smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=C(NCc1cccc(Cl)c1[O-])[C@H](c1ccccc1)C1CC1 ZINC000890759674 1013333631 /nfs/dbraw/zinc/33/36/31/1013333631.db2.gz GXJGCHNFYMVZMZ-MRXNPFEDSA-N -1 1 315.800 3.856 20 10 DHCDMM CCC[C@H](C(=O)NCc1cccc(Cl)c1[O-])c1ccccn1 ZINC000890759397 1013334269 /nfs/dbraw/zinc/33/42/69/1013334269.db2.gz KUOIMRSGEKXRIY-ZDUSSCGKSA-N -1 1 318.804 3.641 20 10 DHCDMM Cc1c(C(=O)NCc2cccc(Cl)c2[O-])ccn1C(C)C ZINC000890761100 1013335599 /nfs/dbraw/zinc/33/55/99/1013335599.db2.gz KPGRQPMPAHOFOZ-UHFFFAOYSA-N -1 1 306.793 3.666 20 10 DHCDMM CC(=O)c1cc(Cl)cc(C[N@@H+]2CCS[C@H](C)CC2)c1[O-] ZINC000192178625 1014710501 /nfs/dbraw/zinc/71/05/01/1014710501.db2.gz QHZXYSHNCYXRAY-SNVBAGLBSA-N -1 1 313.850 3.576 20 10 DHCDMM CCCN(Cc1ccccc1O)[C@@H](C)c1ncc(C(=O)[O-])s1 ZINC001595891260 982925413 /nfs/dbraw/zinc/92/54/13/982925413.db2.gz QSUZGKHLSCRUSM-NSHDSACASA-N -1 1 320.414 3.520 20 10 DHCDMM CC[C@H](C)c1nnc([C@H](C)N[C@H](C)c2ccc(F)c(F)c2[O-])[nH]1 ZINC000276816325 1015679861 /nfs/dbraw/zinc/67/98/61/1015679861.db2.gz AGZILKAEYIZTBO-AEJSXWLSSA-N -1 1 324.375 3.714 20 10 DHCDMM C[C@H]1CC/C(=C\C(=O)NCc2cccc(Br)c2[O-])C1 ZINC000277655088 1016845872 /nfs/dbraw/zinc/84/58/72/1016845872.db2.gz ZJJGZJNFUCKNRS-NGPGYTDTSA-N -1 1 324.218 3.517 20 10 DHCDMM CC/C(C)=C(/C)C(=O)NCc1cccc(Br)c1[O-] ZINC000765750237 1019117252 /nfs/dbraw/zinc/11/72/52/1019117252.db2.gz CQJOCBCREDLDRA-KTKRTIGZSA-N -1 1 312.207 3.517 20 10 DHCDMM [O-]c1c(Br)cccc1CNc1ncc(Cl)s1 ZINC000309498710 1021559901 /nfs/dbraw/zinc/55/99/01/1021559901.db2.gz KXEZVIRZAUNIJO-UHFFFAOYSA-N -1 1 319.611 3.877 20 10 DHCDMM [O-]c1c(F)cc(Cl)cc1CN1CCC[C@@H]1c1cccnc1 ZINC000809728662 1026595513 /nfs/dbraw/zinc/59/55/13/1026595513.db2.gz DZKWEZIFNWMYFM-OAHLLOKOSA-N -1 1 306.768 3.917 20 10 DHCDMM CC(=O)N(C)c1cccc(NCc2cc(Cl)c(F)cc2[O-])c1 ZINC000816524830 1028933408 /nfs/dbraw/zinc/93/34/08/1028933408.db2.gz SJZGEYZJZOYZSW-UHFFFAOYSA-N -1 1 322.767 3.780 20 10 DHCDMM CC(=O)Nc1ccc(NCc2cc(Cl)c(F)cc2[O-])cc1 ZINC000816523830 1028933972 /nfs/dbraw/zinc/93/39/72/1028933972.db2.gz GRIXFPQLWYXELO-UHFFFAOYSA-N -1 1 308.740 3.755 20 10 DHCDMM COCCc1ccccc1NCc1cc(Cl)c(F)cc1[O-] ZINC000816588660 1028938708 /nfs/dbraw/zinc/93/87/08/1028938708.db2.gz UTKXOIVLVFGMGD-UHFFFAOYSA-N -1 1 309.768 3.986 20 10 DHCDMM CC(C)c1ccc(CN(C)C(=O)c2c([O-])c(O)ccc2F)cc1 ZINC000823666126 1030359505 /nfs/dbraw/zinc/35/95/05/1030359505.db2.gz GKOJYCBNAFGACJ-UHFFFAOYSA-N -1 1 317.360 3.633 20 10 DHCDMM CCCC(C)(C)C(=O)NCc1cccc(Br)c1[O-] ZINC000846013578 1031808464 /nfs/dbraw/zinc/80/84/64/1031808464.db2.gz CQSIFFCGAQJSHO-UHFFFAOYSA-N -1 1 314.223 3.597 20 10 DHCDMM CCOc1ccc(C)cc1NC(=O)c1ccc(O)c([O-])c1Cl ZINC001193233383 1035589332 /nfs/dbraw/zinc/58/93/32/1035589332.db2.gz XZIWXIQRAUWJIE-UHFFFAOYSA-N -1 1 321.760 3.711 20 10 DHCDMM O=C(Nc1ccccc1C(F)F)c1ccc(O)c([O-])c1Cl ZINC001193232137 1035590788 /nfs/dbraw/zinc/59/07/88/1035590788.db2.gz FIOBSDGTCYJOAV-UHFFFAOYSA-N -1 1 313.687 3.941 20 10 DHCDMM C[C@H]1C[C@@H](NC(=O)c2ccc(O)c([O-])c2Cl)CC(C)(C)C1 ZINC001193236494 1035592594 /nfs/dbraw/zinc/59/25/94/1035592594.db2.gz FLMBFDPZMBOSTB-VHSXEESVSA-N -1 1 311.809 3.696 20 10 DHCDMM Cc1cc(C)cc([C@@H](C)NC(=O)c2ccc(O)c([O-])c2Cl)c1 ZINC001193246819 1035593799 /nfs/dbraw/zinc/59/37/99/1035593799.db2.gz CNPMKRNTXIQYQG-LLVKDONJSA-N -1 1 319.788 3.859 20 10 DHCDMM CC(C)(NC(=O)c1ccc(O)c([O-])c1Cl)c1cccc(F)c1 ZINC001193236568 1035594073 /nfs/dbraw/zinc/59/40/73/1035594073.db2.gz IAVRTOMUMGMLSP-UHFFFAOYSA-N -1 1 323.751 3.555 20 10 DHCDMM Cc1ccc(C(=O)NCc2cccc(Cl)c2[O-])c(Cl)c1 ZINC001180410459 1035674260 /nfs/dbraw/zinc/67/42/60/1035674260.db2.gz QGRUMZFHWVXDGF-UHFFFAOYSA-N -1 1 310.180 3.937 20 10 DHCDMM O=C(NCc1cccc(Cl)c1[O-])C1CCC(C2CC2)CC1 ZINC001180410450 1035674674 /nfs/dbraw/zinc/67/46/74/1035674674.db2.gz QECRWUQDUFAQGB-UHFFFAOYSA-N -1 1 307.821 3.878 20 10 DHCDMM Cc1cccc(Cl)c1C(=O)NCc1cccc(Cl)c1[O-] ZINC001180410929 1035676740 /nfs/dbraw/zinc/67/67/40/1035676740.db2.gz VNZHVNUGXADVJU-UHFFFAOYSA-N -1 1 310.180 3.937 20 10 DHCDMM Cn1cc(NCc2cc(F)cc(F)c2[O-])c(-c2ccccc2)n1 ZINC001201962418 1037954806 /nfs/dbraw/zinc/95/48/06/1037954806.db2.gz BGNRAHQULKAIOW-UHFFFAOYSA-N -1 1 315.323 3.683 20 10 DHCDMM C[C@H](N[C@@H](C)c1c(F)cncc1F)c1ccc(F)c(F)c1[O-] ZINC000285755859 131199919 /nfs/dbraw/zinc/19/99/19/131199919.db2.gz SHMJPURPUWBYSZ-YUMQZZPRSA-N -1 1 314.282 3.755 20 10 DHCDMM COc1cc(C)c(NCc2cccc(Cl)c2[O-])cc1OC ZINC000158037047 522218879 /nfs/dbraw/zinc/21/88/79/522218879.db2.gz OXTTWZPQPSKIQB-UHFFFAOYSA-N -1 1 307.777 3.983 20 10 DHCDMM CC(C)c1ncsc1C(=O)NCc1cccc(Cl)c1[O-] ZINC000890761168 1013336837 /nfs/dbraw/zinc/33/68/37/1013336837.db2.gz MSXVHLZSAZLQPT-UHFFFAOYSA-N -1 1 310.806 3.556 20 10 DHCDMM CN(C)c1ccc(CNC(=O)c2ccc3ccccc3c2[O-])cc1 ZINC000018215302 1013418302 /nfs/dbraw/zinc/41/83/02/1013418302.db2.gz ADBRRRDAKOXSHF-UHFFFAOYSA-N -1 1 320.392 3.541 20 10 DHCDMM C[C@H](C[N@H+](CC(=O)[O-])Cc1cc(Cl)ccc1[O-])C(C)(C)C ZINC001592593253 978525113 /nfs/dbraw/zinc/52/51/13/978525113.db2.gz YSBXGUNDLDKONC-LLVKDONJSA-N -1 1 313.825 3.614 20 10 DHCDMM C[C@H](C[N@@H+](CC(=O)[O-])Cc1cc(Cl)ccc1[O-])C(C)(C)C ZINC001592593253 978525116 /nfs/dbraw/zinc/52/51/16/978525116.db2.gz YSBXGUNDLDKONC-LLVKDONJSA-N -1 1 313.825 3.614 20 10 DHCDMM CC[C@H](C)c1nnc([C@@H](C)N[C@@H](C)c2ccc(F)c(F)c2[O-])[nH]1 ZINC000276816334 1015679016 /nfs/dbraw/zinc/67/90/16/1015679016.db2.gz AGZILKAEYIZTBO-LPEHRKFASA-N -1 1 324.375 3.714 20 10 DHCDMM O=C(Nc1cccc(N2CCCCC2)c1)c1ccc([O-])c(F)c1 ZINC000767330930 1022686766 /nfs/dbraw/zinc/68/67/66/1022686766.db2.gz VGPIFQLJBGDULE-UHFFFAOYSA-N -1 1 314.360 3.774 20 10 DHCDMM [O-]c1c(F)cc(F)cc1CNc1ccc([C@H]2CCOC2)cc1 ZINC000883131646 1024253257 /nfs/dbraw/zinc/25/32/57/1024253257.db2.gz LTGPDEOQYDVKTR-LBPRGKRZSA-N -1 1 305.324 3.786 20 10 DHCDMM CC(C)(C)c1csc(CNCc2ccc(F)c(F)c2[O-])n1 ZINC000877015929 1033208088 /nfs/dbraw/zinc/20/80/88/1033208088.db2.gz GCMZVBIQWDLDJF-UHFFFAOYSA-N -1 1 312.385 3.714 20 10 DHCDMM CC[C@H](NC1(c2ncccn2)CCC1)c1cccc(Cl)c1[O-] ZINC000883312260 1024366108 /nfs/dbraw/zinc/36/61/08/1024366108.db2.gz YJJBJMWQOGSSCZ-AWEZNQCLSA-N -1 1 317.820 3.956 20 10 DHCDMM Cc1ccc(Cl)c(C)c1NCC(=O)c1ccc([O-])c(O)c1 ZINC001170322672 1024740977 /nfs/dbraw/zinc/74/09/77/1024740977.db2.gz LGAKUOULPNDHIM-UHFFFAOYSA-N -1 1 305.761 3.663 20 10 DHCDMM C[C@@H](NCc1cc(COC(C)(C)C)on1)c1c([O-])cccc1F ZINC000886595020 1025729476 /nfs/dbraw/zinc/72/94/76/1025729476.db2.gz ZKBXLAINRWKKJD-LLVKDONJSA-N -1 1 322.380 3.685 20 10 DHCDMM CCn1ccnc1CN[C@H](C)c1ccc(Cl)c(Cl)c1[O-] ZINC000295836739 1027452333 /nfs/dbraw/zinc/45/23/33/1027452333.db2.gz AFXZGSLJWJIBEK-SECBINFHSA-N -1 1 314.216 3.766 20 10 DHCDMM C[S@](=O)c1cccc(NCc2cc(Cl)c(F)cc2[O-])c1 ZINC000816526117 1028932119 /nfs/dbraw/zinc/93/21/19/1028932119.db2.gz UOJFBZNHTLYDAQ-FQEVSTJZSA-N -1 1 313.781 3.534 20 10 DHCDMM C[C@@H](C1CC1)n1cc(NCc2cc(Cl)c(F)cc2[O-])cn1 ZINC000816574821 1028952132 /nfs/dbraw/zinc/95/21/32/1028952132.db2.gz SUTIVELAXHMEAM-VIFPVBQESA-N -1 1 309.772 3.964 20 10 DHCDMM O=C1CCN1c1ccc(NCc2cc(Cl)c(F)cc2[O-])cc1 ZINC000816598659 1028954706 /nfs/dbraw/zinc/95/47/06/1028954706.db2.gz KTSUVKCRZFUOBO-UHFFFAOYSA-N -1 1 320.751 3.534 20 10 DHCDMM C[C@@H]1C[C@@H](NCc2cc(Cl)cc(Cl)c2[O-])c2nccn21 ZINC000825017597 1030700133 /nfs/dbraw/zinc/70/01/33/1030700133.db2.gz VOJUMCFFRCGHOJ-PRHODGIISA-N -1 1 312.200 3.691 20 10 DHCDMM C[S@](=O)c1cccc(NCc2c([O-])ccc(Cl)c2F)c1 ZINC000790980893 1031199809 /nfs/dbraw/zinc/19/98/09/1031199809.db2.gz GHIZADLUWOVICW-FQEVSTJZSA-N -1 1 313.781 3.534 20 10 DHCDMM O=C1CN(Cc2cc(F)c(F)cc2[O-])Cc2ccc(Cl)cc21 ZINC001142534814 1031961176 /nfs/dbraw/zinc/96/11/76/1031961176.db2.gz XSFUCHGZKDRCEV-UHFFFAOYSA-N -1 1 323.726 3.522 20 10 DHCDMM COCCOCc1ccc(NCc2cccc(Cl)c2[O-])cc1 ZINC000862531962 1033875893 /nfs/dbraw/zinc/87/58/93/1033875893.db2.gz