C1CC1 ZINC000808113054 1047607086 /nfs/dbraw/zinc/60/70/86/1047607086.db2.gz VOJDSBUYAGYEDI-QPJJXVBHSA-N -1 1 330.609 4.103 20 0 EIADMM Cc1[n-][nH]c(=O)c1NC(=O)c1ccc(-c2ccc(C(C)(C)C)cc2)o1 ZINC000615227364 1047733228 /nfs/dbraw/zinc/73/32/28/1047733228.db2.gz PLLUINULTPHHQZ-UHFFFAOYSA-N -1 1 339.395 4.234 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2cc(Cl)ccc2C)cc(C)c1F ZINC000460411046 1047777029 /nfs/dbraw/zinc/77/70/29/1047777029.db2.gz HWJMFVXQIUKVDF-UHFFFAOYSA-N -1 1 327.808 4.205 20 0 EIADMM O=C(N[C@H]1CCO[C@H](c2ccccc2)C1)c1ccc2ccccc2c1[O-] ZINC000131128920 1047833006 /nfs/dbraw/zinc/83/30/06/1047833006.db2.gz ZGBWTABOEKCARG-PXNSSMCTSA-N -1 1 347.414 4.196 20 0 EIADMM CCOc1cc(C(=O)NC(C)(C)c2cccc(C)c2)cc(Cl)c1[O-] ZINC001136845480 1047848227 /nfs/dbraw/zinc/84/82/27/1047848227.db2.gz ONCGLVMJPMYGAZ-UHFFFAOYSA-N -1 1 347.842 4.418 20 0 EIADMM Cc1ccc([C@@H](C)CNC(=O)c2ccc(C(F)(F)F)c([O-])c2)cc1 ZINC001136845374 1047848508 /nfs/dbraw/zinc/84/85/08/1047848508.db2.gz LZPADZHWYIVIQW-LBPRGKRZSA-N -1 1 337.341 4.253 20 0 EIADMM Cc1ccc(C[C@@H]2CCCN(C(=O)c3c([O-])cccc3Cl)C2)cc1 ZINC000747901148 1047858394 /nfs/dbraw/zinc/85/83/94/1047858394.db2.gz SLSNJYZQWXLOIY-INIZCTEOSA-N -1 1 343.854 4.449 20 0 EIADMM Cc1cc(C[N-]C(=O)C(F)(F)F)cc(N[C@H]2CCc3ccccc32)c1 ZINC000825011613 1048010535 /nfs/dbraw/zinc/01/05/35/1048010535.db2.gz PZWQMBRJYOIVJW-KRWDZBQOSA-N -1 1 348.368 4.273 20 0 EIADMM Cc1cc(C[N-]C(=O)C(F)(F)F)cc(N[C@@H]2CCc3ccccc32)c1 ZINC000825011614 1048011001 /nfs/dbraw/zinc/01/10/01/1048011001.db2.gz PZWQMBRJYOIVJW-QGZVFWFLSA-N -1 1 348.368 4.273 20 0 EIADMM CC[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)c1ccc(F)c([O-])c1 ZINC001137007913 1048054705 /nfs/dbraw/zinc/05/47/05/1048054705.db2.gz UMRNEPALRITMEG-FUHWJXTLSA-N -1 1 327.399 4.330 20 0 EIADMM Cc1ccc(C(=O)Nc2ccc(C(=O)C(C)(C)C)cc2)c([O-])c1C ZINC001137044053 1048101625 /nfs/dbraw/zinc/10/16/25/1048101625.db2.gz ADWWAWIRDLSTDE-UHFFFAOYSA-N -1 1 325.408 4.490 20 0 EIADMM O=S(=O)([N-]c1cccc(CCC(F)(F)F)c1)c1ccc(F)cc1 ZINC000131937844 1048171862 /nfs/dbraw/zinc/17/18/62/1048171862.db2.gz NXXZZZZPBZWSGX-UHFFFAOYSA-N -1 1 347.333 4.121 20 0 EIADMM O=C(Nc1ccnn1C1CCCCC1)c1cc2ccccc2cc1[O-] ZINC001143753155 1048184267 /nfs/dbraw/zinc/18/42/67/1048184267.db2.gz ONGWXSNADNLSKS-UHFFFAOYSA-N -1 1 335.407 4.499 20 0 EIADMM CC(=O)Nc1ccc(C)c(NC(=O)c2cc3ccccc3cc2[O-])c1 ZINC000132200711 1048223347 /nfs/dbraw/zinc/22/33/47/1048223347.db2.gz MSTVSNJEHRCYMZ-UHFFFAOYSA-N -1 1 334.375 4.065 20 0 EIADMM CCC(CC)c1nnc([N-]C(=O)c2c(F)ccc(C)c2F)s1 ZINC000499127536 1048315169 /nfs/dbraw/zinc/31/51/69/1048315169.db2.gz LWUQQVOAJASCNO-UHFFFAOYSA-N -1 1 325.384 4.281 20 0 EIADMM C[C@@H](NC(=O)c1c(F)ccc([O-])c1F)c1csc2ccccc21 ZINC000809668005 1048469267 /nfs/dbraw/zinc/46/92/67/1048469267.db2.gz PIYRBJJFMZAMIO-SECBINFHSA-N -1 1 333.359 4.376 20 0 EIADMM Cc1noc(-c2ccccc2)c1[N-]C(=O)c1ccc(F)c(F)c1F ZINC000132825106 1048506464 /nfs/dbraw/zinc/50/64/64/1048506464.db2.gz HRTVIPUJKUNUQX-UHFFFAOYSA-N -1 1 332.281 4.320 20 0 EIADMM CCc1cc2c(CN(C)c3ccc(C)cc3F)cc(=O)oc2cc1[O-] ZINC001171171814 1048632257 /nfs/dbraw/zinc/63/22/57/1048632257.db2.gz ZXIADFNHOSIUDX-UHFFFAOYSA-N -1 1 341.382 4.145 20 0 EIADMM CC(=Cc1ccc(C)cc1)C(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1 ZINC000810111721 1048633476 /nfs/dbraw/zinc/63/34/76/1048633476.db2.gz UBSXFTOALJNFRG-SDNWHVSQSA-N -1 1 333.391 4.133 20 0 EIADMM CC(C)Oc1ccc([C@H](C)NC(=O)c2c([O-])cccc2Cl)cc1 ZINC000920444229 1048674307 /nfs/dbraw/zinc/67/43/07/1048674307.db2.gz BXMNVWGGGMJJGD-LBPRGKRZSA-N -1 1 333.815 4.324 20 0 EIADMM CC(C)Oc1ccc([C@@H](C)NC(=O)c2c([O-])cccc2Cl)cc1 ZINC000920444227 1048674449 /nfs/dbraw/zinc/67/44/49/1048674449.db2.gz BXMNVWGGGMJJGD-GFCCVEGCSA-N -1 1 333.815 4.324 20 0 EIADMM C[C@H](NC(=O)c1c([O-])cccc1Cl)c1ccc(F)c(Cl)c1 ZINC000920462267 1048679678 /nfs/dbraw/zinc/67/96/78/1048679678.db2.gz AQTBQISMPHKWRV-QMMMGPOBSA-N -1 1 328.170 4.329 20 0 EIADMM CN(Cc1cccc(OC(F)(F)F)c1)Cc1c(F)cc([O-])cc1F ZINC001144567702 1048733853 /nfs/dbraw/zinc/73/38/53/1048733853.db2.gz ZLKDNYJZWXBLGL-UHFFFAOYSA-N -1 1 347.283 4.201 20 0 EIADMM [O-]c1cc(F)c(CN2CCC(c3ccc(F)cc3F)CC2)cc1F ZINC001144664003 1048780628 /nfs/dbraw/zinc/78/06/28/1048780628.db2.gz QWSFXHIWWIPQBT-UHFFFAOYSA-N -1 1 339.332 4.328 20 0 EIADMM C[N@@H+](CCc1ccc(C(F)(F)F)cc1)Cc1cc(F)c([O-])cc1F ZINC001144663779 1048783142 /nfs/dbraw/zinc/78/31/42/1048783142.db2.gz ISOZGBCIRDZFBF-UHFFFAOYSA-N -1 1 345.311 4.364 20 0 EIADMM [O-]c1cc(F)c(CN2CCC[C@H]2c2ccc(F)cc2F)cc1F ZINC001144659928 1048792460 /nfs/dbraw/zinc/79/24/60/1048792460.db2.gz RBFQHTMTOUIONR-INIZCTEOSA-N -1 1 325.305 4.286 20 0 EIADMM O=C([N-]Cc1ccc(C(F)(F)F)cc1)C(F)(F)c1ccc(F)cc1 ZINC000920843093 1048802415 /nfs/dbraw/zinc/80/24/15/1048802415.db2.gz VNOXGTAQWFIQAW-UHFFFAOYSA-N -1 1 347.258 4.253 20 0 EIADMM O=C(c1ccc([O-])cc1F)N(Cc1c(F)cccc1F)C1CCCC1 ZINC001144832535 1048864641 /nfs/dbraw/zinc/86/46/41/1048864641.db2.gz AQTDMRGRQCHINF-UHFFFAOYSA-N -1 1 349.352 4.395 20 0 EIADMM C[C@H](NC(=O)c1ncccc1[O-])c1ccc(Cl)c(Cl)c1Cl ZINC001144855227 1048869735 /nfs/dbraw/zinc/86/97/35/1048869735.db2.gz OLQLDRPEIZZWKC-ZETCQYMHSA-N -1 1 345.613 4.238 20 0 EIADMM Cc1c([N-]C(=O)c2cc(-c3cccc(F)c3)no2)noc1C(C)(C)C ZINC001132459119 1048872166 /nfs/dbraw/zinc/87/21/66/1048872166.db2.gz UGOLJQARAVZJKC-UHFFFAOYSA-N -1 1 343.358 4.327 20 0 EIADMM C[C@@H](c1ccc(F)c(F)c1)N(C)C(=O)c1ncc2ccccc2c1[O-] ZINC001135937402 1048998286 /nfs/dbraw/zinc/99/82/86/1048998286.db2.gz NZWLBVZXNKIQHU-NSHDSACASA-N -1 1 342.345 4.052 20 0 EIADMM O=C(Nc1nc(/C=C\c2ccccc2)cs1)c1cc(F)ccc1[O-] ZINC001146400917 1049021606 /nfs/dbraw/zinc/02/16/06/1049021606.db2.gz ZCYIGBJAYOMPJT-VURMDHGXSA-N -1 1 340.379 4.411 20 0 EIADMM O=C(CCc1ccccc1C(F)(F)F)Nc1c([O-])cccc1F ZINC001146492297 1049028395 /nfs/dbraw/zinc/02/83/95/1049028395.db2.gz NHPDSBLEXILLGI-UHFFFAOYSA-N -1 1 327.277 4.121 20 0 EIADMM CCCOc1nc(Cl)nc([N-][C@@H](c2ccccc2)C(F)(F)F)n1 ZINC001170882741 1049057145 /nfs/dbraw/zinc/05/71/45/1049057145.db2.gz KSUXVHVMQPULFZ-JTQLQIEISA-N -1 1 346.740 4.029 20 0 EIADMM COc1ccc([C@H]2CCCCCN2C(=O)c2cccc([O-])c2F)cc1 ZINC001136102775 1049084713 /nfs/dbraw/zinc/08/47/13/1049084713.db2.gz GKGSCQJTZXUQHB-QGZVFWFLSA-N -1 1 343.398 4.297 20 0 EIADMM CC[C@H](NC(=O)Cc1ccc([O-])c(Cl)c1)c1cc(F)ccc1F ZINC001147218314 1049114454 /nfs/dbraw/zinc/11/44/54/1049114454.db2.gz OKORABFPIFPDAP-HNNXBMFYSA-N -1 1 339.769 4.134 20 0 EIADMM CC(C)n1c2ccccc2nc1NC(=O)Cc1ccc([O-])c(Cl)c1 ZINC001147656852 1049194594 /nfs/dbraw/zinc/19/45/94/1049194594.db2.gz XDWQBZGTWQRVQI-UHFFFAOYSA-N -1 1 343.814 4.157 20 0 EIADMM O=S(=O)([N-]c1cccc(Cl)c1Cl)c1cccc(F)c1F ZINC000135634097 1049236384 /nfs/dbraw/zinc/23/63/84/1049236384.db2.gz AWXOPXCUGPWZRQ-UHFFFAOYSA-N -1 1 338.162 4.072 20 0 EIADMM O=C([N-]c1noc2cccnc21)c1sc2cc(F)ccc2c1Cl ZINC001147980961 1049244474 /nfs/dbraw/zinc/24/44/74/1049244474.db2.gz ZISGHCCBCLDRSU-UHFFFAOYSA-N -1 1 347.758 4.482 20 0 EIADMM O=C(NCCc1ccc2ccccc2c1)c1cc(Cl)ccc1[O-] ZINC001136192119 1049262357 /nfs/dbraw/zinc/26/23/57/1049262357.db2.gz OZTUTAWMFREWAZ-UHFFFAOYSA-N -1 1 325.795 4.171 20 0 EIADMM O=C(Nc1cccc(C(F)(F)F)c1[O-])c1cc(Cl)ccc1F ZINC001148427668 1049306438 /nfs/dbraw/zinc/30/64/38/1049306438.db2.gz PFZXMMXQEDRPMV-UHFFFAOYSA-N -1 1 333.668 4.456 20 0 EIADMM C[C@@]1(Cc2cccc3ccccc32)CCCN1C(=O)c1cncc([O-])c1 ZINC001148559763 1049332580 /nfs/dbraw/zinc/33/25/80/1049332580.db2.gz ZBVNSWMULRUYOO-QFIPXVFZSA-N -1 1 346.430 4.178 20 0 EIADMM O=C(c1cccc(-c2ccccc2)c1[O-])N1CCCC(F)(F)CC1 ZINC001148861032 1049390739 /nfs/dbraw/zinc/39/07/39/1049390739.db2.gz HTWSYKZSTGSFCZ-UHFFFAOYSA-N -1 1 331.362 4.321 20 0 EIADMM COc1cncc(NC(=O)c2cccc(-c3ccccc3)c2[O-])c1C ZINC001148861020 1049392310 /nfs/dbraw/zinc/39/23/10/1049392310.db2.gz GYEHZEDTFNTFEO-UHFFFAOYSA-N -1 1 334.375 4.024 20 0 EIADMM Cc1ccc(NC(=O)c2cc(F)ccc2[O-])cc1NC(=O)C(C)(C)C ZINC000080027349 1049544998 /nfs/dbraw/zinc/54/49/98/1049544998.db2.gz IQZOWPSIFFZHOY-UHFFFAOYSA-N -1 1 344.386 4.077 20 0 EIADMM C=Cc1ccc(S(=O)(=O)[N-]c2ccc(SC(F)F)cc2)cc1 ZINC000821111726 1049599518 /nfs/dbraw/zinc/59/95/18/1049599518.db2.gz RZEFRBMHPTZFPR-UHFFFAOYSA-N -1 1 341.404 4.445 20 0 EIADMM CCSc1cccc(F)c1[N-]C(=O)c1ccc(Cn2cccn2)o1 ZINC000813304446 1049748367 /nfs/dbraw/zinc/74/83/67/1049748367.db2.gz ZDSTXHOLPSGEDQ-UHFFFAOYSA-N -1 1 345.399 4.028 20 0 EIADMM C[C@@H](C1CC1)N(C(=O)Cc1ccc([O-])c(Cl)c1)c1ccccc1 ZINC001171588873 1049752468 /nfs/dbraw/zinc/75/24/68/1049752468.db2.gz IEPIMEDSNROMQN-ZDUSSCGKSA-N -1 1 329.827 4.420 20 0 EIADMM Cc1cccnc1Oc1ccc(C(=O)Nc2cccc(F)c2[O-])cc1 ZINC001171636157 1049776705 /nfs/dbraw/zinc/77/67/05/1049776705.db2.gz DJNCYIULMZORBF-UHFFFAOYSA-N -1 1 338.338 4.279 20 0 EIADMM O=C(CCOc1ccc2ccccc2c1)Nc1cccc(F)c1[O-] ZINC001171636228 1049777690 /nfs/dbraw/zinc/77/76/90/1049777690.db2.gz FEGPDNGFUGQJDL-UHFFFAOYSA-N -1 1 325.339 4.092 20 0 EIADMM Cn1c2ccccc2c2cc(S(=O)(=O)[N-]c3ccccc3)ccc21 ZINC000615917435 1049810345 /nfs/dbraw/zinc/81/03/45/1049810345.db2.gz HITVIIYSCCAKSF-UHFFFAOYSA-N -1 1 336.416 4.132 20 0 EIADMM CC1(C)[C@@H](c2ccccc2F)CCN1C(=O)c1ccc([O-])c(F)c1 ZINC001171854712 1049813555 /nfs/dbraw/zinc/81/35/55/1049813555.db2.gz KMVABIMSKNLEAN-CQSZACIVSA-N -1 1 331.362 4.079 20 0 EIADMM O=C(c1ccc(C(F)(F)F)cc1[O-])N1CCC(c2ccco2)CC1 ZINC000617383735 1049986967 /nfs/dbraw/zinc/98/69/67/1049986967.db2.gz NSTYBBCFSVUFJX-UHFFFAOYSA-N -1 1 339.313 4.024 20 0 EIADMM O=C(NCc1cccc(F)c1)Nc1cc(Cl)c(Cl)cc1[O-] ZINC001185826012 1050166323 /nfs/dbraw/zinc/16/63/23/1050166323.db2.gz ZEFGGPWCJPLDEG-UHFFFAOYSA-N -1 1 329.158 4.160 20 0 EIADMM CCc1cc(Cl)ccc1[N-]S(=O)(=O)c1cccc(F)c1C ZINC001185829738 1050168277 /nfs/dbraw/zinc/16/82/77/1050168277.db2.gz ZCFOVNXYGKRJPI-UHFFFAOYSA-N -1 1 327.808 4.151 20 0 EIADMM CCc1ccc(Cl)cc1[N-]S(=O)(=O)c1cccc(F)c1C ZINC001185836838 1050168346 /nfs/dbraw/zinc/16/83/46/1050168346.db2.gz NZILUAVECAOFCM-UHFFFAOYSA-N -1 1 327.808 4.151 20 0 EIADMM Cc1cc(C(F)(F)F)ccc1[N-]S(=O)(=O)c1cccc(F)c1C ZINC001185824681 1050172948 /nfs/dbraw/zinc/17/29/48/1050172948.db2.gz DUCVYQYEHWDIHE-UHFFFAOYSA-N -1 1 347.333 4.262 20 0 EIADMM Cc1cccc(C(C)C)c1[N-]S(=O)(=O)c1cccc2cnccc21 ZINC000091053109 1050222107 /nfs/dbraw/zinc/22/21/07/1050222107.db2.gz HZFCLXMQJOIPFQ-UHFFFAOYSA-N -1 1 340.448 4.467 20 0 EIADMM Cc1cccc(C(C)C)c1[N-]S(=O)(=O)c1cc(F)c(F)c(F)c1 ZINC000091053142 1050224665 /nfs/dbraw/zinc/22/46/65/1050224665.db2.gz HDELURLZWVVXLJ-UHFFFAOYSA-N -1 1 343.370 4.337 20 0 EIADMM FC(F)(F)c1cnc(-c2nc(-c3cc(Cl)ccc3Cl)no2)[n-]1 ZINC001212690125 1050229757 /nfs/dbraw/zinc/22/97/57/1050229757.db2.gz YZAXAQDNABRQKJ-UHFFFAOYSA-N -1 1 349.099 4.452 20 0 EIADMM FC(F)(F)c1c[n-]c(-c2nc(-c3cc(Cl)ccc3Cl)no2)n1 ZINC001212690125 1050229770 /nfs/dbraw/zinc/22/97/70/1050229770.db2.gz YZAXAQDNABRQKJ-UHFFFAOYSA-N -1 1 349.099 4.452 20 0 EIADMM COc1cc(C(=O)N2CC[C@H](C3CCCCC3)C2)cc(Cl)c1[O-] ZINC000618182448 1050301837 /nfs/dbraw/zinc/30/18/37/1050301837.db2.gz IDLLAIVLDCLTGE-ZDUSSCGKSA-N -1 1 337.847 4.097 20 0 EIADMM CC(=O)c1ccc([N-]S(=O)(=O)c2csc3ccccc32)c(F)c1 ZINC001186495983 1050339275 /nfs/dbraw/zinc/33/92/75/1050339275.db2.gz YRBXBGSNUHGHNB-UHFFFAOYSA-N -1 1 349.408 4.044 20 0 EIADMM C[C@H](c1ccc(F)cc1F)N1CCC(C(=O)c2ccc([O-])cc2)CC1 ZINC000618440726 