MQKIMPNLVWQIDP-UHFFFAOYSA-N -1 1 321.804 3.821 20 10 DHCDMM CN=[S@@](C)(=O)c1cccc(NCc2cccc(Cl)c2[O-])c1 ZINC000864013720 1034251086 /nfs/dbraw/zinc/25/10/86/1034251086.db2.gz CLHNVHRTSWKJOA-NRFANRHFSA-N -1 1 324.833 3.744 20 10 DHCDMM CC(C)C(=O)Nc1cccc(NCc2cc(F)cc(F)c2[O-])c1 ZINC001177395440 1035368187 /nfs/dbraw/zinc/36/81/87/1035368187.db2.gz FDAWNOCXCWAPGC-UHFFFAOYSA-N -1 1 320.339 3.877 20 10 DHCDMM [O-]c1c(F)cc(F)cc1CNc1cnn(-c2ccccc2F)c1 ZINC001178199602 1035414437 /nfs/dbraw/zinc/41/44/37/1035414437.db2.gz NHJYKWQKUUPOGL-UHFFFAOYSA-N -1 1 319.286 3.607 20 10 DHCDMM CC(C)(C)Cc1cc(NC(=O)c2ccc(O)c([O-])c2Cl)on1 ZINC001193209909 1035586321 /nfs/dbraw/zinc/58/63/21/1035586321.db2.gz QEBCMHJAYQPBGO-UHFFFAOYSA-N -1 1 324.764 3.580 20 10 DHCDMM C[C@H]1C[C@H](NC(=O)c2ccc(O)c([O-])c2Cl)c2ccccc21 ZINC001193236577 1035592677 /nfs/dbraw/zinc/59/26/77/1035592677.db2.gz IEURXZPZWVTLKW-ZANVPECISA-N -1 1 317.772 3.730 20 10 DHCDMM C[C@@H]1C[C@H](NC(=O)c2ccc(O)c([O-])c2Cl)CC(C)(C)C1 ZINC001193236495 1035593783 /nfs/dbraw/zinc/59/37/83/1035593783.db2.gz FLMBFDPZMBOSTB-ZJUUUORDSA-N -1 1 311.809 3.696 20 10 DHCDMM C[C@H]1[C@H](C(F)(F)F)CCC[N@H+]1Cc1cc(F)cc(F)c1O ZINC001180970701 1035800477 /nfs/dbraw/zinc/80/04/77/1035800477.db2.gz WBKRXVGVKNVVRO-GZMMTYOYSA-N -1 1 309.278 3.833 20 10 DHCDMM Cc1ccccc1COC(=O)NCc1cccc(Cl)c1[O-] ZINC001195882472 1036375585 /nfs/dbraw/zinc/37/55/85/1036375585.db2.gz PJDXIFRXJQXYOW-UHFFFAOYSA-N -1 1 305.761 3.780 20 10 DHCDMM CC1(C)CCN(C(=O)c2c([O-])c(O)ccc2F)CC(C)(C)C1 ZINC001183964684 1036718404 /nfs/dbraw/zinc/71/84/04/1036718404.db2.gz QGKLWKAMGFBPQU-UHFFFAOYSA-N -1 1 309.381 3.525 20 10 DHCDMM C[S@](=O)Cc1ccccc1NCc1cccc(Cl)c1[O-] ZINC000762790233 1036947252 /nfs/dbraw/zinc/94/72/52/1036947252.db2.gz BEUXTGBYBUYIMK-FQEVSTJZSA-N -1 1 309.818 3.536 20 10 DHCDMM O=C(NCCCc1ccsc1)NCc1cccc(Cl)c1[O-] ZINC001123656072 1038178138 /nfs/dbraw/zinc/17/81/38/1038178138.db2.gz LXQAUHVHJRIYNF-UHFFFAOYSA-N -1 1 324.833 3.539 20 10 DHCDMM CC[C@@H](NCc1ccon1)c1ccc(Cl)c(Cl)c1[O-] ZINC000775513298 1038606326 /nfs/dbraw/zinc/60/63/26/1038606326.db2.gz WCAWICUVBWQYKV-LLVKDONJSA-N -1 1 301.173 3.928 20 10 DHCDMM [O-]c1cc(O)c(CN2CCCC[C@@H]2C(F)(F)F)cc1Cl ZINC001232267707 1039013298 /nfs/dbraw/zinc/01/32/98/1039013298.db2.gz KMIPWTNSPLFZNM-GFCCVEGCSA-N -1 1 309.715 3.668 20 10 DHCDMM COc1ccc(N(C)Cc2cccc(Cl)c2[O-])cc1OC ZINC000761221269 1040771949 /nfs/dbraw/zinc/77/19/49/1040771949.db2.gz GVFZRSSCKCITAK-UHFFFAOYSA-N -1 1 307.777 3.699 20 10 DHCDMM [O-]c1cccc(Cl)c1C[NH+]1CCC(O)(c2ccccc2)CC1 ZINC000274333874 130226988 /nfs/dbraw/zinc/22/69/88/130226988.db2.gz DQILXXNSGNNQMI-UHFFFAOYSA-N -1 1 317.816 3.529 20 10 DHCDMM C[C@@H](N[C@@H](C)c1c(F)cncc1F)c1ccc(F)c(F)c1[O-] ZINC000285755850 131199104 /nfs/dbraw/zinc/19/91/04/131199104.db2.gz SHMJPURPUWBYSZ-SFYZADRCSA-N -1 1 314.282 3.755 20 10 DHCDMM C[C@H](CN(C)C(=O)c1c(F)ccc(O)c1[O-])C1CCCCC1 ZINC000530275711 340784685 /nfs/dbraw/zinc/78/46/85/340784685.db2.gz HQDVKKHEOUTQPW-LLVKDONJSA-N -1 1 309.381 3.525 20 10 DHCDMM C[C@H](N[C@H]1COc2cccc(F)c21)c1ccc(F)c(F)c1[O-] ZINC000364789724 525633535 /nfs/dbraw/zinc/63/35/35/525633535.db2.gz NASOAEOWWOGJJL-UFBFGSQYSA-N -1 1 309.287 3.594 20 10 DHCDMM O=C([O-])CC[C@H]1CCC[N@H+](Cc2ccc3ccccc3c2[O-])C1 ZINC001595018728 951306045 /nfs/dbraw/zinc/30/60/45/951306045.db2.gz BPMZONQXQDEETD-CQSZACIVSA-N -1 1 313.397 3.622 20 10 DHCDMM O=C([O-])CC[C@H]1CCC[N@@H+](Cc2ccc3ccccc3c2[O-])C1 ZINC001595018728 951306049 /nfs/dbraw/zinc/30/60/49/951306049.db2.gz BPMZONQXQDEETD-CQSZACIVSA-N -1 1 313.397 3.622 20 10 DHCDMM C[C@H]([NH2+]Cc1ccc(C(=O)[O-])cc1)c1cc(Cl)ccc1[O-] ZINC001589128799 956182938 /nfs/dbraw/zinc/18/29/38/956182938.db2.gz NWHLXZQKGMMVKF-JTQLQIEISA-N -1 1 305.761 3.595 20 10 DHCDMM Cc1ccsc1[C@@H]1C[C@@H]1C(=O)NCc1cccc(Cl)c1[O-] ZINC000890760130 1013333476 /nfs/dbraw/zinc/33/34/76/1013333476.db2.gz JCVCMLFGLLIKMK-NEPJUHHUSA-N -1 1 321.829 3.835 20 10 DHCDMM CCCCSCCC(=O)NCc1cccc(Cl)c1[O-] ZINC000890759594 1013333749 /nfs/dbraw/zinc/33/37/49/1013333749.db2.gz DIVIEZPGJKYBTR-UHFFFAOYSA-N -1 1 301.839 3.585 20 10 DHCDMM Cc1ccc(C(=O)NCc2cccc(Cl)c2[O-])c(C(C)C)n1 ZINC000890761416 1013339738 /nfs/dbraw/zinc/33/97/38/1013339738.db2.gz RBZJFJXMYCEZQR-UHFFFAOYSA-N -1 1 318.804 3.802 20 10 DHCDMM CSCCCCCCC(=O)NCc1cccc(Cl)c1[O-] ZINC000890762828 1013344448 /nfs/dbraw/zinc/34/44/48/1013344448.db2.gz KCNNRFIPJWSTHW-UHFFFAOYSA-N -1 1 315.866 3.975 20 10 DHCDMM [O-]c1cccc(F)c1CN(Cc1cccnc1)Cc1ccccn1 ZINC001137837871 1018663159 /nfs/dbraw/zinc/66/31/59/1018663159.db2.gz XTRLMMPZRKXSMN-UHFFFAOYSA-N -1 1 323.371 3.524 20 10 DHCDMM Cc1cc(Cl)cc(C[NH2+]C[C@H](CC(=O)[O-])CC(C)C)c1[O-] ZINC000854244296 1022438025 /nfs/dbraw/zinc/43/80/25/1022438025.db2.gz YVYOLVBQYBSJRK-LBPRGKRZSA-N -1 1 313.825 3.581 20 10 DHCDMM O=C1[N-]C(=S)S/C1=C/c1ccc(-c2c(F)cccc2F)o1 ZINC000115184176 1023006247 /nfs/dbraw/zinc/00/62/47/1023006247.db2.gz UAXBKCRZAVQNOE-IZZDOVSWSA-N -1 1 323.345 3.714 20 10 DHCDMM CN1C(=O)c2ccc(Cl)cc2N[C@H]1c1cccc(Cl)c1[O-] ZINC000124749488 1023352487 /nfs/dbraw/zinc/35/24/87/1023352487.db2.gz LTMQAQJKDOHIPQ-CQSZACIVSA-N -1 1 323.179 3.895 20 10 DHCDMM CCOc1ccc(NCc2cc(F)cc(F)c2[O-])cc1OC ZINC000883027185 1024214403 /nfs/dbraw/zinc/21/44/03/1024214403.db2.gz RPMZOMWCAPWBGJ-UHFFFAOYSA-N -1 1 309.312 3.690 20 10 DHCDMM Cc1ccc2c(C)cc(NCC(=O)c3ccc([O-])c(O)c3)nc2c1 ZINC001170315668 1024742323 /nfs/dbraw/zinc/74/23/23/1024742323.db2.gz FVSHCURDDSWXOV-UHFFFAOYSA-N -1 1 322.364 3.558 20 10 DHCDMM Cc1cc(Br)c([O-])c(CNC(C)(C)C(F)F)c1 ZINC000793255190 1024966531 /nfs/dbraw/zinc/96/65/31/1024966531.db2.gz RNGXAYYLORAXLB-UHFFFAOYSA-N -1 1 308.166 3.596 20 10 DHCDMM C[C@@H](C1CC1)n1cc(NCc2cc(Cl)cc(F)c2[O-])cn1 ZINC000779190085 1028668228 /nfs/dbraw/zinc/66/82/28/1028668228.db2.gz BWKHMDDQKHCPHC-VIFPVBQESA-N -1 1 309.772 3.964 20 10 DHCDMM CCc1nnc(CN[C@H](CC)c2cccc(Cl)c2[O-])s1 ZINC000290129890 1029905834 /nfs/dbraw/zinc/90/58/34/1029905834.db2.gz JYNQZRLQWDVPEB-LLVKDONJSA-N -1 1 311.838 3.700 20 10 DHCDMM O=C(Nc1csc2cnccc12)c1ccc(O)c([O-])c1Cl ZINC001193219532 1035590171 /nfs/dbraw/zinc/59/01/71/1035590171.db2.gz JYVLXDDJFPVTJZ-UHFFFAOYSA-N -1 1 320.757 3.613 20 10 DHCDMM Cc1cc(C)cc(CC(=O)NCc2cccc(Cl)c2[O-])c1 ZINC001180421080 1035680001 /nfs/dbraw/zinc/68/00/01/1035680001.db2.gz VKBAQIGGCYBYNE-UHFFFAOYSA-N -1 1 303.789 3.521 20 10 DHCDMM COC(=O)CCc1ccc(NCc2cccc(Cl)c2[O-])cc1 ZINC001180778029 1035765033 /nfs/dbraw/zinc/76/50/33/1035765033.db2.gz AUPPIUITGKQEJW-UHFFFAOYSA-N -1 1 319.788 3.763 20 10 DHCDMM Cc1ccn2cc(C[N@@H+](C)Cc3cc(Cl)ccc3O)nc2c1 ZINC001203665841 1037686147 /nfs/dbraw/zinc/68/61/47/1037686147.db2.gz XUJCCABGCBJXQH-UHFFFAOYSA-N -1 1 315.804 3.634 20 10 DHCDMM Cc1cc(F)cc(NC(=O)NCc2cccc(Cl)c2[O-])c1 ZINC001201828032 1037910210 /nfs/dbraw/zinc/91/02/10/1037910210.db2.gz CYYKBWMEMFJWKS-UHFFFAOYSA-N -1 1 308.740 3.815 20 10 DHCDMM COc1ccc(F)cc1NC(=O)NCc1cccc(Cl)c1[O-] ZINC001202133085 1038052576 /nfs/dbraw/zinc/05/25/76/1038052576.db2.gz WLPUWWNYRAOITE-UHFFFAOYSA-N -1 1 324.739 3.515 20 10 DHCDMM O=C1[N-]C(=S)S/C1=C\c1ccc(-c2c(F)cccc2F)o1 ZINC000172127707 1039748326 /nfs/dbraw/zinc/74/83/26/1039748326.db2.gz UAXBKCRZAVQNOE-WDZFZDKYSA-N -1 1 323.345 3.714 20 10 DHCDMM O=C(NCc1cccc(Cl)c1[O-])[C@H]1CC[C@H](C(F)(F)F)C1 ZINC000890759935 1013334916 /nfs/dbraw/zinc/33/49/16/1013334916.db2.gz WGCGUDVGDOTBEM-WPRPVWTQSA-N -1 1 321.726 3.640 20 10 DHCDMM [O-]c1c(Cl)cc(Cl)cc1CNCc1nccn1C1CC1 ZINC000894514485 1013398728 /nfs/dbraw/zinc/39/87/28/1013398728.db2.gz JJHFERUWCWUKJH-UHFFFAOYSA-N -1 1 312.200 3.520 20 10 DHCDMM CC[C@H](C)c1nnc([C@H](C)N[C@@H](C)c2ccc(F)c(F)c2[O-])[nH]1 ZINC000276816329 1015679391 /nfs/dbraw/zinc/67/93/91/1015679391.db2.gz AGZILKAEYIZTBO-GUBZILKMSA-N -1 1 324.375 3.714 20 10 DHCDMM CCC[C@@H](C)CC(=O)NCc1cccc(Br)c1[O-] ZINC000765737735 1019102640 /nfs/dbraw/zinc/10/26/40/1019102640.db2.gz