1050378827 /nfs/dbraw/zinc/37/88/27/1050378827.db2.gz QAQOQACSYUQJQZ-CYBMUJFWSA-N -1 1 345.389 4.326 20 0 EIADMM [O-]c1ccc(Cl)c(Nc2cnn(Cc3ccncc3)c2)c1Cl ZINC001203140048 1050413196 /nfs/dbraw/zinc/41/31/96/1050413196.db2.gz ZTLVAQLZPDCYPG-UHFFFAOYSA-N -1 1 335.194 4.082 20 0 EIADMM CC[C@H](C)C[C@@H](C)[N-]S(=O)(=O)c1ccc(Cl)c(F)c1Cl ZINC001187372833 1050529054 /nfs/dbraw/zinc/52/90/54/1050529054.db2.gz FENTVBVCVRDLSV-DTWKUNHWSA-N -1 1 342.263 4.236 20 0 EIADMM CCS(=O)(=O)c1ccc([O-])c(Nc2cc(C(C)C)ccc2OC)c1 ZINC001173915179 1050624038 /nfs/dbraw/zinc/62/40/38/1050624038.db2.gz HCVBBCLIVNCRLU-UHFFFAOYSA-N -1 1 349.452 4.061 20 0 EIADMM CCOc1cc(C(=O)N(C)Cc2c(C)cccc2C)cc(Cl)c1[O-] ZINC001179356945 1050671304 /nfs/dbraw/zinc/67/13/04/1050671304.db2.gz ZHBFXOYYWWDZHL-UHFFFAOYSA-N -1 1 347.842 4.333 20 0 EIADMM CCCC[C@H](CCC)C[N-]S(=O)(=O)c1cc2cc(F)ccc2o1 ZINC001188017353 1050679740 /nfs/dbraw/zinc/67/97/40/1050679740.db2.gz OUMNWGLVEAYQBJ-ZDUSSCGKSA-N -1 1 341.448 4.457 20 0 EIADMM COc1ccc(OC)c(OC)c1Nc1cc(Cl)cc(Cl)c1[O-] ZINC001174054852 1050692814 /nfs/dbraw/zinc/69/28/14/1050692814.db2.gz JPUMBTODJZEQLZ-UHFFFAOYSA-N -1 1 344.194 4.468 20 0 EIADMM O=S(=O)([N-]c1ccccc1Oc1ccc(Cl)cc1)C1CCC1 ZINC001188130081 1050706153 /nfs/dbraw/zinc/70/61/53/1050706153.db2.gz FRUWAEATYNOEFN-UHFFFAOYSA-N -1 1 337.828 4.427 20 0 EIADMM O=C(c1c([O-])cccc1Cl)N1CC=C(c2ccc(Cl)nc2)CC1 ZINC000773815361 1050706393 /nfs/dbraw/zinc/70/63/93/1050706393.db2.gz RBWDYJCYHIQLSL-UHFFFAOYSA-N -1 1 349.217 4.024 20 0 EIADMM CCCc1cc(=O)[n-]c(SC[C@@H](OC)c2ccc(Cl)cc2)n1 ZINC001188163228 1050712812 /nfs/dbraw/zinc/71/28/12/1050712812.db2.gz QGODHPIYGQATBK-CQSZACIVSA-N -1 1 338.860 4.268 20 0 EIADMM O=C(Nc1cc(F)c([O-])cc1Cl)[C@@H]1Cc2ccc(Cl)cc21 ZINC001179660284 1050740979 /nfs/dbraw/zinc/74/09/79/1050740979.db2.gz NYOACWZPSVWVCV-SNVBAGLBSA-N -1 1 326.154 4.117 20 0 EIADMM O=C(Nc1ccc(C2CCC2)nc1)c1ccc([O-])c(C(F)(F)F)c1 ZINC001188572637 1050796717 /nfs/dbraw/zinc/79/67/17/1050796717.db2.gz SLVRVWMRZHVCGD-UHFFFAOYSA-N -1 1 336.313 4.326 20 0 EIADMM O=C(Nc1ccc(-n2ccc(=O)[n-]2)cc1)Nc1cccc2ccccc21 ZINC001188942668 1050867744 /nfs/dbraw/zinc/86/77/44/1050867744.db2.gz GGFVRVLRSYJACB-UHFFFAOYSA-N -1 1 344.374 4.375 20 0 EIADMM O=c1oc2cc([O-])ccc2cc1Nc1cccc(N2CCCCC2)c1 ZINC001174302479 1050870720 /nfs/dbraw/zinc/87/07/20/1050870720.db2.gz VYFTUESCICJZGN-UHFFFAOYSA-N -1 1 336.391 4.233 20 0 EIADMM Cc1nc(SCCc2cccc(Cl)c2Cl)[n-]c(=O)c1C ZINC001189060554 1050896386 /nfs/dbraw/zinc/89/63/86/1050896386.db2.gz APJXVMSZNTVLOX-UHFFFAOYSA-N -1 1 329.252 4.441 20 0 EIADMM Cc1nc(S[C@H](C)C(=O)c2ccc(C(C)(C)C)cc2)[n-]c(=O)c1C ZINC001189060845 1050896585 /nfs/dbraw/zinc/89/65/85/1050896585.db2.gz DYGRDIUARLRGMH-CYBMUJFWSA-N -1 1 344.480 4.460 20 0 EIADMM CC(C)=CCC[N-]S(=O)(=O)c1sc2ccccc2c1Cl ZINC001189170197 1050928875 /nfs/dbraw/zinc/92/88/75/1050928875.db2.gz HDNOSOWBKDXADQ-UHFFFAOYSA-N -1 1 329.874 4.189 20 0 EIADMM CC(C)(C)[C@H]1CCC[C@@H]([N-]S(=O)(=O)c2cc(F)ccc2F)CC1 ZINC001189289490 1050947933 /nfs/dbraw/zinc/94/79/33/1050947933.db2.gz OLTXCRUHWSBHGI-GXTWGEPZSA-N -1 1 345.455 4.238 20 0 EIADMM CCOc1ccc([N-]S(=O)(=O)c2ccc(F)c3ccccc32)cc1 ZINC001189386000 1050975361 /nfs/dbraw/zinc/97/53/61/1050975361.db2.gz RPGITXSCQVNIEX-UHFFFAOYSA-N -1 1 345.395 4.178 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2ccc(F)c3ccccc32)cc1F ZINC001189348450 1050977003 /nfs/dbraw/zinc/97/70/03/1050977003.db2.gz QEKMWBBHVGUVFU-UHFFFAOYSA-N -1 1 333.359 4.227 20 0 EIADMM COc1ccc(C)c([N-]S(=O)(=O)c2ccc(F)c3ccccc32)c1 ZINC001189349057 1050978647 /nfs/dbraw/zinc/97/86/47/1050978647.db2.gz SYLIWPHDBKVYBZ-UHFFFAOYSA-N -1 1 345.395 4.097 20 0 EIADMM Nc1ccc(Nc2c([O-])c(Br)ccc2Cl)c(F)c1 ZINC001174483669 1050992748 /nfs/dbraw/zinc/99/27/48/1050992748.db2.gz