YABOWKQCOQFSAZ-SNVBAGLBSA-N -1 1 314.223 3.597 20 10 DHCDMM Cc1ccc(C(=O)N(C)C)cc1NCc1cccc(Cl)c1[O-] ZINC000378911630 1020523083 /nfs/dbraw/zinc/52/30/83/1020523083.db2.gz JGMPAARJLBNALQ-UHFFFAOYSA-N -1 1 318.804 3.668 20 10 DHCDMM CC(=O)c1cc(Cl)cc(CN(C)Cc2scnc2C)c1[O-] ZINC000111671735 1021658897 /nfs/dbraw/zinc/65/88/97/1021658897.db2.gz ZOKSGBAWHCLCPA-UHFFFAOYSA-N -1 1 324.833 3.645 20 10 DHCDMM [O-]c1c(F)cc(F)cc1CNc1ccccc1N1CCCC1 ZINC000882906253 1024163856 /nfs/dbraw/zinc/16/38/56/1024163856.db2.gz UZAJAEXHTUJQKT-UHFFFAOYSA-N -1 1 304.340 3.883 20 10 DHCDMM CCCCc1nnc(NCc2c([O-])ccc(Cl)c2F)s1 ZINC000790243840 1024248415 /nfs/dbraw/zinc/24/84/15/1024248415.db2.gz VKJJJHWWNIIZRK-UHFFFAOYSA-N -1 1 315.801 3.991 20 10 DHCDMM CO[C@@H]1Cc2ccc(NCc3c([O-])ccc(Cl)c3F)cc2C1 ZINC000790986290 1024411007 /nfs/dbraw/zinc/41/10/07/1024411007.db2.gz MPVZRDRZJSZOIT-CYBMUJFWSA-N -1 1 321.779 3.910 20 10 DHCDMM CCc1cc(C)cc(CC)c1NCC(=O)c1ccc([O-])c(O)c1 ZINC001170315156 1024742381 /nfs/dbraw/zinc/74/23/81/1024742381.db2.gz QUYLOZCPFGBVSB-UHFFFAOYSA-N -1 1 313.397 3.826 20 10 DHCDMM CC[C@@H](CC(F)(F)F)NC(=O)NCc1cccc(Cl)c1[O-] ZINC000894212335 1026442205 /nfs/dbraw/zinc/44/22/05/1026442205.db2.gz JJGUIKWGELUEFJ-VIFPVBQESA-N -1 1 324.730 3.576 20 10 DHCDMM O=c1[nH]c2cccc(NCc3c([O-])ccc(Cl)c3F)c2o1 ZINC000810161703 1026698081 /nfs/dbraw/zinc/69/80/81/1026698081.db2.gz OUEXRUCWETTXLK-UHFFFAOYSA-N -1 1 308.696 3.644 20 10 DHCDMM O=C1CCN(Cc2cccc(Cl)c2[O-])c2ccc(F)cc2N1 ZINC000811508585 1027026259 /nfs/dbraw/zinc/02/62/59/1027026259.db2.gz YFMGARRQHPIZPA-UHFFFAOYSA-N -1 1 320.751 3.534 20 10 DHCDMM C[C@@H](N[C@@H](CF)c1ccc(F)cc1)c1cc([N+](=O)[O-])ccc1[O-] ZINC000866596399 1030390424 /nfs/dbraw/zinc/39/04/24/1030390424.db2.gz KETBEBCELQCYBU-BMIGLBTASA-N -1 1 322.311 3.801 20 10 DHCDMM Cc1cc(F)c(CN[C@H](C)c2cc([N+](=O)[O-])ccc2[O-])c(F)c1 ZINC000927094249 1031086097 /nfs/dbraw/zinc/08/60/97/1031086097.db2.gz RBGWDKCPXBDZDV-SNVBAGLBSA-N -1 1 322.311 3.738 20 10 DHCDMM CC[C@H](NCc1nonc1C)c1cc(Cl)cc(Cl)c1[O-] ZINC000872136775 1031530385 /nfs/dbraw/zinc/53/03/85/1031530385.db2.gz ORTMKXSSCMGRBD-NSHDSACASA-N -1 1 316.188 3.631 20 10 DHCDMM [O-]c1cc(F)c(F)cc1CN1CCc2cc(F)c(F)cc2C1 ZINC001142534625 1031960040 /nfs/dbraw/zinc/96/00/40/1031960040.db2.gz QDSFMWGYXRSCJU-UHFFFAOYSA-N -1 1 311.278 3.507 20 10 DHCDMM CSCc1cnc(CNCc2cccc(Cl)c2[O-])s1 ZINC000898219322 1031980393 /nfs/dbraw/zinc/98/03/93/1031980393.db2.gz WXKRJPGQJQVTQU-UHFFFAOYSA-N -1 1 314.863 3.655 20 10 DHCDMM [O-]c1c(Cl)cccc1CN1CCOc2cc(F)c(F)cc21 ZINC001182665598 1036413488 /nfs/dbraw/zinc/41/34/88/1036413488.db2.gz HOGSHDOHVFUZFO-UHFFFAOYSA-N -1 1 311.715 3.723 20 10 DHCDMM COc1cc(F)ccc1NC(=O)NCc1cccc(Cl)c1[O-] ZINC001197312729 1036734256 /nfs/dbraw/zinc/73/42/56/1036734256.db2.gz MUZOVBOBOMIREU-UHFFFAOYSA-N -1 1 324.739 3.515 20 10 DHCDMM Cc1cc(S(=O)(=O)[N-]c2cccc(N(C)C)c2)ccc1Cl ZINC001185529693 1037171084 /nfs/dbraw/zinc/17/10/84/1037171084.db2.gz KSBAJXGWPWNERC-UHFFFAOYSA-N -1 1 324.833 3.515 20 10 DHCDMM Oc1ccc(Cl)c(F)c1C[N@@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000775136872 1037684691 /nfs/dbraw/zinc/68/46/91/1037684691.db2.gz NIOQKZYQRXJJGL-QMMMGPOBSA-N -1 1 311.706 3.959 20 10 DHCDMM [O-]c1c(CNc2ccc(=S)[nH]c2)cc(Cl)c2cccnc12 ZINC001168522912 1038207199 /nfs/dbraw/zinc/20/71/99/1038207199.db2.gz KNGIAPVLMKXTQG-UHFFFAOYSA-N -1 1 317.801 3.890 20 10 DHCDMM COc1c([O-])c(C[N@H+](C)[C@H](C)c2cccs2)ccc1[N+](=O)[O-] ZINC000278274749 334094440 /nfs/dbraw/zinc/09/44/40/334094440.db2.gz RZLVBWBASIGKOL-SNVBAGLBSA-N -1 1 322.386 3.564 20 10 DHCDMM [O-]c1c(Cl)cccc1CN[C@H]1COc2cccc(Cl)c21 ZINC000377885001 337063391 /nfs/dbraw/zinc/06/33/91/337063391.db2.gz QQLMVLSWGGFJTO-LBPRGKRZSA-N -1 1 310.180 3.922 20 10 DHCDMM Cc1ccsc1[C@H]1C[C@H]1C(=O)NCc1cccc(Cl)c1[O-] ZINC000890760131 1013334934 /nfs/dbraw/zinc/33/49/34/1013334934.db2.gz JCVCMLFGLLIKMK-NWDGAFQWSA-N -1 1 321.829 3.835 20 10 DHCDMM Cc1cc2c(cn1)CN(Cc1cc(Cl)c(Cl)cc1[O-])C2 ZINC001236798094 1021278759 /nfs/dbraw/zinc/27/87/59/1021278759.db2.gz GKLFMICWSVNAAX-UHFFFAOYSA-N -1 1 309.196 3.918 20 10 DHCDMM C[C@@H](N[C@H](C)c1ccc(Cl)c(Cl)c1[O-])c1nccn1C ZINC000850572953 1021616673 /nfs/dbraw/zinc/61/66/73/1021616673.db2.gz RDJZNRQNKUCFBC-RKDXNWHRSA-N -1 1 314.216 3.844 20 10 DHCDMM O=C(CNc1cc(F)c2ccccc2c1)c1ccc([O-])c(O)c1 ZINC001170322250 1024741819 /nfs/dbraw/zinc/74/18/19/1024741819.db2.gz ICHRAKNSPQAHOY-UHFFFAOYSA-N -1 1 311.312 3.685 20 10 DHCDMM O=C(NCCCc1cccs1)NCc1cccc(Cl)c1[O-] ZINC000893962159 1025615644 /nfs/dbraw/zinc/61/56/44/1025615644.db2.gz UIGHUYQIIHWJIC-UHFFFAOYSA-N -1 1 324.833 3.539 20 10 DHCDMM C[C@@H](N[C@H]1COc2cc(F)cc(F)c21)c1c([O-])cccc1F ZINC000886587804 1025724179 /nfs/dbraw/zinc/72/41/79/1025724179.db2.gz GCGMQWMERPTCCQ-PELKAZGASA-N -1 1 309.287 3.594 20 10 DHCDMM [O-]c1c(F)cc(Cl)cc1CN1CCC[C@H]1c1ccncc1 ZINC000809728652 1026595444 /nfs/dbraw/zinc/59/54/44/1026595444.db2.gz DQAQSCJYDKROEB-HNNXBMFYSA-N -1 1 306.768 3.917 20 10 DHCDMM CC(C)(O)COc1ccc(NCc2cccc(Cl)c2[O-])cc1 ZINC000271805273 1027148894 /nfs/dbraw/zinc/14/88/94/1027148894.db2.gz IOGRKGOZQWURHV-UHFFFAOYSA-N -1 1 321.804 3.807 20 10 DHCDMM COCc1cccc(NCc2cccc(Br)c2[O-])c1 ZINC000048795697 1028249846 /nfs/dbraw/zinc/24/98/46/1028249846.db2.gz NDFKJWQERDMHOB-UHFFFAOYSA-N -1 1 322.202 3.913 20 10 DHCDMM Cn1nccc1[C@@H]1CCCC[N@H+]1Cc1cc(Cl)ccc1O ZINC000370201385 1028578511 /nfs/dbraw/zinc/57/85/11/1028578511.db2.gz KASANPPMLMCUSM-HNNXBMFYSA-N -1 1 305.809 3.506 20 10 DHCDMM CC(C)CN1C(=O)c2ccccc2N[C@@H]1c1cccc(F)c1[O-] ZINC000778519575 1028680941 /nfs/dbraw/zinc/68/09/41/1028680941.db2.gz IQZSDMKTPVOEIJ-KRWDZBQOSA-N -1 1 314.360 3.754 20 10 DHCDMM [O-]c1cc(F)c(Cl)cc1CNc1c[nH]nc1-c1ccccn1 ZINC000816564642 1028944543 /nfs/dbraw/zinc/94/45/43/1028944543.db2.gz LWBYEFCAQCVASP-UHFFFAOYSA-N -1 1 318.739 3.582 20 10 DHCDMM CNC(=O)Oc1cccc(NCc2cc(Cl)c(F)cc2[O-])c1 ZINC000816616923 1028966511 /nfs/dbraw/zinc/96/65/11/1028966511.db2.gz JTBJEFFPHMQFPN-UHFFFAOYSA-N -1 1 324.739 3.515 20 10 DHCDMM [O-]c1c(F)cc(Cl)cc1CNCc1c(F)cc(F)cc1F ZINC000816650829 1028974672 /nfs/dbraw/zinc/97/46/72/1028974672.db2.gz FCXJAWZLLIMFOB-UHFFFAOYSA-N -1 1 319.685 3.892 20 10 DHCDMM [O-]c1c(Br)cccc1CNc1cccc2c1CCO2 ZINC000690189214 1035062851 /nfs/dbraw/zinc/06/28/51/1035062851.db2.gz FJGPLEVAOYWDRX-UHFFFAOYSA-N -1 1 320.186 3.702 20 10 DHCDMM CN(C(=O)c1ccc(O)c([O-])c1Cl)[C@@H]1CCc2ccccc21 ZINC001193232735 1035590726 /nfs/dbraw/zinc/59/07/26/1035590726.db2.gz OANNWTSQSQVCHO-CYBMUJFWSA-N -1 1 317.772 3.511 20 10 DHCDMM C[C@H]1[C@H]2C[C@@H](C[C@H]1NC(=O)c1ccc(O)c([O-])c1Cl)C2(C)C ZINC001193246972 1035593606 /nfs/dbraw/zinc/59/36/06/1035593606.db2.gz GBKAJQQCDJMYDI-GAIPPQHRSA-N -1 1 323.820 3.552 20 10 DHCDMM Cc1ccc(C)c(CC(=O)NCc2cccc(Cl)c2[O-])c1 ZINC001180411343 1035676414 /nfs/dbraw/zinc/67/64/14/1035676414.db2.gz WTCRUKKMNCAKKG-UHFFFAOYSA-N -1 1 303.789 3.521 20 10 DHCDMM CN(Cc1c([O-])ccc(Cl)c1F)c1ccc2c(c1)OCO2 ZINC001180753085 1035750662 /nfs/dbraw/zinc/75/06/62/1035750662.db2.gz YYOYVQGNJOEXJC-UHFFFAOYSA-N -1 1 309.724 3.550 20 10 DHCDMM Cc1cc(C[NH2+][C@@H](C)c2cc(Cl)c(Cl)cc2O)ncn1 ZINC000774266030 1036266662 /nfs/dbraw/zinc/26/66/62/1036266662.db2.gz MYJOREZWJCZIDW-VIFPVBQESA-N -1 1 312.200 3.648 20 10 DHCDMM CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1CNC(=O)c1c(F)ccc(O)c1[O-] ZINC001182510294 1036368294 /nfs/dbraw/zinc/36/82/94/1036368294.db2.gz QJCHRFNXIJDBFZ-UPJWGTAASA-N -1 1 323.408 3.675 20 10 DHCDMM O=C(NCc1cccc(Cl)c1[O-])Nc1cccc2[nH]ccc21 ZINC001199518022 1037280047 /nfs/dbraw/zinc/28/00/47/1037280047.db2.gz MFGSALRRLCXXIY-UHFFFAOYSA-N -1 1 315.760 3.849 20 10 DHCDMM CC[C@@H](NCc1ncnn1C(C)(C)C)c1cccc(Cl)c1[O-] ZINC000287104630 535806657 /nfs/dbraw/zinc/80/66/57/535806657.db2.gz QHDAEYLLTQPTGP-CYBMUJFWSA-N -1 1 322.840 3.633 20 10 DHCDMM COc1ccccc1[C@H](C)[N@@H+](C)Cc1c([O-])cc(F)cc1F ZINC001140584045 1017196696 /nfs/dbraw/zinc/19/66/96/1017196696.db2.gz DRBOANJMNIEMIQ-NSHDSACASA-N -1 1 307.340 3.872 20 10 DHCDMM [O-]c1cccc(F)c1CN1CCOC[C@@H]1c1ccc(Cl)cc1 ZINC001137839493 1018751116 /nfs/dbraw/zinc/75/11/16/1018751116.db2.gz ACQVHHKVURXOEC-MRXNPFEDSA-N -1 1 321.779 3.758 20 10 DHCDMM Cc1cc([N-]S(=O)(=O)c2cc(F)ccc2C)c(C)c(C)c1O ZINC000187061773 1018978423 /nfs/dbraw/zinc/97/84/23/1018978423.db2.gz FRKCHKNWMCHBBF-UHFFFAOYSA-N -1 1 323.389 3.566 20 10 DHCDMM O=C(C[C@H]1C=CCCC1)NCc1cccc(Br)c1[O-] ZINC000765754279 1019115768 /nfs/dbraw/zinc/11/57/68/1019115768.db2.gz UMDWFLWGUCNVRM-NSHDSACASA-N -1 1 324.218 3.517 20 10 DHCDMM COc1cc([O-])c(CN2CCCCC(F)(F)C2)c(Cl)c1 ZINC001236797041 1021275182 /nfs/dbraw/zinc/27/51/82/1021275182.db2.gz AXJGGKMIHAVGAW-UHFFFAOYSA-N -1 1 305.752 3.675 20 10 DHCDMM COCC[N@H+](CCF)Cc1cc2oc3ccccc3c2cc1O ZINC000853548814 1022292499 /nfs/dbraw/zinc/29/24/99/1022292499.db2.gz QNYFKYXLTGTLEB-UHFFFAOYSA-N -1 1 317.360 3.710 20 10 DHCDMM CC(C)(C)[C@@H]1CCCN(C(=O)c2c([O-])c(O)ccc2F)CC1 ZINC000825882824 1033074305 /nfs/dbraw/zinc/07/43/05/1033074305.db2.gz OFFZRYXLHBHBON-LLVKDONJSA-N -1 1 309.381 3.525 20 10 DHCDMM O=C1[N-]C(=S)S/C1=C\c1ccc(-c2cccc(F)c2F)o1 ZINC000790100568 1024224371 /nfs/dbraw/zinc/22/43/71/1024224371.db2.gz FMGHNMMCDZUJJG-WDZFZDKYSA-N -1 1 323.345 3.714 20 10 DHCDMM [O-]c1ccc(Cl)c(F)c1CNc1cnn(-c2ccccc2)c1 ZINC000790981208 1024423700 /nfs/dbraw/zinc/42/37/00/1024423700.db2.gz TZCOEDBCAJCWOO-UHFFFAOYSA-N -1 1 317.751 3.983 20 10 DHCDMM Cc1cc(Br)c([O-])c(CN[C@@H](C)C(F)(F)F)c1 ZINC000808435911 1026286638 /nfs/dbraw/zinc/28/66/38/1026286638.db2.gz CPFGDECISVAMHR-ZETCQYMHSA-N -1 1 312.129 3.504 20 10 DHCDMM C[C@@H](O)c1cc(NCc2cc(Cl)cc(F)c2[O-])ccc1F ZINC000809716734 1026603170 /nfs/dbraw/zinc/60/31/70/1026603170.db2.gz YIEWPCXEBDTNHD-MRVPVSSYSA-N -1 1 313.731 3.989 20 10 DHCDMM C[C@@H](Nc1cc2c(cn1)CCCC2)c1cc([N+](=O)[O-])ccc1[O-] ZINC000812739075 1027381878 /nfs/dbraw/zinc/38/18/78/1027381878.db2.gz JHOHIFODAOALKW-LLVKDONJSA-N -1 1 313.357 3.747 20 10 DHCDMM CNC(=O)Oc1cccc(NCc2c([O-])ccc(Cl)c2F)c1 ZINC000813791943 1027714750 /nfs/dbraw/zinc/71/47/50/1027714750.db2.gz WKVJWHGZDRMFLO-UHFFFAOYSA-N -1 1 324.739 3.515 20 10 DHCDMM C[C@H](C1CC1)n1cc(NCc2cc(Cl)c(F)cc2[O-])cn1 ZINC000816574820 1028953843 /nfs/dbraw/zinc/95/38/43/1028953843.db2.gz SUTIVELAXHMEAM-SECBINFHSA-N -1 1 309.772 3.964 20 10 DHCDMM C[C@H](N[C@H](CF)c1ccc(F)cc1)c1cc([N+](=O)[O-])ccc1[O-] ZINC000866596402 1030389636 /nfs/dbraw/zinc/38/96/36/1030389636.db2.gz KETBEBCELQCYBU-ZUZCIYMTSA-N -1 1 322.311 3.801 20 10 DHCDMM [O-]c1cc(F)c(Cl)cc1CNc1ccn(CC(F)(F)F)n1 ZINC000293486590 1031487584 /nfs/dbraw/zinc/48/75/84/1031487584.db2.gz AHQWQLFIILMJFC-UHFFFAOYSA-N -1 1 323.677 3.556 20 10 DHCDMM Cc1n[nH]c(C)c1[C@@H]1CCC[N@H+]1Cc1cc(Cl)c(F)cc1[O-] ZINC000293957524 1031722241 /nfs/dbraw/zinc/72/22/41/1031722241.db2.gz PPRANMTYQSCCQQ-AWEZNQCLSA-N -1 1 323.799 3.862 20 10 DHCDMM [O-]c1c(Cl)cccc1CNCc1csc(C(F)(F)F)n1 ZINC000898214950 1031977345 /nfs/dbraw/zinc/97/73/45/1031977345.db2.gz HQJXRUSJNPXDPO-UHFFFAOYSA-N -1 1 322.739 3.811 20 10 DHCDMM COc1cccc(NCc2c([O-])ccc(Cl)c2F)c1OC ZINC001179584702 1035486742 /nfs/dbraw/zinc/48/67/42/1035486742.db2.gz WPFKOUHAGNARLG-UHFFFAOYSA-N -1 1 311.740 3.814 20 10 DHCDMM Cc1cc([C@@H]2CCC[N@H+]2Cc2cc(Cl)cc(F)c2[O-])on1 ZINC000775655520 1036256871 /nfs/dbraw/zinc/25/68/71/1036256871.db2.gz GELQLBYCZUHXRQ-ZDUSSCGKSA-N -1 1 310.756 3.818 20 10 DHCDMM CC(C)(C)c1cnc(SCC(=O)c2ccc([O-])c(O)c2)s1 ZINC000164074290 1038049662 /nfs/dbraw/zinc/04/96/62/1038049662.db2.gz MYKXHRRVPLBDQG-UHFFFAOYSA-N -1 1 323.439 3.827 20 10 DHCDMM CCOc1ccc(NCc2cccc(Cl)c2[O-])cc1CO ZINC000158062279 521125790 /nfs/dbraw/zinc/12/57/90/521125790.db2.gz XZISBWGJQCPUKI-UHFFFAOYSA-N -1 1 307.777 3.549 20 10 DHCDMM Cc1cc([O-])c(C[NH2+][C@H](CCC(C)(C)C)C(=O)[O-])cc1Cl ZINC001594326705 958179750 /nfs/dbraw/zinc/17/97/50/958179750.db2.gz IGDQJQWJTQCXJW-CYBMUJFWSA-N -1 1 313.825 3.723 20 10 DHCDMM COc1cccc(NCc2cccc(Br)c2[O-])c1 ZINC000042411726 1013200629 /nfs/dbraw/zinc/20/06/29/1013200629.db2.gz XEKMPZWFQKZUSK-UHFFFAOYSA-N -1 1 308.175 3.775 20 10 DHCDMM O=C(CCCc1ccsc1)NCc1cccc(Cl)c1[O-] ZINC000890759090 1013334802 /nfs/dbraw/zinc/33/48/02/1013334802.db2.gz BWVZIBXNOMKZLU-UHFFFAOYSA-N -1 1 309.818 3.746 20 10 DHCDMM CC(=O)c1cc(Cl)cc(C[N@@H+]2CCS[C@@H](C)CC2)c1[O-] ZINC000192178632 1014710811 /nfs/dbraw/zinc/71/08/11/1014710811.db2.gz QHZXYSHNCYXRAY-JTQLQIEISA-N -1 1 313.850 3.576 20 10 DHCDMM [O-]c1c(CN[C@@H]2c3ccccc3CC[C@@H]2F)ccc(F)c1F ZINC000895690220 1015259213 /nfs/dbraw/zinc/25/92/13/1015259213.db2.gz CCLZMRLGOGKBJI-GOEBONIOSA-N -1 1 307.315 3.786 20 10 DHCDMM [O-]c1c(Cl)cccc1CNc1cnn(Cc2ccccc2)c1 ZINC000393512566 1015742385 /nfs/dbraw/zinc/74/23/85/1015742385.db2.gz CUBUWXWOQNZZCM-UHFFFAOYSA-N -1 1 313.788 3.903 20 10 DHCDMM C[C@H](Cc1cccs1)NC(=O)NCc1cccc(Cl)c1[O-] ZINC000891905720 1015749185 /nfs/dbraw/zinc/74/91/85/1015749185.db2.gz DGARGNXAWWJKNE-SNVBAGLBSA-N -1 1 324.833 3.538 20 10 DHCDMM C[C@@H]([NH2+]Cc1ccccc1CC(=O)[O-])c1ccc(Cl)cc1[O-] ZINC001593305208 994760809 /nfs/dbraw/zinc/76/08/09/994760809.db2.gz UZKKJRCXBIFIDO-LLVKDONJSA-N -1 1 319.788 3.524 20 10 DHCDMM CC(=O)c1cc(Cl)cc(CN2CCn3cccc3[C@H]2C)c1[O-] ZINC000177236679 1020536688 /nfs/dbraw/zinc/53/66/88/1020536688.db2.gz GVMLNLBUUGQWAN-LLVKDONJSA-N -1 1 318.804 3.627 20 10 DHCDMM Cc1c(F)cccc1-c1ccc(C=C2SC(=S)[N-]C2=O)o1 ZINC000734303143 1020584728 /nfs/dbraw/zinc/58/47/28/1020584728.db2.gz FEANFJYAARQCKJ-NTUHNPAUSA-N -1 1 319.382 3.883 20 10 DHCDMM Cn1cc(NCc2c([O-])ccc(Cl)c2F)c(-c2ccco2)n1 ZINC001203180885 1032977172 /nfs/dbraw/zinc/97/71/72/1032977172.db2.gz HEUUZDGARQVPQK-UHFFFAOYSA-N -1 1 321.739 3.790 20 10 DHCDMM [O-]c1c(F)cc(F)cc1CNc1ccnn1C1CCCCC1 ZINC000882963220 1024188807 /nfs/dbraw/zinc/18/88/07/1024188807.db2.gz RUBBZVPYXZOZFY-UHFFFAOYSA-N -1 1 307.344 3.984 20 10 DHCDMM CO[C@@H]1CCOc2c(NCc3cc(F)cc(F)c3[O-])cccc21 ZINC000883106080 1024242379 /nfs/dbraw/zinc/24/23/79/1024242379.db2.gz HOCWQYOSRMJCQY-OAHLLOKOSA-N -1 1 321.323 3.753 20 10 DHCDMM Cc1c(NCc2cc(F)cc(F)c2[O-])cnn1C1CCCC1 ZINC000883104806 1024243109 /nfs/dbraw/zinc/24/31/09/1024243109.db2.gz NBBYKNVYNHGKPC-UHFFFAOYSA-N -1 1 307.344 3.903 20 10 DHCDMM O=C1CCN1c1cccc(NCc2c([O-])ccc(Cl)c2F)c1 ZINC000790485411 1024311534 /nfs/dbraw/zinc/31/15/34/1024311534.db2.gz GJRBAADMGYTSLU-UHFFFAOYSA-N -1 1 320.751 3.534 20 10 DHCDMM CCNC(=O)c1cccc(NCc2c([O-])ccc(Cl)c2F)c1 ZINC000790977394 1024422056 /nfs/dbraw/zinc/42/20/56/1024422056.db2.gz KFJJMFJAIVKCLK-UHFFFAOYSA-N -1 1 322.767 3.547 20 10 DHCDMM Cc1c(NCc2c([O-])ccc(Cl)c2F)cnn1CC(C)C ZINC000790982797 1024426040 /nfs/dbraw/zinc/42/60/40/1024426040.db2.gz YSBMDGYJHGRXFO-UHFFFAOYSA-N -1 1 311.788 3.958 20 10 DHCDMM COc1ccc(NCC(=O)c2ccc([O-])c(O)c2)c2ccccc12 ZINC001170315078 1024740543 /nfs/dbraw/zinc/74/05/43/1024740543.db2.gz PCOMSYZDDCRKLS-UHFFFAOYSA-N -1 1 323.348 3.554 20 10 DHCDMM CSc1ccc(F)c(C)c1NCC(=O)c1ccc([O-])c(O)c1 ZINC001170320474 1024742501 /nfs/dbraw/zinc/74/25/01/1024742501.db2.gz CGUAGGXGMLPGPM-UHFFFAOYSA-N -1 1 321.373 3.562 20 10 DHCDMM CCN1C(=O)c2ccc(Cl)cc2N[C@@H]1c1cccc(F)c1[O-] ZINC000778520309 1028681148 /nfs/dbraw/zinc/68/11/48/1028681148.db2.gz SSLTWYBNOREVOV-HNNXBMFYSA-N -1 1 320.751 3.771 20 10 DHCDMM CN(C)c1ccc2c(c1)OCCN2Cc1cccc([O-])c1Cl ZINC000816570134 1028950095 /nfs/dbraw/zinc/95/00/95/1028950095.db2.gz JVVAXHLXDJTBTG-UHFFFAOYSA-N -1 1 318.804 3.511 20 10 DHCDMM C[C@@H](N[C@H](CF)c1ccc(F)cc1)c1cc([N+](=O)[O-])ccc1[O-] ZINC000866596401 1030390306 /nfs/dbraw/zinc/39/03/06/1030390306.db2.gz KETBEBCELQCYBU-MEBBXXQBSA-N -1 1 322.311 3.801 20 10 DHCDMM [O-]c1c(Cl)cc(Cl)cc1C[N@H+]1CC[C@]2(CC2(F)F)C1 ZINC000846118815 1031865503 /nfs/dbraw/zinc/86/55/03/1031865503.db2.gz ZFTXJXSSAQRPPY-LBPRGKRZSA-N -1 1 308.155 3.930 20 10 DHCDMM Cc1cc(Br)c([O-])c(CN[C@H](C)C(F)(F)F)c1 