OKWJTSVWEYXAMZ-UHFFFAOYSA-N -1 1 331.572 4.273 20 0 EIADMM COC(=O)c1ccc([O-])c(NC(=O)Nc2ccccc2C(C)(C)C)c1 ZINC001189591189 1051016692 /nfs/dbraw/zinc/01/66/92/1051016692.db2.gz MTRVZAKDLRJTAL-UHFFFAOYSA-N -1 1 342.395 4.120 20 0 EIADMM [O-]c1c(Cl)cc(Br)cc1Nc1ccc2cn[nH]c2c1 ZINC001174502411 1051036864 /nfs/dbraw/zinc/03/68/64/1051036864.db2.gz NMLVSEAFCSCZDH-UHFFFAOYSA-N -1 1 338.592 4.428 20 0 EIADMM Cc1ccc(C)c([N-]S(=O)(=O)c2cc(F)cc(C(F)(F)F)c2)c1 ZINC001189948748 1051087748 /nfs/dbraw/zinc/08/77/48/1051087748.db2.gz KAOVODVRFZXEQP-UHFFFAOYSA-N -1 1 347.333 4.262 20 0 EIADMM O=C(Nc1c([O-])cccc1F)NC1c2ccccc2-c2ccccc21 ZINC001190037366 1051105642 /nfs/dbraw/zinc/10/56/42/1051105642.db2.gz FEUWLEVMBQIOEV-UHFFFAOYSA-N -1 1 334.350 4.423 20 0 EIADMM O=C(NCc1ccc(Cl)cc1Cl)Nc1ccc([O-])c(F)c1F ZINC001190092856 1051111967 /nfs/dbraw/zinc/11/19/67/1051111967.db2.gz DFGQZWQGYPKFSZ-UHFFFAOYSA-N -1 1 347.148 4.299 20 0 EIADMM O=c1cc(CSC2CCC(F)(F)CC2)c2ccc([O-])cc2o1 ZINC001190227591 1051133402 /nfs/dbraw/zinc/13/34/02/1051133402.db2.gz DCMBBDZTXKZFCU-UHFFFAOYSA-N -1 1 326.364 4.310 20 0 EIADMM CO[C@H](CSc1nc(-c2ccccc2)cc(=O)[n-]1)c1ccccc1 ZINC001190201185 1051136194 /nfs/dbraw/zinc/13/61/94/1051136194.db2.gz LZWULZVUQBRQHC-QGZVFWFLSA-N -1 1 338.432 4.329 20 0 EIADMM Cc1noc(-c2ccccc2)c1NC(=O)Nc1cc(F)c(F)cc1[O-] ZINC001190368921 1051170701 /nfs/dbraw/zinc/17/07/01/1051170701.db2.gz LAKKOMHWNPJYIU-UHFFFAOYSA-N -1 1 345.305 4.278 20 0 EIADMM CCC(C)(C)c1ccc(S(=O)(=O)[N-]c2ccc(COC)cc2)cc1 ZINC001190447193 1051188716 /nfs/dbraw/zinc/18/87/16/1051188716.db2.gz KKDRJCZSLRTRJE-UHFFFAOYSA-N -1 1 347.480 4.321 20 0 EIADMM Cc1ccc(OC(C)C)cc1[N-]S(=O)(=O)c1ccc(C2CC2)cc1 ZINC001190499437 1051194749 /nfs/dbraw/zinc/19/47/49/1051194749.db2.gz GBTAKGCDAOSGAQ-UHFFFAOYSA-N -1 1 345.464 4.460 20 0 EIADMM COc1cc(C(=O)N(C)c2cccc(C(C)C)c2)cc(Cl)c1[O-] ZINC000153666390 1051210494 /nfs/dbraw/zinc/21/04/94/1051210494.db2.gz ZNIBVXHFUJIFIG-UHFFFAOYSA-N -1 1 333.815 4.454 20 0 EIADMM [O-]c1cc(F)c(Nc2cc(F)cnc2Br)cc1Cl ZINC001250020634 1051295613 /nfs/dbraw/zinc/29/56/13/1051295613.db2.gz YBCNKUGAMBLUBG-UHFFFAOYSA-N -1 1 335.535 4.225 20 0 EIADMM COc1cc(C(=O)Nc2cc(Cl)cc(Cl)n2)cc(Cl)c1[O-] ZINC001191128951 1051360574 /nfs/dbraw/zinc/36/05/74/1051360574.db2.gz GNNZXCHHGHJIBG-UHFFFAOYSA-N -1 1 347.585 4.008 20 0 EIADMM COc1cc(C(=O)Nc2c(C)c(C)c(N)c(C)c2C)cc(Cl)c1[O-] ZINC001191148836 1051365101 /nfs/dbraw/zinc/36/51/01/1051365101.db2.gz RPZRYMMNXUHQLV-UHFFFAOYSA-N -1 1 348.830 4.122 20 0 EIADMM [O-]c1c(Cl)cc(Br)cc1Nc1cc(CO)ccc1F ZINC001175131837 1051399418 /nfs/dbraw/zinc/39/94/18/1051399418.db2.gz CGPUWEORECMOIH-UHFFFAOYSA-N -1 1 346.583 4.183 20 0 EIADMM CC(=O)c1ccc(Nc2c(F)ccc([O-])c2F)c(Br)c1 ZINC001175268454 1051502989 /nfs/dbraw/zinc/50/29/89/1051502989.db2.gz OMRWYMLKCYCMSD-UHFFFAOYSA-N -1 1 342.139 4.379 20 0 EIADMM CC(C)(C)OC(=O)Nc1ccc([N-]c2nnc(-c3ccco3)o2)cc1 ZINC001175546109 1051631200 /nfs/dbraw/zinc/63/12/00/1051631200.db2.gz UXVTYCNXPOQILW-UHFFFAOYSA-N -1 1 342.355 4.420 20 0 EIADMM CCc1ccc(C(=O)Nc2nc(-c3ccc(C)s3)ns2)c([O-])c1 ZINC001182569801 1051639423 /nfs/dbraw/zinc/63/94/23/1051639423.db2.gz SCOAJPBLIKPJGL-UHFFFAOYSA-N -1 1 345.449 4.095 20 0 EIADMM CC(C)(C)c1ccc(C(=O)Nc2c(Cl)cnnc2Cl)c([O-])c1 ZINC001192315218 1051689541 /nfs/dbraw/zinc/68/95/41/1051689541.db2.gz ZLYCJHHYWDJQJL-UHFFFAOYSA-N -1 1 340.210 4.039 20 0 EIADMM O=C(c1c(F)ccc([O-])c1F)N1CCC[C@@H]1c1cc2ccccc2[nH]1 ZINC001192535545 1051764330 /nfs/dbraw/zinc/76/43/30/1051764330.db2.gz IFUUJTBNQXKSDY-OAHLLOKOSA-N -1 1 342.345 4.129 20 0 EIADMM O=C(Nc1ccc(-c2cccc(O)c2)cc1)c1c(F)ccc([O-])c1F ZINC001192540206 1051765000 /nfs/dbraw/zinc/76/50/00/1051765000.db2.gz SXIYTUJIYGSYAD-UHFFFAOYSA-N -1 1 341.313 4.295 20 