ZINC000808435910 1034037487 /nfs/dbraw/zinc/03/74/87/1034037487.db2.gz CPFGDECISVAMHR-SSDOTTSWSA-N -1 1 312.129 3.504 20 10 DHCDMM C[C@@H]1C[C@@H](NC(=O)c2ccc(O)c([O-])c2Cl)c2ccccc21 ZINC001193236574 1035593310 /nfs/dbraw/zinc/59/33/10/1035593310.db2.gz IEURXZPZWVTLKW-NOZJJQNGSA-N -1 1 317.772 3.730 20 10 DHCDMM O=C(c1ccc(O)c([O-])c1Cl)N1CCC[C@@H]1C1CCCCC1 ZINC001193233456 1035593407 /nfs/dbraw/zinc/59/34/07/1035593407.db2.gz ZGXDECTWMBIOEB-CYBMUJFWSA-N -1 1 323.820 3.936 20 10 DHCDMM Cc1cc2ccc(NC(=O)c3ccc(O)c([O-])c3Cl)cc2[nH]1 ZINC001193229734 1035597252 /nfs/dbraw/zinc/59/72/52/1035597252.db2.gz LGHLEGXAYDQFBU-UHFFFAOYSA-N -1 1 316.744 3.793 20 10 DHCDMM O=C(NCc1cccc(Cl)c1[O-])c1cccc2ncccc21 ZINC001180411415 1035677111 /nfs/dbraw/zinc/67/71/11/1035677111.db2.gz YJIAOYFBNOMARI-UHFFFAOYSA-N -1 1 312.756 3.524 20 10 DHCDMM [O-]c1c(F)cc(Cl)cc1CN1CCN(c2ccccc2)CC1 ZINC000775639308 1036142111 /nfs/dbraw/zinc/14/21/11/1036142111.db2.gz SSOKQILHNHVCQZ-UHFFFAOYSA-N -1 1 320.795 3.507 20 10 DHCDMM O=S(=O)(Nc1cc(Cl)c([O-])cc1Cl)c1cccs1 ZINC001250916174 1036371101 /nfs/dbraw/zinc/37/11/01/1036371101.db2.gz RRQKKWJKLCRFIW-UHFFFAOYSA-N -1 1 324.210 3.561 20 10 DHCDMM Oc1c(Br)cccc1C[NH2+]Cc1ccc(Cl)o1 ZINC000698071501 1036683283 /nfs/dbraw/zinc/68/32/83/1036683283.db2.gz ADZRRBQVVNIBDF-UHFFFAOYSA-N -1 1 316.582 3.691 20 10 DHCDMM Cc1ccc2c(c1)C(=O)N(C)[C@H](c1cccc(Cl)c1[O-])N2 ZINC000153695673 1037138438 /nfs/dbraw/zinc/13/84/38/1037138438.db2.gz GEHQJUXYGQOWCD-OAHLLOKOSA-N -1 1 302.761 3.550 20 10 DHCDMM COC(=O)Nc1ccc(NCc2cccc(Cl)c2[O-])cc1 ZINC000158047594 1039781826 /nfs/dbraw/zinc/78/18/26/1039781826.db2.gz PMNYILZGGNJAEV-UHFFFAOYSA-N -1 1 306.749 3.836 20 10 DHCDMM C[C@@H](N[C@H](C)c1c(F)cccc1F)c1cc([N+](=O)[O-])ccc1[O-] ZINC000273396253 130116276 /nfs/dbraw/zinc/11/62/76/130116276.db2.gz LWSZBGGSPZGOOO-NXEZZACHSA-N -1 1 322.311 3.990 20 10 DHCDMM CN1Cc2cc(NCc3cccc(Cl)c3[O-])ccc2NC1=O ZINC000187469594 337266098 /nfs/dbraw/zinc/26/60/98/337266098.db2.gz FXEUMEMUSFTZSM-UHFFFAOYSA-N -1 1 317.776 3.635 20 10 DHCDMM CC(C)(C)OCc1cc(CNCc2cccc(Cl)c2[O-])no1 ZINC000188658269 518883311 /nfs/dbraw/zinc/88/33/11/518883311.db2.gz KOSMZPCPZBYERG-UHFFFAOYSA-N -1 1 324.808 3.639 20 10 DHCDMM Cc1ccsc1[C@@H]1C[C@H]1C(=O)NCc1cccc(Cl)c1[O-] ZINC000890760133 1013332857 /nfs/dbraw/zinc/33/28/57/1013332857.db2.gz JCVCMLFGLLIKMK-VXGBXAGGSA-N -1 1 321.829 3.835 20 10 DHCDMM CC(C)(CNC(=O)NCc1cccc(Cl)c1[O-])CC(F)F ZINC000896426946 1015585471 /nfs/dbraw/zinc/58/54/71/1015585471.db2.gz MLXOQPXIYNOYJR-UHFFFAOYSA-N -1 1 320.767 3.526 20 10 DHCDMM C/C=C(\C=C\C(=O)NCc1cccc(Br)c1[O-])CC ZINC000277565959 1016651740 /nfs/dbraw/zinc/65/17/40/1016651740.db2.gz QBGUOGNRNZBEBF-VKJCYHOASA-N -1 1 324.218 3.683 20 10 DHCDMM C[C@H](N[C@@H](C)c1ccc(Cl)c(Cl)c1[O-])c1nccn1C ZINC000850572952 1021617189 /nfs/dbraw/zinc/61/71/89/1021617189.db2.gz RDJZNRQNKUCFBC-IUCAKERBSA-N -1 1 314.216 3.844 20 10 DHCDMM O=C1C[C@H]2CCC[C@@H](C1)N2Cc1c([O-])ccc(Cl)c1Cl ZINC001237080362 1021643167 /nfs/dbraw/zinc/64/31/67/1021643167.db2.gz AUHACQLIOYCJKB-AOOOYVTPSA-N -1 1 314.212 3.785 20 10 DHCDMM CC(=O)c1cc(F)cc(C[N@@H+]2CC=C(C(C)(C)C)CC2)c1O ZINC001168931983 1022186793 /nfs/dbraw/zinc/18/67/93/1022186793.db2.gz JJDAHQUGWJTKHU-UHFFFAOYSA-N -1 1 305.393 3.912 20 10 DHCDMM O=C(CSc1ccnc2ccccc21)c1ccc([O-])c(O)c1 ZINC000068053720 1022505304 /nfs/dbraw/zinc/50/53/04/1022505304.db2.gz BRZIJQVDWXWGQJ-UHFFFAOYSA-N -1 1 311.362 3.621 20 10 DHCDMM CN(Cc1ccc(Cl)nc1)Cc1cc(F)cc(Cl)c1[O-] ZINC001237804310 1022865207 /nfs/dbraw/zinc/86/52/07/1022865207.db2.gz CUNLWPQCLGOCFM-UHFFFAOYSA-N -1 1 315.175 3.865 20 10 DHCDMM COC(=O)CCc1cccc(NCc2cccc(Cl)c2[O-])c1 ZINC000786578514 1023708694 /nfs/dbraw/zinc/70/86/94/1023708694.db2.gz XYXKEWZAZQCZOW-UHFFFAOYSA-N -1 1 319.788 3.763 20 10 DHCDMM CCN(Cc1ccccc1Cl)C(=O)c1c([O-])c(O)ccc1F ZINC000789953974 1024192903 /nfs/dbraw/zinc/19/29/03/1024192903.db2.gz CORDEPXVPIVHAW-UHFFFAOYSA-N -1 1 323.751 3.553 20 10 DHCDMM Cc1noc2ncc(NCc3c([O-])ccc(Cl)c3F)cc12 ZINC000790245298 1024251969 /nfs/dbraw/zinc/25/19/69/1024251969.db2.gz LBVCUULPNJWWIL-UHFFFAOYSA-N -1 1 307.712 3.641 20 10 DHCDMM C[C@H](c1ccco1)N(C)Cc1cc(Cl)cc([N+](=O)[O-])c1[O-] ZINC000131062242 1024253234 /nfs/dbraw/zinc/25/32/34/1024253234.db2.gz DQUZONUMJHSDMZ-SECBINFHSA-N -1 1 310.737 3.740 20 10 DHCDMM O=C1CCN1c1cccc(NCc2cc(Cl)cc(F)c2[O-])c1 ZINC000790943023 1024401341 /nfs/dbraw/zinc/40/13/41/1024401341.db2.gz GKLLHKSVLXZAOJ-UHFFFAOYSA-N -1 1 320.751 3.534 20 10 DHCDMM [O-]c1c(Br)cccc1CNc1cc2cc[nH]c2cn1 ZINC000804654277 1025420403 /nfs/dbraw/zinc/42/04/03/1025420403.db2.gz MLCOQTJIPXYMDZ-UHFFFAOYSA-N -1 1 318.174 3.643 20 10 DHCDMM C[C@@H](N[C@@H]1COc2cc(F)cc(F)c21)c1c([O-])cccc1F ZINC000886587805 1025723562 /nfs/dbraw/zinc/72/35/62/1025723562.db2.gz GCGMQWMERPTCCQ-PRHODGIISA-N -1 1 309.287 3.594 20 10 DHCDMM O=C1CCc2ccc(NCc3cc(Cl)c(F)cc3[O-])cc2N1 ZINC000816563642 1028945017 /nfs/dbraw/zinc/94/50/17/1028945017.db2.gz FGSNASQIOZGFTA-UHFFFAOYSA-N -1 1 320.751 3.682 20 10 DHCDMM [O-]c1c(F)cccc1CN1Cc2cccc(Br)c2C1 ZINC000770664448 1034469225 /nfs/dbraw/zinc/46/92/25/1034469225.db2.gz NROFFQYQYUIPCQ-UHFFFAOYSA-N -1 1 322.177 3.810 20 10 DHCDMM O=c1[nH]c2cc(NCc3cc(Cl)cc(F)c3[O-])ccc2o1 ZINC001177395688 1035368837 /nfs/dbraw/zinc/36/88/37/1035368837.db2.gz UVNRMUBAYBPYGF-UHFFFAOYSA-N -1 1 308.696 3.644 20 10 DHCDMM [O-]c1c(F)cc(Cl)cc1CNc1cccc(-n2cccn2)c1 ZINC001178045984 1035406374 /nfs/dbraw/zinc/40/63/74/1035406374.db2.gz CBQRTBNEQILREV-UHFFFAOYSA-N -1 1 317.751 3.983 20 10 DHCDMM [O-]c1c(F)cc(Cl)cc1CNc1cccc2c1OCCO2 ZINC001178416835 1035428711 /nfs/dbraw/zinc/42/87/11/1035428711.db2.gz FEGQSAYQVKDZLH-UHFFFAOYSA-N -1 1 309.724 3.568 20 10 DHCDMM C[C@H](CCc1ccccc1)NC(=O)c1ccc(O)c([O-])c1Cl ZINC001193247166 1035592650 /nfs/dbraw/zinc/59/26/50/1035592650.db2.gz NKDQGRFVAWUZJW-LLVKDONJSA-N -1 1 319.788 3.502 20 10 DHCDMM O=C(Nc1ccc2ccncc2c1)c1ccc(O)c([O-])c1Cl ZINC001193229299 1035596708 /nfs/dbraw/zinc/59/67/08/1035596708.db2.gz HSGZTWQDYRZKCZ-UHFFFAOYSA-N -1 1 314.728 3.552 20 10 DHCDMM Cn1cccc1[C@@H]1CCC[N@H+]1Cc1cc(Cl)cc(F)c1[O-] ZINC000775644517 1036182429 /nfs/dbraw/zinc/18/24/29/1036182429.db2.gz MTZYLWHVHCPRSG-HNNXBMFYSA-N -1 1 308.784 3.860 20 10 DHCDMM Cc1csc([C@@H](C)NCc2cc(Cl)cc(F)c2[O-])n1 ZINC000776163101 1037635676 /nfs/dbraw/zinc/63/56/76/1037635676.db2.gz OTCMKHWTJNVSLF-MRVPVSSYSA-N -1 1 300.786 3.800 20 10 DHCDMM O=C1[N-]C(=S)S/C1=C/c1ccc(F)c(Cl)c1Cl ZINC000761377924 1039961593 /nfs/dbraw/zinc/96/15/93/1039961593.db2.gz WZYLUNFRAVKNIN-ZZXKWVIFSA-N -1 1 308.186 3.621 20 10 DHCDMM O=C(NCc1cccc(Cl)c1[O-])c1conc1C1CCCC1 ZINC000890763443 1013346867 /nfs/dbraw/zinc/34/68/67/1013346867.db2.gz WKQHOTSBYOPKAT-UHFFFAOYSA-N -1 1 320.776 3.621 20 10 DHCDMM CCCN(CCC)c1ccc(C=C2SC(=O)[N-]C2=O)cc1 ZINC000007154820 1012343586 /nfs/dbraw/zinc/34/35/86/1012343586.db2.gz VZUCHFYJMXGPTB-KAMYIIQDSA-N -1 1 304.415 3.637 20 10 DHCDMM CN(Cc1ccsc1)Cc1cc(Cl)cc([N+](=O)[O-])c1[O-] ZINC000120463096 1012570181 /nfs/dbraw/zinc/57/01/81/1012570181.db2.gz KBFZVTICDOIMKE-UHFFFAOYSA-N -1 1 312.778 3.647 20 10 DHCDMM CC(C)c1cc(NCc2cccc(Br)c2[O-])ncn1 ZINC000764935609 1018433147 /nfs/dbraw/zinc/43/31/47/1018433147.db2.gz ZVCHTUDICUZQKA-UHFFFAOYSA-N -1 1 322.206 3.680 20 10 DHCDMM Cc1ccc2ccc(NCC(=O)c3ccc([O-])c(O)c3)cc2c1 ZINC001170323009 1024740806 /nfs/dbraw/zinc/74/08/06/1024740806.db2.gz SVSASOOEBLTVOO-UHFFFAOYSA-N -1 1 307.349 3.854 20 10 DHCDMM CNC(=O)Nc1cc(NCc2cccc(Cl)c2[O-])ccc1F ZINC000809699165 1026586545 /nfs/dbraw/zinc/58/65/45/1026586545.db2.gz OWUFJRXZJQWZIH-UHFFFAOYSA-N -1 1 323.755 3.548 20 10 DHCDMM CC(C)(C(=O)NCc1cccc(Cl)c1[O-])c1ccccc1 ZINC001159034056 1027765335 /nfs/dbraw/zinc/76/53/35/1027765335.db2.gz PYWZURWPVJMIFX-UHFFFAOYSA-N -1 1 303.789 3.640 20 10 DHCDMM [O-]c1cc(F)c(Cl)cc1CNc1ccc(-n2cccn2)cc1 ZINC000816523011 1028932988 /nfs/dbraw/zinc/93/29/88/1028932988.db2.gz YUJVDEIHTILREN-UHFFFAOYSA-N -1 1 317.751 3.983 20 10 DHCDMM CCc1nc(CNCc2cc(Cl)cc(Cl)c2[O-])co1 ZINC000825050664 1030709851 /nfs/dbraw/zinc/70/98/51/1030709851.db2.gz PQRDYNRMZAPXFV-UHFFFAOYSA-N -1 1 301.173 3.539 20 10 DHCDMM CC1(C)CCC[C@H]1[C@@H]1CCN(C(=O)c2c([O-])c(O)ccc2F)C1 ZINC000844148680 1030983974 /nfs/dbraw/zinc/98/39/74/1030983974.db2.gz AEMLYYBSYNRLBP-NEPJUHHUSA-N -1 1 321.392 3.525 20 10 DHCDMM [O-]c1c(Cl)cccc1CNCc1ncc(C(F)(F)F)s1 ZINC000898218887 1031979726 /nfs/dbraw/zinc/97/97/26/1031979726.db2.gz RSTVJCGAFZEURW-UHFFFAOYSA-N -1 1 322.739 3.811 20 10 DHCDMM O=C1c2ccccc2C(=O)c2cc(Nc3ccsc3)c([O-])cc21 ZINC001173820995 1033861268 /nfs/dbraw/zinc/86/12/68/1033861268.db2.gz KLBNVWQXENQDOX-UHFFFAOYSA-N -1 1 321.357 3.973 20 10 DHCDMM CCc1c(Cl)cc(Nc2ccncc2F)c([O-])c1Cl ZINC001175201743 1034848338 /nfs/dbraw/zinc/84/83/38/1034848338.db2.gz LONPOWVSCURSLB-UHFFFAOYSA-N -1 1 301.148 3.961 20 10 DHCDMM CCNC(=O)c1ccc(NCc2cc(Cl)cc(F)c2[O-])cc1 ZINC001178895440 1035453365 /nfs/dbraw/zinc/45/33/65/1035453365.db2.gz KXKGMCDPZWQUFR-UHFFFAOYSA-N -1 1 322.767 3.547 20 10 DHCDMM O=C(NCc1cccc(Cl)c1[O-])C1(c2ccccc2F)CC1 ZINC001180409837 1035673936 /nfs/dbraw/zinc/67/39/36/1035673936.db2.gz GDPYHEHWZROFPQ-UHFFFAOYSA-N -1 1 319.763 3.533 20 10 DHCDMM [O-]c1c(Br)cccc1CNc1ccnc(Cl)c1 ZINC000149073256 1035747591 /nfs/dbraw/zinc/74/75/91/1035747591.db2.gz BCSLQYHFNCRQSZ-UHFFFAOYSA-N -1 1 313.582 3.815 20 10 DHCDMM [O-]c1c(F)cc(F)cc1CN1CCN(C2CC2)c2ccccc21 ZINC001181135195 1035849870 /nfs/dbraw/zinc/84/98/70/1035849870.db2.gz SCKFACREHWIEEN-UHFFFAOYSA-N -1 1 316.351 3.659 20 10 DHCDMM [O-]c1cc(O)c(CN2CCCC[C@H]2C(F)(F)F)cc1Cl ZINC001232267718 1039011846 /nfs/dbraw/zinc/01/18/46/1039011846.db2.gz KMIPWTNSPLFZNM-LBPRGKRZSA-N -1 1 309.715 3.668 20 10 DHCDMM [O-]c1c(Cl)cccc1CNc1ccc2c(c1)OCCCO2 ZINC000158115788 1040060205 /nfs/dbraw/zinc/06/02/05/1040060205.db2.gz DDULKZUZZJFZOW-UHFFFAOYSA-N -1 1 305.761 3.819 20 10 DHCDMM Cc1cccc([C@H]([NH2+]Cc2cc(Cl)c(C)cc2[O-])C(=O)[O-])c1 ZINC001594397097 958778217 /nfs/dbraw/zinc/77/82/17/958778217.db2.gz FICWEZLOHBCKLI-INIZCTEOSA-N -1 1 319.788 3.578 20 10 DHCDMM O=C(CC[C@@H]1CC1(Cl)Cl)NCc1cccc(Cl)c1[O-] ZINC000890761164 1013335714 /nfs/dbraw/zinc/33/57/14/1013335714.db2.gz MPSAIZPHDPSZGC-SECBINFHSA-N -1 1 322.619 3.636 20 10 DHCDMM CC(C)c1c[nH]c(CNCc2cc(Cl)cc(Cl)c2[O-])n1 ZINC000894780840 1013488644 /nfs/dbraw/zinc/48/86/44/1013488644.db2.gz KCLPKHKUELCZCY-UHFFFAOYSA-N -1 1 314.216 3.835 20 10 DHCDMM CCC(CC)CC(=O)NCc1cccc(Br)c1[O-] ZINC000765751889 1019118899 /nfs/dbraw/zinc/11/88/99/1019118899.db2.gz SZEBQCHHBLOFAE-UHFFFAOYSA-N -1 1 314.223 3.597 20 10 DHCDMM COCc1ccc(N[C@H](C)c2cc(F)cc(F)c2[O-])cc1OC ZINC000858567596 1032948165 /nfs/dbraw/zinc/94/81/65/1032948165.db2.gz GLLGERMGDSGWAO-SNVBAGLBSA-N -1 1 323.339 3.999 20 10 DHCDMM Cn1ncc(NCc2cc(F)cc(F)c2[O-])c1-c1ccccc1 ZINC001202356923 1021226012 /nfs/dbraw/zinc/22/60/12/1021226012.db2.gz NINOSVNUISGOTN-UHFFFAOYSA-N -1 1 315.323 3.683 20 10 DHCDMM Cc1ccc2c(c1)C(=O)N(C)[C@H](c1cc(Cl)cc(F)c1[O-])N2 ZINC000768274824 1022938531 /nfs/dbraw/zinc/93/85/31/1022938531.db2.gz UGFLOPFFKKGMBB-OAHLLOKOSA-N -1 1 320.751 3.689 20 10 DHCDMM CCN(Cc1cccc(Cl)c1)C(=O)c1c([O-])c(O)ccc1F ZINC000790069715 1024211031 /nfs/dbraw/zinc/21/10/31/1024211031.db2.gz POENNFPUXUEPGV-UHFFFAOYSA-N -1 1 323.751 3.553 20 10 DHCDMM [O-]c1ccc(Cl)c(F)c1CNc1ccc(-n2cccn2)cc1 ZINC000790951975 1024405306 /nfs/dbraw/zinc/40/53/06/1024405306.db2.gz UTZDKWOEZVINMW-UHFFFAOYSA-N -1 1 317.751 3.983 20 10 DHCDMM COCc1ccc([C@@H]2CCCN2Cc2ccc(F)c(F)c2[O-])o1 ZINC000877395904 1033294606 /nfs/dbraw/zinc/29/46/06/1033294606.db2.gz PBDRBTZOGAFQTD-AWEZNQCLSA-N -1 1 323.339 3.747 20 10 DHCDMM CCN(C)C(=O)c1cccc(NCc2cccc(Cl)c2[O-])c1 ZINC000809726935 1026595178 /nfs/dbraw/zinc/59/51/78/1026595178.db2.gz YMJWGXSHQRMFKL-UHFFFAOYSA-N -1 1 318.804 3.750 20 10 DHCDMM [O-]c1c(F)cc(Cl)cc1CN1CCC[C@H]1c1cccnc1 ZINC000809728661 1026595946 /nfs/dbraw/zinc/59/59/46/1026595946.db2.gz DZKWEZIFNWMYFM-HNNXBMFYSA-N -1 1 306.768 3.917 20 10 DHCDMM [O-]c1c(F)cc(Cl)cc1CN1CCC[C@@H]1c1ccncc1 ZINC000809728653 1026596005 /nfs/dbraw/zinc/59/60/05/1026596005.db2.gz DQAQSCJYDKROEB-OAHLLOKOSA-N -1 1 306.768 3.917 20 10 DHCDMM Cc1nn(C)c2cc(NCc3cc(Cl)cc(F)c3[O-])ccc12 ZINC000812774464 1027401453 /nfs/dbraw/zinc/40/14/53/1027401453.db2.gz OUZXTFOIHYHRGX-UHFFFAOYSA-N -1 1 319.767 3.992 20 10 DHCDMM Cc1nn(C)c2cc(NCc3cc(Cl)c(F)cc3[O-])ccc12 ZINC000816616557 1028963733 /nfs/dbraw/zinc/96/37/33/1028963733.db2.gz ZTLJGKQZVXNIBP-UHFFFAOYSA-N -1 1 319.767 3.992 20 10 DHCDMM CCCc1ncc(CNCc2cc(Cl)cc(Cl)c2[O-])o1 ZINC000825086247 1030721506 /nfs/dbraw/zinc/72/15/06/1030721506.db2.gz RFUVWVVCSXQFPR-UHFFFAOYSA-N -1 1 315.200 3.929 20 10 DHCDMM CCc1nocc1CN(C)Cc1cc(Cl)cc(Cl)c1[O-] ZINC000293538743 1031505213 /nfs/dbraw/zinc/50/52/13/1031505213.db2.gz CPMCJYYVRFZUBO-UHFFFAOYSA-N -1 1 315.200 3.881 20 10 DHCDMM CC[C@@H](NCc1nonc1C)c1ccc(Cl)c(Cl)c1[O-] ZINC000872138077 1031531406 /nfs/dbraw/zinc/53/14/06/1031531406.db2.gz ZMZZDAJZLJPRFQ-SNVBAGLBSA-N -1 1 316.188 3.631 20 10 DHCDMM Cc1ccc2c(c1)C(=O)N(C)[C@@H](c1cc(Cl)c(F)cc1[O-])N2 ZINC000877855805 1033489859 /nfs/dbraw/zinc/48/98/59/1033489859.db2.gz VMBJSQOXTSQMRD-HNNXBMFYSA-N -1 1 320.751 3.689 20 10 DHCDMM C[C@@H](c1ccco1)[N@H+](C)Cc1c(O)cccc1Br ZINC000862219498 1033784655 /nfs/dbraw/zinc/78/46/55/1033784655.db2.gz HMQCHDMDYWHQLT-JTQLQIEISA-N -1 1 310.191 3.941 20 10 DHCDMM C[C@H]1c2ccccc2CCN1C(=O)c1ccc(O)c([O-])c1Cl ZINC001193209251 1035585574 /nfs/dbraw/zinc/58/55/74/1035585574.db2.gz HNYPQVFSQLFERP-JTQLQIEISA-N -1 1 317.772 3.511 20 10 DHCDMM O=C(C/C=C/c1ccc(F)cc1)NCc1cccc(Cl)c1[O-] ZINC001180409851 1035673543 /nfs/dbraw/zinc/67/35/43/1035673543.db2.gz GXPCUEDUMMQAPJ-HNQUOIGGSA-N -1 1 319.763 3.904 20 10 DHCDMM [O-]c1c(F)cc(Cl)cc1CN1CCC[C@@H]1c1ccccn1 ZINC000775650481 1036232224 /nfs/dbraw/zinc/23/22/24/1036232224.db2.gz DQAYOCDBGUCNLA-OAHLLOKOSA-N -1 1 306.768 3.917 20 10 DHCDMM Cc1ncc(CN(C)Cc2cc(Cl)cc(F)c2[O-])s1 ZINC000775659474 1036269381 /nfs/dbraw/zinc/26/93/81/1036269381.db2.gz XZSMQLALJZNACP-UHFFFAOYSA-N -1 1 300.786 3.582 20 10 DHCDMM CC(C)[C@H]1CC[C@@H](C)C[C@@H]1CNC(=O)c1c(F)ccc(O)c1[O-] ZINC001182510293 1036367712 /nfs/dbraw/zinc/36/77/12/1036367712.db2.gz QJCHRFNXIJDBFZ-JHJVBQTASA-N -1 1 323.408 3.675 20 10 DHCDMM Cc1ncsc1CN(C)Cc1cc(Cl)cc(F)c1[O-] ZINC000775676005 1036393690 /nfs/dbraw/zinc/39/36/90/1036393690.db2.gz JAWCHORNELGZJA-UHFFFAOYSA-N -1 1 300.786 3.582 20 10 DHCDMM CC(=O)Nc1ccc(C)c(NCc2cccc(Cl)c2[O-])c1 ZINC000158038212 1039776341 /nfs/dbraw/zinc/77/63/41/1039776341.db2.gz KOPQYTPQNJOVOB-UHFFFAOYSA-N -1 1 304.777 3.925 20 10 DHCDMM COC[C@@H](NCc1cc(Cl)cc(Cl)c1[O-])c1ccco1 ZINC000080240705 192015262 /nfs/dbraw/zinc/01/52/62/192015262.db2.gz COTJKGQJVBEISD-GFCCVEGCSA-N -1 1 316.184 3.769 20 10 DHCDMM CCC(CC)n1ccc(C(=O)NCc2cccc(Cl)c2[O-])n1 ZINC000890760118 1013333008 /nfs/dbraw/zinc/33/30/08/1013333008.db2.gz ILTJCPGKDSTEPG-UHFFFAOYSA-N -1 1 321.808 3.533 20 10 DHCDMM [O-]c1c(Br)cccc1CNc1ccc2n[nH]cc2c1 ZINC000048796065 1013485141 /nfs/dbraw/zinc/48/51/41/1013485141.db2.gz PQMRVHCYDFLSSI-UHFFFAOYSA-N -1 1 318.174 3.643 20 10 DHCDMM C[C@@H](C[N@H+](CC(=O)[O-])Cc1cc(Cl)ccc1[O-])C(C)(C)C ZINC001592593255 978525457 /nfs/dbraw/zinc/52/54/57/978525457.db2.gz YSBXGUNDLDKONC-NSHDSACASA-N -1 1 313.825 3.614 20 10 DHCDMM C[C@@H](C[N@@H+](CC(=O)[O-])Cc1cc(Cl)ccc1[O-])C(C)(C)C ZINC001592593255 978525463 /nfs/dbraw/zinc/52/54/63/978525463.db2.gz YSBXGUNDLDKONC-NSHDSACASA-N -1 1 313.825 3.614 20 10 DHCDMM C[C@H](N[C@@H](C(=O)[O-])c1c(F)cccc1Cl)c1ccccc1O ZINC001599901141 984829030 /nfs/dbraw/zinc/82/90/30/984829030.db2.gz TWLUPXFMQHKILC-BJOHPYRUSA-N -1 1 323.751 3.661 20 10 DHCDMM [O-]c1cccc(F)c1CN(Cc1ccccn1)Cc1ccccn1 ZINC001137832061 1018145775 /nfs/dbraw/zinc/14/57/75/1018145775.db2.gz ZCCHZNSZAAFYCO-UHFFFAOYSA-N -1 1 323.371 3.524 20 10 DHCDMM CC(C)(C)c1ccc(NCc2c([O-])ccc(Cl)c2F)nn1 ZINC001116773535 1018856209 /nfs/dbraw/zinc/85/62/09/1018856209.db2.gz MWSFOAXWIFZXKT-UHFFFAOYSA-N -1 1 309.772 3.884 20 10 DHCDMM CCn1cc(CN(C)Cc2cc(Cl)cc(Cl)c2[O-])cn1 ZINC000769426594 1023146180 /nfs/dbraw/zinc/14/61/80/1023146180.db2.gz FVVFDHJOCRLTME-UHFFFAOYSA-N -1 1 314.216 3.547 20 10 DHCDMM COCCOc1cc(C)ccc1NCc1cc(F)cc(F)c1[O-] ZINC000882906024 1024164650 /nfs/dbraw/zinc/16/46/50/1024164650.db2.gz GTTVVSQAGHUFIQ-UHFFFAOYSA-N -1 1 323.339 3.616 20 10 DHCDMM COCCOc1ccc(NCc2cc(F)cc(F)c2[O-])c(C)c1 ZINC000883001516 1024207844 /nfs/dbraw/zinc/20/78/44/1024207844.db2.gz GOCBGPAEBZECGY-UHFFFAOYSA-N -1 1 323.339 3.616 20 10 DHCDMM COCCCOc1ccccc1NCc1cc(F)cc(F)c1[O-] ZINC000883056995 1024226117 /nfs/dbraw/zinc/22/61/17/1024226117.db2.gz BMFWUADLOXQCFO-UHFFFAOYSA-N -1 1 323.339 3.698 20 10 DHCDMM CC(C)([NH2+]Cc1cc(F)cc(F)c1O)c1ccccc1[N+](=O)[O-] ZINC000883126884 1024249962 /nfs/dbraw/zinc/24/99/62/1024249962.db2.gz DBECDGMKJWODDP-UHFFFAOYSA-N -1 1 322.311 3.604 20 10 DHCDMM [O-]c1ccc(Cl)c(F)c1CNc1cccc(CCCO)c1 ZINC000790990399 1024411614 /nfs/dbraw/zinc/41/16/14/1024411614.db2.gz NHEVGFGGUKERLF-UHFFFAOYSA-N -1 1 309.768 3.722 20 10 DHCDMM Cc1nn(C)c2cc(NCc3cccc(Cl)c3[O-])ccc12 ZINC000812773373 1027398502 /nfs/dbraw/zinc/39/85/02/1027398502.db2.gz DMCFPMATOWUTBK-UHFFFAOYSA-N -1 1 301.777 3.853 20 10 DHCDMM [O-]c1cc(F)c(Cl)cc1CNc1cccc(-c2nnco2)c1 ZINC000816479018 1028889944 /nfs/dbraw/zinc/88/99/44/1028889944.db2.gz AEQRQHWKSCCYGD-UHFFFAOYSA-N -1 1 319.723 3.847 20 10 DHCDMM [O-]c1cc(F)c(Cl)cc1CNc1ccc2c(c1)OCCO2 ZINC000816536761 1028927693 /nfs/dbraw/zinc/92/76/93/1028927693.db2.gz JBMYWHBOFITKGB-UHFFFAOYSA-N -1 1 309.724 3.568 20 10 DHCDMM COC(=O)Nc1cccc(NCc2cc(Cl)c(F)cc2[O-])c1 ZINC000816523358 1028932272 /nfs/dbraw/zinc/93/22/72/1028932272.db2.gz NFRAZURDTBTLFP-UHFFFAOYSA-N -1 1 324.739 3.975 20 10 DHCDMM [O-]c1cc(F)c(Cl)cc1C[N@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000816592282 1028938367 /nfs/dbraw/zinc/93/83/67/1028938367.db2.gz FSEPNJLCLDLTJS-MRVPVSSYSA-N -1 1 311.706 3.959 20 10 DHCDMM COCc1cc(N[C@@H](C)c2cc(F)cc(F)c2[O-])ccc1OC ZINC000866500661 1030328138 /nfs/dbraw/zinc/32/81/38/1030328138.db2.gz XXKPHCTXENXSJY-JTQLQIEISA-N -1 1 323.339 3.999 20 10 DHCDMM [O-]c1c(Cl)cc(Cl)cc1C[N@H+]1CC[C@@]2(CC2(F)F)C1 ZINC000846118814 1031866914 /nfs/dbraw/zinc/86/69/14/1031866914.db2.gz ZFTXJXSSAQRPPY-GFCCVEGCSA-N -1 1 308.155 3.930 20 10 DHCDMM COC(=O)Nc1ccc(NCc2cc(Cl)cc(F)c2[O-])cc1 ZINC001177399741 1035368734 /nfs/dbraw/zinc/36/87/34/1035368734.db2.gz HNNSMVWPCBTVAK-UHFFFAOYSA-N -1 1 324.739 3.975 20 10 DHCDMM C[C@@H]1c2ccccc2CCN1C(=O)c1ccc(O)c([O-])c1Cl ZINC001193209253 1035587349 /nfs/dbraw/zinc/58/73/49/1035587349.db2.gz HNYPQVFSQLFERP-SNVBAGLBSA-N -1 1 317.772 3.511 20 10 DHCDMM CN(C(=O)c1ccc(O)c([O-])c1Cl)[C@H]1CCc2ccccc21 ZINC001193232736 1035591292 /nfs/dbraw/zinc/59/12/92/1035591292.db2.gz OANNWTSQSQVCHO-ZDUSSCGKSA-N -1 1 317.772 3.511 20 10 DHCDMM O=C(Nc1ccc2c(c1)N=NC2)c1ccc(O)c([O-])c1Cl ZINC001193230524 1035596317 /nfs/dbraw/zinc/59/63/17/1035596317.db2.gz TXZCZHMAYVPGHS-UHFFFAOYSA-N -1 1 303.705 3.601 20 10 DHCDMM Cc1cc(C)c(NC(=O)c2ccc(O)c([O-])c2Cl)cc1C ZINC001193229094 1035597279 /nfs/dbraw/zinc/59/72/79/1035597279.db2.gz DBNXYWFFZROZIT-UHFFFAOYSA-N -1 1 305.761 3.929 20 10 DHCDMM O=C(NCc1cccc(Cl)c1[O-])c1ccc2cccnc2c1 ZINC001180409542 1035674525 /nfs/dbraw/zinc/67/45/25/1035674525.db2.gz APLOQQLZBZDLOG-UHFFFAOYSA-N -1 1 312.756 3.524 20 10 DHCDMM C[C@@H]1[C@@H](C(F)(F)F)CCC[N@H+]1Cc1cc(F)cc(F)c1O ZINC001180970702 1035799676 /nfs/dbraw/zinc/79/96/76/1035799676.db2.gz WBKRXVGVKNVVRO-KCJUWKMLSA-N -1 1 309.278 3.833 20 10 DHCDMM Cc1cc(Br)c([O-])c(CN2CCCC(F)(F)C2)c1 ZINC001182725988 1036439930 /nfs/dbraw/zinc/43/99/30/1036439930.db2.gz OBWXDUFLXJGSFM-UHFFFAOYSA-N -1 1 320.177 3.694 20 10 DHCDMM Cc1ccccc1[C@H]1CN(Cc2cccc(Cl)c2[O-])CCO1 ZINC000775703735 1036486222 /nfs/dbraw/zinc/48/62/22/1036486222.db2.gz WEIPIXREOVKFHD-QGZVFWFLSA-N -1 1 317.816 3.928 20 10 DHCDMM COc1cc(F)c(NCc2cc(F)cc(F)c2[O-])cc1F ZINC001201880787 1037927834 /nfs/dbraw/zinc/92/78/34/1037927834.db2.gz DTXWLUNFCGZPJW-UHFFFAOYSA-N -1 1 301.239 3.569 20 10 DHCDMM [O-]c1c(Br)c(F)ccc1Nc1ccncc1Cl ZINC001212160012 1038510547 /nfs/dbraw/zinc/51/05/47/1038510547.db2.gz ISFZDSSZISMHDM-UHFFFAOYSA-N -1 1 317.545 3.508 20 10 DHCDMM O=C([O-])CC[C@@H]1CCC[N@H+](Cc2ccc3ccccc3c2[O-])C1 ZINC001595018725 951304274 /nfs/dbraw/zinc/30/42/74/951304274.db2.gz BPMZONQXQDEETD-AWEZNQCLSA-N -1 1 313.397 3.622 20 10 DHCDMM O=C([O-])CC[C@@H]1CCC[N@@H+](Cc2ccc3ccccc3c2[O-])C1 ZINC001595018725 951304286 /nfs/dbraw/zinc/30/42/86/951304286.db2.gz BPMZONQXQDEETD-AWEZNQCLSA-N -1 1 313.397 3.622 20 10 DHCDMM O=C1[N-]C(=S)S/C1=C/c1ccc(Oc2ccccc2)o1 ZINC000588410019 1014808986 /nfs/dbraw/zinc/80/89/86/1014808986.db2.gz XTQMVGHAHKFILE-DHZHZOJOSA-N -1 1 303.364 3.561 20 10 DHCDMM O=C(CC1=CCCCC1)NCc1cccc(Br)c1[O-] ZINC000277474020 1016357547 /nfs/dbraw/zinc/35/75/47/1016357547.db2.gz IDOABWBRXIIBLJ-UHFFFAOYSA-N -1 1 324.218 3.661 20 10 DHCDMM CC(C(=O)NCc1cccc(Br)c1[O-])=C1CCCC1 ZINC000277608943 1016768413 /nfs/dbraw/zinc/76/84/13/1016768413.db2.gz VAQZJJGUKQXRCK-UHFFFAOYSA-N -1 1 324.218 3.661 20 10 DHCDMM [O-]c1ccc(Cl)c(Cl)c1CN1CC(F)(F)C[C@H]1CF ZINC001237078119 1021627583 /nfs/dbraw/zinc/62/75/83/1021627583.db2.gz OIYJXQBGZXYHEG-ZETCQYMHSA-N -1 1 314.134 3.878 20 10 DHCDMM CC(=O)N1CCc2c1cccc2NCc1cccc(Cl)c1[O-] ZINC000769558253 1023179559 /nfs/dbraw/zinc/17/95/59/1023179559.db2.gz VGJJRFCUVOZZID-UHFFFAOYSA-N -1 1 316.788 3.567 20 10 DHCDMM CC(C)(C)c1nnc(NCc2c([O-])ccc(Cl)c2F)s1 ZINC000790242783 1024249485 /nfs/dbraw/zinc/24/94/85/1024249485.db2.gz KVBHYAQMKUXTDV-UHFFFAOYSA-N -1 1 315.801 3.946 20 10 DHCDMM CC(=O)c1cc(Cl)cc(CN(CC(F)F)C(C)C)c1[O-] ZINC000135399088 1025224685 /nfs/dbraw/zinc/22/46/85/1025224685.db2.gz HSVVRASVHMNCFQ-UHFFFAOYSA-N -1 1 305.752 3.724 20 10 DHCDMM C[C@H](NCc1cc(COC(C)(C)C)on1)c1c([O-])cccc1F ZINC000886595021 1025730818 /nfs/dbraw/zinc/73/08/18/1025730818.db2.gz ZKBXLAINRWKKJD-NSHDSACASA-N -1 1 322.380 3.685 20 10 DHCDMM [O-]c1c(F)cc(Cl)cc1CN1CCOCc2ccccc21 ZINC000811508128 1027024832 /nfs/dbraw/zinc/02/48/32/1027024832.db2.gz BHCCAJODJJFUMC-UHFFFAOYSA-N -1 1 307.752 3.722 20 10 DHCDMM [O-]c1ccc(Cl)c(F)c1CN1CCOCc2ccccc21 ZINC000811508240 1027025648 /nfs/dbraw/zinc/02/56/48/1027025648.db2.gz HUFPHSUGHZLMEO-UHFFFAOYSA-N -1 1 307.752 3.722 20 10 DHCDMM CC1(C)CN(Cc2cc(Cl)cc(F)c2[O-])[C@@H]1[C@H]1CCCO1 ZINC000811510353 1027026180 /nfs/dbraw/zinc/02/61/80/1027026180.db2.gz CYJDNNTYMOFFRG-UKRRQHHQSA-N -1 1 313.800 3.574 20 10 DHCDMM CC1(C)CN(Cc2cc(Cl)cc(F)c2[O-])[C@H]1[C@H]1CCCO1 ZINC000811510352 1027027147 /nfs/dbraw/zinc/02/71/47/1027027147.db2.gz CYJDNNTYMOFFRG-HIFRSBDPSA-N -1 1 313.800 3.574 20 10 DHCDMM C[C@H](Nc1cc2c(cn1)CCCC2)c1cc([N+](=O)[O-])ccc1[O-] ZINC000812739076 1027382492 /nfs/dbraw/zinc/38/24/92/1027382492.db2.gz JHOHIFODAOALKW-NSHDSACASA-N -1 1 313.357 3.747 20 10 DHCDMM C[C@H](C1CC1)n1nccc1NCc1cc(Cl)c(F)cc1[O-] ZINC000816546702 1028930191 /nfs/dbraw/zinc/93/01/91/1028930191.db2.gz SZWVMQBOMJDLJP-SECBINFHSA-N -1 1 309.772 3.964 20 10 DHCDMM COc1ccc(N(C)Cc2cccc([O-])c2Cl)cc1OC ZINC000816569774 1028947282 /nfs/dbraw/zinc/94/72/82/1028947282.db2.gz WKLAYQCFLPTZJN-UHFFFAOYSA-N -1 1 307.777 3.699 20 10 DHCDMM C[C@H](O)c1cc(NCc2cc(Cl)c(F)cc2[O-])ccc1F ZINC000816609916 1028958875 /nfs/dbraw/zinc/95/88/75/1028958875.db2.gz REJXRNXFKDCPQS-QMMMGPOBSA-N -1 1 313.731 3.989 20 10 DHCDMM Cc1cc(Br)c(O)c(C[N@H+](C)Cc2ccoc2)c1 ZINC000781897059 1029436211 /nfs/dbraw/zinc/43/62/11/1029436211.db2.gz CDMKBKYRSICYTM-UHFFFAOYSA-N -1 1 310.191 3.688 20 10 DHCDMM CCn1ccnc1[C@H](C)NCc1cc(Cl)cc(Cl)c1[O-] ZINC000825005032 1030685631 /nfs/dbraw/zinc/68/56/31/1030685631.db2.gz BRXZUBDTSLLZFA-VIFPVBQESA-N -1 1 314.216 