0 EIADMM [O-]c1c(Br)c(F)ccc1Nc1cnn(-c2ccccc2)c1 ZINC001175794452 1051791099 /nfs/dbraw/zinc/79/10/99/1051791099.db2.gz FFWWEOJUAUVBLP-UHFFFAOYSA-N -1 1 348.175 4.223 20 0 EIADMM CC(C)(C(=O)Nc1cccc(C(F)(F)F)c1[O-])c1ccc(O)cc1 ZINC001183781399 1051897629 /nfs/dbraw/zinc/89/76/29/1051897629.db2.gz CWTAQOGYHZZDGP-UHFFFAOYSA-N -1 1 339.313 4.033 20 0 EIADMM COc1ccc(Nc2cc(Br)cc(Cl)c2[O-])cc1O ZINC001176259974 1051988021 /nfs/dbraw/zinc/98/80/21/1051988021.db2.gz STDGKJAYGWZMDG-UHFFFAOYSA-N -1 1 344.592 4.266 20 0 EIADMM CSc1ccc([O-])c(C(=O)N2C[C@H](C(C)C)Nc3ccccc32)c1 ZINC000621891712 1052005838 /nfs/dbraw/zinc/00/58/38/1052005838.db2.gz DZIQYDQUDVLHTL-MRXNPFEDSA-N -1 1 342.464 4.211 20 0 EIADMM CCN(CC)C(=O)c1cc(F)cc(Nc2ccc(F)c(F)c2[O-])c1 ZINC001176304490 1052008476 /nfs/dbraw/zinc/00/84/76/1052008476.db2.gz XGYZVWQNVBKNPE-UHFFFAOYSA-N -1 1 338.329 4.035 20 0 EIADMM Cc1c(=O)[n-]c(SCc2ccc(F)c(F)c2)nc1-c1ccccc1 ZINC000163929197 1052010476 /nfs/dbraw/zinc/01/04/76/1052010476.db2.gz AVPVCQYYDBIPLD-UHFFFAOYSA-N -1 1 344.386 4.316 20 0 EIADMM Cc1ccccc1-c1ccc([N-]S(=O)(=O)c2ccccc2N)cc1 ZINC001193928182 1052021114 /nfs/dbraw/zinc/02/11/14/1052021114.db2.gz AJASCDMZGYNJEB-UHFFFAOYSA-N -1 1 338.432 4.045 20 0 EIADMM O=C(OCc1csc(-c2ccccc2F)n1)c1ccc([O-])cc1F ZINC000773569756 1052038485 /nfs/dbraw/zinc/03/84/85/1052038485.db2.gz WHJODRUEPQTAKR-UHFFFAOYSA-N -1 1 347.342 4.151 20 0 EIADMM COc1cc(OC)c(Nc2c(F)cc(F)c([O-])c2F)cc1Cl ZINC001176669821 1052156773 /nfs/dbraw/zinc/15/67/73/1052156773.db2.gz LHPVAJHZFYROHW-UHFFFAOYSA-N -1 1 333.693 4.224 20 0 EIADMM CC1(C)COC(c2cccc(Nc3c(F)cc(F)c([O-])c3F)c2)=N1 ZINC001176673524 1052161669 /nfs/dbraw/zinc/16/16/69/1052161669.db2.gz JGZSKEVXSLZXQZ-UHFFFAOYSA-N -1 1 336.313 4.109 20 0 EIADMM CCn1nc(-c2ccccc2)cc1Nc1c(F)cc(F)c([O-])c1F ZINC001176663345 1052172744 /nfs/dbraw/zinc/17/27/44/1052172744.db2.gz FYRHCWNLIHDVQN-UHFFFAOYSA-N -1 1 333.313 4.437 20 0 EIADMM O=C(Nc1c([O-])cccc1Cl)Oc1ccc(Br)cc1 ZINC001194599550 1052176989 /nfs/dbraw/zinc/17/69/89/1052176989.db2.gz XJZFRTOPJSCASE-UHFFFAOYSA-N -1 1 342.576 4.419 20 0 EIADMM Cc1cccc(C)c1S(=O)(=O)[N-]c1ccccc1-c1cccnc1 ZINC001194641975 1052183662 /nfs/dbraw/zinc/18/36/62/1052183662.db2.gz DZEZSAOMCPWHJG-UHFFFAOYSA-N -1 1 338.432 4.166 20 0 EIADMM Cc1cccc(C)c1S(=O)(=O)[N-]c1ccc(Cl)c2ncccc12 ZINC001194637760 1052184041 /nfs/dbraw/zinc/18/40/41/1052184041.db2.gz DKHPZESOERWBKA-UHFFFAOYSA-N -1 1 346.839 4.306 20 0 EIADMM O=S(=O)([N-]c1cc(F)ccc1Cl)c1cc2ccccc2s1 ZINC001185454925 1052243734 /nfs/dbraw/zinc/24/37/34/1052243734.db2.gz VMLZKJJCZLMTON-UHFFFAOYSA-N -1 1 341.816 4.495 20 0 EIADMM Cc1cc(S(=O)(=O)[N-]c2ccc(-c3cnco3)cc2)ccc1Cl ZINC001185524791 1052255259 /nfs/dbraw/zinc/25/52/59/1052255259.db2.gz KYZRHERWYPTUFU-UHFFFAOYSA-N -1 1 348.811 4.104 20 0 EIADMM COc1cc(Cl)cc([N-]S(=O)(=O)c2ccc(Cl)c(C)c2)c1 ZINC001185530283 1052258075 /nfs/dbraw/zinc/25/80/75/1052258075.db2.gz XEPIPXCPKKLVFS-UHFFFAOYSA-N -1 1 346.235 4.111 20 0 EIADMM O=C(Nc1cc(C(F)(F)F)ccc1F)Nc1c([O-])cccc1F ZINC001185618095 1052267427 /nfs/dbraw/zinc/26/74/27/1052267427.db2.gz ZKYNWMHJSRFINL-UHFFFAOYSA-N -1 1 332.228 4.333 20 0 EIADMM CC(C)C[C@@H]1CCCN(C(=O)c2ccc(C(F)(F)F)cc2[O-])C1 ZINC000622433649 1052269028 /nfs/dbraw/zinc/26/90/28/1052269028.db2.gz MTDHVJYGKMZTKZ-LBPRGKRZSA-N -1 1 329.362 4.309 20 0 EIADMM Cc1nc(C(C)C)[n-]c(=O)c1C(=O)N(C)c1ccc(C(C)C)cc1 ZINC000763747255 1052349912 /nfs/dbraw/zinc/34/99/12/1052349912.db2.gz ZMRPYRUTZIZDRW-UHFFFAOYSA-N -1 1 327.428 4.014 20 0 EIADMM O=C(c1ccc([O-])cc1)C1CCN(Cc2c(F)cccc2Cl)CC1 ZINC000623172498 1052600505 /nfs/dbraw/zinc/60/05/05/1052600505.db2.gz LAZPIJPCDJUDQW-UHFFFAOYSA-N -1 1 347.817 4.280 20 0 EIADMM CC(C)Cn1ccnc1CN[C@@H](C)c1ccc(Cl)c(Cl)c1[O-] ZINC000185546323 1052635588 /nfs/dbraw/zinc/63/55/88/1052635588.db2.gz PPSYWVKUFSVUMF-NSHDSACASA-N -1 1 342.270 4.402 20 0 EIADMM Cc1noc(C2CC2)c1[N-]C(=O)c1cc(-c2ccc(Cl)cc2)on1 ZINC000184070051 1052991301 /nfs/dbraw/zinc/99/13/01/1052991301.db2.gz GOUOCTYFENZGOV-UHFFFAOYSA-N -1 1 343.770 4.421 20 0 EIADMM Cc1cc(Cl)c(C(=O)Nc2cccc(C(F)(F)F)c2[O-])cn1 ZINC001194899149 1053154356 /nfs/dbraw/zinc/15/43/56/1053154356.db2.gz HFUIMGGUCLTHNB-UHFFFAOYSA-N -1 1 330.693 4.020 20 0 EIADMM CC(C)=CC[C@@H](NCc1ccc(-c2ccc(F)cc2C)o1)C(=O)[O-] ZINC000864528328 1053306840 /nfs/dbraw/zinc/30/68/40/1053306840.db2.gz NQFFROQNDVZQHS-QGZVFWFLSA-N -1 1 331.387 4.293 20 0 EIADMM Nc1ccccc1N(C(=O)c1cc([O-])cnc1Cl)c1ccccc1 ZINC001195308306 1053371118 /nfs/dbraw/zinc/37/11/18/1053371118.db2.gz BJJOWHLBQQBZOR-UHFFFAOYSA-N -1 1 339.782 4.001 20 0 EIADMM CC(C)Cc1ccc([C@H](C)NC(=O)c2cc([O-])cnc2Cl)cc1 ZINC001195313908 1053375151 /nfs/dbraw/zinc/37/51/51/1053375151.db2.gz AHWNDZAVNOEQEA-LBPRGKRZSA-N -1 1 332.831 4.130 20 0 EIADMM CCOC(=O)NC(=S)[N-]c1ccc(Cl)c(-c2ccccc2)c1 ZINC001195494605 1053424289 /nfs/dbraw/zinc/42/42/89/1053424289.db2.gz MUJIPWIGRNNYPK-UHFFFAOYSA-N -1 1 334.828 4.450 20 0 EIADMM CC1(C)COc2ccc(NCc3cccc([O-])c3Cl)cc2NC1=O ZINC000865861659 1053612432 /nfs/dbraw/zinc/61/24/32/1053612432.db2.gz RXWAHDYOHOUVMW-UHFFFAOYSA-N -1 1 346.814 4.015 20 0 EIADMM Cc1ccc([N-]S(=O)(=O)c2ccc3cc(Cl)ccc3c2)cc1O ZINC001196435737 1053658621 /nfs/dbraw/zinc/65/86/21/1053658621.db2.gz QVTUJVIJPINWFS-UHFFFAOYSA-N -1 1 347.823 4.308 20 0 EIADMM O=S(=O)([N-]c1ccc(F)cc1)c1ccc2cc(Cl)ccc2c1 ZINC001196412222 1053665776 /nfs/dbraw/zinc/66/57/76/1053665776.db2.gz LQKKNLPMMJLRBP-UHFFFAOYSA-N -1 1 335.787 4.433 20 0 EIADMM O=S(=O)([N-]c1cccc(F)c1)c1ccc2cc(Cl)ccc2c1 ZINC001196412121 1053665783 /nfs/dbraw/zinc/66/57/83/1053665783.db2.gz JORQLSSHQNRDDB-UHFFFAOYSA-N -1 1 335.787 4.433 20 0 EIADMM C[C@@]1(CC(=O)Nc2cc(F)c([O-])cc2Cl)CC1(Cl)Cl ZINC000885678939 1053811730 /nfs/dbraw/zinc/81/17/30/1053811730.db2.gz YKBNZYJLPNFEJY-LLVKDONJSA-N -1 1 326.582 4.097 20 0 EIADMM O=S(=O)(Cc1ccc(Cl)c(F)c1)[N-]c1ccc(Cl)s1 ZINC001197649516 1053958999 /nfs/dbraw/zinc/95/89/99/1053958999.db2.gz OVCKSDPLSSSUTD-UHFFFAOYSA-N -1 1 340.228 4.136 20 0 EIADMM Cc1csc([N-]S(=O)(=O)Cc2cccc(Cl)c2Cl)c1 ZINC001197726346 1053983366 /nfs/dbraw/zinc/98/33/66/1053983366.db2.gz PWZUJHABZJRVCY-UHFFFAOYSA-N -1 1 336.265 4.305 20 0 EIADMM CCc1ccc(S(=O)(=O)[N-]c2ccc(-c3cnc(C)o3)cc2)cc1 ZINC000029433254 1054007366 /nfs/dbraw/zinc/00/73/66/1054007366.db2.gz SXQOHRYTTOGOOK-UHFFFAOYSA-N -1 1 342.420 4.013 20 0 EIADMM CC(C)Oc1ccc([N-]S(=O)(=O)c2cccc(F)c2)cc1Cl ZINC000031721556 1054077760 /nfs/dbraw/zinc/07/77/60/1054077760.db2.gz SPEKOYWYPZJUKT-UHFFFAOYSA-N -1 1 343.807 4.067 20 0 EIADMM COCc1nc(C(=O)[N-]c2cccc(Cl)c2SC(F)F)co1 ZINC000775828137 1054099399 /nfs/dbraw/zinc/09/93/99/1054099399.db2.gz WZKBIBVYVHYDRB-UHFFFAOYSA-N -1 1 348.758 4.041 20 0 EIADMM COc1ccc(C(=O)Nc2cccc(C3SCCS3)c2)c([O-])c1 ZINC000018216187 1054104158 /nfs/dbraw/zinc/10/41/58/1054104158.db2.gz MDJKBOPTTALURB-UHFFFAOYSA-N -1 1 347.461 4.132 20 0 EIADMM CCO[C@H](C)c1ncc(C(=O)[N-]c2cc(F)c(F)c(F)c2F)s1 ZINC000871269392 1054179231 /nfs/dbraw/zinc/17/92/31/1054179231.db2.gz SCFYWRAYFNRRDH-ZCFIWIBFSA-N -1 1 348.321 4.049 20 0 EIADMM Cc1nc(SCc2noc3c2CC(C)(C)CC3)[n-]c(=O)c1C1CC1 ZINC000871679755 1054245750 /nfs/dbraw/zinc/24/57/50/1054245750.db2.gz QFQPAYQCDNUAIM-UHFFFAOYSA-N -1 1 345.468 4.163 20 0 EIADMM CC[C@H]([N-]C(=O)C(F)(F)c1ccccc1F)c1cc(F)ccc1F ZINC000857453391 1054250563 /nfs/dbraw/zinc/25/05/63/1054250563.db2.gz LFZHESZHRBHZOX-HNNXBMFYSA-N -1 1 343.295 4.463 20 0 EIADMM O=C(Nc1ccc([O-])c(Cl)c1)c1c(F)cccc1Br ZINC000123966016 1054420836 /nfs/dbraw/zinc/42/08/36/1054420836.db2.gz LRLCHEFIUQJOHA-UHFFFAOYSA-N -1 1 344.567 4.200 20 0 EIADMM CC1(C)CCCN(C(=O)c2cc(-c3ccc(C=O)o3)ccc2[O-])CC1 ZINC001137066771 1054479058 /nfs/dbraw/zinc/47/90/58/1054479058.db2.gz CZJNIYBKEUCEQO-UHFFFAOYSA-N -1 1 341.407 4.117 20 0 EIADMM O=C(NCc1cc(-c2ccccc2)no1)c1cc2ccccc2cc1[O-] ZINC000058476680 1054574534 /nfs/dbraw/zinc/57/45/34/1054574534.db2.gz UZCBZVAZDWSTOK-UHFFFAOYSA-N -1 1 344.370 4.130 20 0 EIADMM Cc1cc(C(=O)Nc2ccc([O-])c(Cl)c2)sc1Br ZINC000094535879 1054608248 /nfs/dbraw/zinc/60/82/48/1054608248.db2.gz OAOFLUCYJCGFOY-UHFFFAOYSA-N -1 1 346.633 4.430 20 0 EIADMM Cc1cc(NC(=S)Nc2cc([O-])c(Cl)cc2F)ccc1F ZINC001201036357 1054643635 /nfs/dbraw/zinc/64/36/35/1054643635.db2.gz RKAVEWBYGYKBOR-UHFFFAOYSA-N -1 1 328.771 4.441 20 0 EIADMM O=C(NCc1ccc([O-])c(Cl)c1)N1CCC[C@@H]1c1cccs1 ZINC000876392906 1054893562 /nfs/dbraw/zinc/89/35/62/1054893562.db2.gz DMDYXNBMZLELEZ-CYBMUJFWSA-N -1 1 336.844 4.154 20 0 EIADMM O=C(NCc1ccc([O-])c(Cl)c1)N1CCC[C@H]1c1ccsc1 ZINC000876393271 1054893709 /nfs/dbraw/zinc/89/37/09/1054893709.db2.gz KHUFGQFZWXOOHL-AWEZNQCLSA-N -1 1 336.844 4.154 20 0 EIADMM Cc1c(C)c(C)c(S(=O)(=O)[N-]c2cccnc2C2CC2)c(C)c1C ZINC001201792554 1054905568 /nfs/dbraw/zinc/90/55/68/1054905568.db2.gz KNWDYGOZIBQMPP-UHFFFAOYSA-N -1 1 344.480 4.302 20 0 EIADMM Cc1c(C)c(C)c(S(=O)(=O)[N-]c2cnc3occc3c2)c(C)c1C ZINC001201795582 1054906038 /nfs/dbraw/zinc/90/60/38/1054906038.db2.gz QHHNIHHWALHWJV-UHFFFAOYSA-N -1 1 344.436 4.171 20 0 EIADMM O=C(NC[C@H](c1ccccc1)C(F)(F)F)c1c([O-])cccc1Cl ZINC000777219960 1054992886 /nfs/dbraw/zinc/99/28/86/1054992886.db2.gz CFPYBMJLDWWUMH-LLVKDONJSA-N -1 1 343.732 4.122 20 0 EIADMM O=C(Nc1cccc(C(F)(F)F)c1[O-])Nc1c(F)cccc1F ZINC001202044636 1054995161 /nfs/dbraw/zinc/99/51/61/1054995161.db2.gz IUSXZBYIBFBQCM-UHFFFAOYSA-N -1 1 332.228 4.333 20 0 EIADMM Cc1ccc(-c2nsc([N-]C(=O)c3c(F)cccc3F)n2)s1 ZINC000066413126 1055001659 /nfs/dbraw/zinc/00/16/59/1055001659.db2.gz ZGBGZAKQVSRUEI-UHFFFAOYSA-N -1 1 337.376 4.106 20 0 EIADMM O=C(Nc1ccc(Br)cc1)Nc1cc(F)c(F)cc1[O-] ZINC001202332928 1055143098 /nfs/dbraw/zinc/14/30/98/1055143098.db2.gz JABUXVAIJSJVHH-UHFFFAOYSA-N -1 1 343.127 4.077 20 0 EIADMM C[C@]1(c2ccccc2)CCCN(C(=O)c2ccc([O-])c(F)c2)CC1 ZINC000672118995 1056587739 /nfs/dbraw/zinc/58/77/39/1056587739.db2.gz RPQVOIOVOJIGNV-FQEVSTJZSA-N -1 1 327.399 4.115 20 0 EIADMM Cc1ccc(F)cc1[N-]S(=O)(=O)c1ccc(Cl)c(Cl)c1 ZINC000007405618 1056792815 /nfs/dbraw/zinc/79/28/15/1056792815.db2.gz BNEUNULRZRISRR-UHFFFAOYSA-N -1 1 334.199 4.242 20 0 EIADMM CCOc1cc(C(=O)N2C[C@@H](C)c3ccccc32)cc(Cl)c1[O-] ZINC000186624254 1060109343 /nfs/dbraw/zinc/10/93/43/1060109343.db2.gz RYBFPLGZEUWQCQ-LLVKDONJSA-N -1 1 331.799 4.208 20 0 EIADMM Cc1ccc(-c2nsc([N-]C(=O)c3coc(C4CCC4)n3)n2)s1 ZINC000194267266 1060232861 /nfs/dbraw/zinc/23/28/61/1060232861.db2.gz PBJJKSUGBKENAH-UHFFFAOYSA-N -1 1 346.437 4.083 20 0 EIADMM CC1=C(C)C[C@@](C)(C(=O)Nc2ccc(-n3ccc(=O)[n-]3)cc2)CC1 ZINC001168921827 1060522423 /nfs/dbraw/zinc/52/24/23/1060522423.db2.gz FYXMGUFINKFGEY-IBGZPJMESA-N -1 1 325.412 4.043 20 0 EIADMM O=c1cc(C2CC2)nc(SCc2cc(Cl)nc(Cl)c2)[n-]1 ZINC000767081832 1061099833 /nfs/dbraw/zinc/09/98/33/1061099833.db2.gz UWIJFEMJISTZOA-UHFFFAOYSA-N -1 1 328.224 4.054 20 0 EIADMM O=C(c1c([O-])cccc1Cl)N1C[C@H](c2ccccc2)[C@H]2CCC[C@H]21 ZINC000804347604 1061132495 /nfs/dbraw/zinc/13/24/95/1061132495.db2.gz IBJLWCKHRYCJNJ-BFYDXBDKSA-N -1 1 341.838 4.454 20 0 EIADMM Cc1cc2cc([N-]S(=O)(=O)c3cccc4ccccc43)ccc2[nH]1 ZINC000103279449 219282088 /nfs/dbraw/zinc/28/20/88/219282088.db2.gz GEWPULQDJGVWNH-UHFFFAOYSA-N -1 1 336.416 4.430 20 0 EIADMM Cc1ccc(S(=O)(=O)[N-]c2ccc(OC(C)C)cc2)c(Cl)c1 ZINC000071977261 215986533 /nfs/dbraw/zinc/98/65/33/215986533.db2.gz JYFDWJFLRDVIDJ-UHFFFAOYSA-N -1 1 339.844 4.236 20 0 EIADMM