3.766 20 10 DHCDMM O=C(NCc1cccc(Cl)c1[O-])c1ccc(C2CC2)cc1 ZINC001180421067 1035680621 /nfs/dbraw/zinc/68/06/21/1035680621.db2.gz VCFYGHOTSHMERK-UHFFFAOYSA-N -1 1 301.773 3.853 20 10 DHCDMM CN1CCN(Cc2cc(Cl)cc(F)c2[O-])Cc2ccccc21 ZINC000775675788 1036395597 /nfs/dbraw/zinc/39/55/97/1036395597.db2.gz CKVMNJAQTVEDIF-UHFFFAOYSA-N -1 1 320.795 3.637 20 10 DHCDMM Cc1ccc2c(c1)C(=O)N(C)[C@@H](c1cccc(Cl)c1[O-])N2 ZINC000153695772 1037139449 /nfs/dbraw/zinc/13/94/49/1037139449.db2.gz GEHQJUXYGQOWCD-HNNXBMFYSA-N -1 1 302.761 3.550 20 10 DHCDMM CO[C@@H]1Cc2ccc(N[C@H](C)c3cc(F)cc(F)c3[O-])cc2C1 ZINC000760888863 1038976107 /nfs/dbraw/zinc/97/61/07/1038976107.db2.gz ZECOFNIUDQLITO-MEBBXXQBSA-N -1 1 319.351 3.957 20 10 DHCDMM C[C@@H]1CC/C(=C\C(=O)NCc2cccc(Br)c2[O-])C1 ZINC000277655086 130629968 /nfs/dbraw/zinc/62/99/68/130629968.db2.gz ZJJGZJNFUCKNRS-MXBGMFSPSA-N -1 1 324.218 3.517 20 10 DHCDMM CC[C@H]([NH2+]Cc1cc(F)cnc1Cl)c1ccc(F)cc1O ZINC000297300628 132008666 /nfs/dbraw/zinc/00/86/66/132008666.db2.gz MJERQFZFFTVIHD-ZDUSSCGKSA-N -1 1 312.747 3.960 20 10 DHCDMM O=C([O-])CCC1CC[NH+](Cc2ccc3ccccc3c2[O-])CC1 ZINC001595023315 951323379 /nfs/dbraw/zinc/32/33/79/951323379.db2.gz FAAOZDMDBXXBBY-UHFFFAOYSA-N -1 1 313.397 3.622 20 10 DHCDMM C[C@@H]1C[C@@H](c2cccnc2)[N@H+](Cc2cc(F)cc(F)c2O)C1 ZINC000894461199 1013378115 /nfs/dbraw/zinc/37/81/15/1013378115.db2.gz CYURPFHMYNVYSC-BZNIZROVSA-N -1 1 304.340 3.649 20 10 DHCDMM C[C@H]1C[C@@H](c2cccnc2)[N@H+](Cc2cc(F)cc(F)c2O)C1 ZINC000894461201 1013378795 /nfs/dbraw/zinc/37/87/95/1013378795.db2.gz CYURPFHMYNVYSC-ZBEGNZNMSA-N -1 1 304.340 3.649 20 10 DHCDMM O=C1[N-]C(=S)S/C1=C\c1ccc(Cl)c(C(F)(F)F)c1 ZINC000255138875 1013905989 /nfs/dbraw/zinc/90/59/89/1013905989.db2.gz FSPTUHPKJLNXSA-YWEYNIOJSA-N -1 1 323.748 3.848 20 10 DHCDMM CCC[N@@H+](CC)Cc1c(O)ccc(C(=O)c2ccccc2)c1[O-] ZINC000728197624 1012376276 /nfs/dbraw/zinc/37/62/76/1012376276.db2.gz FWIOGSGJIJXKOP-UHFFFAOYSA-N -1 1 313.397 3.561 20 10 DHCDMM CCC[N@H+](CC)Cc1c([O-])ccc(C(=O)c2ccccc2)c1[O-] ZINC000728197624 1012376290 /nfs/dbraw/zinc/37/62/90/1012376290.db2.gz FWIOGSGJIJXKOP-UHFFFAOYSA-N -1 1 313.397 3.561 20 10 DHCDMM CCC[N@@H+](CC)Cc1c([O-])ccc(C(=O)c2ccccc2)c1[O-] ZINC000728197624 1012376306 /nfs/dbraw/zinc/37/63/06/1012376306.db2.gz FWIOGSGJIJXKOP-UHFFFAOYSA-N -1 1 313.397 3.561 20 10 DHCDMM O=C1[N-]C(=S)S/C1=C\c1ccc(Oc2ccccc2)o1 ZINC000182201549 1021536843 /nfs/dbraw/zinc/53/68/43/1021536843.db2.gz XTQMVGHAHKFILE-FLIBITNWSA-N -1 1 303.364 3.561 20 10 DHCDMM CC[C@H](NCc1ncccn1)c1ccc(Cl)c(Cl)c1[O-] ZINC000850553061 1021600267 /nfs/dbraw/zinc/60/02/67/1021600267.db2.gz STNKUILIPFCZJD-NSHDSACASA-N -1 1 312.200 3.730 20 10 DHCDMM CC[C@@H](NCc1ncccn1)c1ccc(Cl)c(Cl)c1[O-] ZINC000850553060 1021600611 /nfs/dbraw/zinc/60/06/11/1021600611.db2.gz STNKUILIPFCZJD-LLVKDONJSA-N -1 1 312.200 3.730 20 10 DHCDMM COCCc1ccccc1NCc1cc(Cl)cc(F)c1[O-] ZINC000786578854 1023707494 /nfs/dbraw/zinc/70/74/94/1023707494.db2.gz JYYZHIODGZDVFC-UHFFFAOYSA-N -1 1 309.768 3.986 20 10 DHCDMM CO[C@H]1CCOc2c(NCc3cc(F)cc(F)c3[O-])cccc21 ZINC000883106079 1024241829 /nfs/dbraw/zinc/24/18/29/1024241829.db2.gz HOCWQYOSRMJCQY-HNNXBMFYSA-N -1 1 321.323 3.753 20 10 DHCDMM [O-]c1ccc(Cl)c(F)c1CNc1ccc(N2CCCC2)cn1 ZINC000790241973 1024250057 /nfs/dbraw/zinc/25/00/57/1024250057.db2.gz BFSCYRJPLZDQQD-UHFFFAOYSA-N -1 1 321.783 3.792 20 10 DHCDMM CCCn1ncc(NCc2cc(F)cc(F)c2[O-])c1C1CC1 ZINC000883133035 1024254030 /nfs/dbraw/zinc/25/40/30/1024254030.db2.gz MXHCSENTVOFLIF-UHFFFAOYSA-N -1 1 307.344 3.766 20 10 DHCDMM Cc1cc2n[nH]cc2cc1NCc1c([O-])ccc(Cl)c1F ZINC000790994631 1024414199 /nfs/dbraw/zinc/41/41/99/1024414199.db2.gz AMWAOOSXLKSRIQ-UHFFFAOYSA-N -1 1 305.740 3.982 20 10 DHCDMM CO[C@@H](C)c1nc(CN[C@H](C)c2c([O-])cccc2F)cs1 ZINC000886536745 1025682740 /nfs/dbraw/zinc/68/27/40/1025682740.db2.gz NXUUMEYTHCJYOK-ZJUUUORDSA-N -1 1 310.394 3.546 20 10 DHCDMM [O-]c1c(Cl)cccc1CN1CCO[C@@H](c2ccccc2)C1 ZINC000271709473 1027125527 /nfs/dbraw/zinc/12/55/27/1027125527.db2.gz AJIZVFSIMDINNQ-MRXNPFEDSA-N -1 1 303.789 3.619 20 10 DHCDMM [O-]c1cc(F)c(Cl)cc1CNc1ccc(N2CCCC2)cn1 ZINC000816537119 1028927299 /nfs/dbraw/zinc/92/72/99/1028927299.db2.gz TXKSZLDUAWDONA-UHFFFAOYSA-N -1 1 321.783 3.792 20 10 DHCDMM COc1ccc(NCc2cc(Cl)c(F)cc2[O-])cc1OC ZINC000816522895 1028932915 /nfs/dbraw/zinc/93/29/15/1028932915.db2.gz SYBMKZORONFRRE-UHFFFAOYSA-N -1 1 311.740 3.814 20 10 DHCDMM COc1cc(NCc2cc(Cl)c(F)cc2[O-])cc(OC)c1 ZINC000816523704 1028933332 /nfs/dbraw/zinc/93/33/32/1028933332.db2.gz BELVFLZMGATLPF-UHFFFAOYSA-N -1 1 311.740 3.814 20 10 DHCDMM COC(=O)c1cccc(NCc2cc(Cl)c(F)cc2[O-])c1 ZINC000816528219 1028935922 /nfs/dbraw/zinc/93/59/22/1028935922.db2.gz RPRFPOFCIGNEIO-UHFFFAOYSA-N -1 1 309.724 3.583 20 10 DHCDMM Cc1n[nH]c(C)c1[C@H]1CCC[N@H+]1Cc1cc(Cl)c(F)cc1[O-] ZINC000293957528 1031720702 /nfs/dbraw/zinc/72/07/02/1031720702.db2.gz PPRANMTYQSCCQQ-CQSZACIVSA-N -1 1 323.799 3.862 20 10 DHCDMM [O-]c1c(Br)cccc1CNc1cnn(C2CCC2)c1 ZINC000897876056 1031862159 /nfs/dbraw/zinc/86/21/59/1031862159.db2.gz MSRRWOPEASAQBQ-UHFFFAOYSA-N -1 1 322.206 3.688 20 10 DHCDMM CN1CCOc2ccc(NCc3cc(Cl)cc(F)c3[O-])cc21 ZINC001178118554 1035408325 /nfs/dbraw/zinc/40/83/25/1035408325.db2.gz KCMDWCGZPLWQJX-UHFFFAOYSA-N -1 1 322.767 3.625 20 10 DHCDMM Cc1cc([C@H]2CCC[N@H+]2Cc2cc(Cl)cc(F)c2[O-])on1 ZINC000775655516 1036257218 /nfs/dbraw/zinc/25/72/18/1036257218.db2.gz GELQLBYCZUHXRQ-CYBMUJFWSA-N -1 1 310.756 3.818 20 10 DHCDMM [O-]c1c(Cl)cc(Cl)cc1C[N@H+]1CCOCC2(CCC2)C1 ZINC000761225663 1040809300 /nfs/dbraw/zinc/80/93/00/1040809300.db2.gz KJTWWPPHRIKYIP-UHFFFAOYSA-N -1 1 316.228 3.702 20 10 DHCDMM [O-]c1c(Cl)cc(Cl)cc1CN1CCOCC2(CCC2)C1 ZINC000761225663 1040809313 /nfs/dbraw/zinc/80/93/13/1040809313.db2.gz KJTWWPPHRIKYIP-UHFFFAOYSA-N -1 1 316.228 3.702 20 10 DHCDMM COc1cc(Cl)cc(C[N@H+]2CC=C(C(F)(F)F)CC2)c1O ZINC000273789799 130167407 /nfs/dbraw/zinc/16/74/07/130167407.db2.gz UYZFDNJEQADSMB-UHFFFAOYSA-N -1 1 321.726 3.749 20 10 DHCDMM Cc1cccc([C@@H]([NH2+]Cc2cc(Cl)c(C)cc2[O-])C(=O)[O-])c1 ZINC001594397106 958777047 /nfs/dbraw/zinc/77/70/47/958777047.db2.gz FICWEZLOHBCKLI-MRXNPFEDSA-N -1 1 319.788 3.578 20 10 DHCDMM CCCCS[C@H](C)C(=O)NCc1cccc(Cl)c1[O-] ZINC000890757504 1013328506 /nfs/dbraw/zinc/32/85/06/1013328506.db2.gz GCRFGFDBTNWJKL-SNVBAGLBSA-N -1 1 301.839 3.584 20 10 DHCDMM C[C@]1(C(=O)NCc2cccc(Cl)c2[O-])C[C@@H]1c1ccccc1 ZINC000890761710 1013337255 /nfs/dbraw/zinc/33/72/55/1013337255.db2.gz WADJSXQQONUCSX-KDOFPFPSSA-N -1 1 315.800 3.856 20 10 DHCDMM CC(C)(CNC(=O)NCc1cccc(Cl)c1[O-])C(C)(F)F ZINC000896223835 1015505844 /nfs/dbraw/zinc/50/58/44/1015505844.db2.gz UVLUNOTUPUMERZ-UHFFFAOYSA-N -1 1 320.767 3.526 20 10 DHCDMM CC(C)C[C@@H](C)C[N@H+](CC(=O)[O-])Cc1cc(Cl)ccc1[O-] ZINC001591134241 991838702 /nfs/dbraw/zinc/83/87/02/991838702.db2.gz QTMCXJFLYKVRCB-GFCCVEGCSA-N -1 1 313.825 3.614 20 10 DHCDMM CC(C)C[C@@H](C)C[N@@H+](CC(=O)[O-])Cc1cc(Cl)ccc1[O-] ZINC001591134241 991838710 /nfs/dbraw/zinc/83/87/10/991838710.db2.gz QTMCXJFLYKVRCB-GFCCVEGCSA-N -1 1 313.825 3.614 20 10 DHCDMM CC(=O)c1cc(Cl)cc(CN2Cc3ccccc3C2)c1[O-] ZINC000050911608 1018244935 /nfs/dbraw/zinc/24/49/35/1018244935.db2.gz TYQBTVHFVFGIGN-UHFFFAOYSA-N -1 1 301.773 3.764 20 10 DHCDMM CCC/C(C)=C/C(=O)NCc1cccc(Br)c1[O-] ZINC000765732113 1019081409 /nfs/dbraw/zinc/08/14/09/1019081409.db2.gz PULNCJJFPFHKBE-CSKARUKUSA-N -1 1 312.207 3.517 20 10 DHCDMM CCN1C(=O)c2ccccc2N[C@@H]1c1cc(Cl)cc(F)c1[O-] ZINC000768266545 1022936421 /nfs/dbraw/zinc/93/64/21/1022936421.db2.gz SGPCOOOGXLILFZ-HNNXBMFYSA-N -1 1 320.751 3.771 20 10 DHCDMM O=[N+]([O-])c1cc(Cl)cc(CN2CCc3ccsc3C2)c1[O-] ZINC000769431516 1023148352 /nfs/dbraw/zinc/14/83/52/1023148352.db2.gz AQHSKFIGWDYXCB-UHFFFAOYSA-N -1 1 324.789 3.574 20 10 DHCDMM COc1cc(NCc2cc(F)cc(F)c2[O-])cc(OC)c1C ZINC000883129904 1024251622 /nfs/dbraw/zinc/25/16/22/1024251622.db2.gz JMBDPFPTRVLKMW-UHFFFAOYSA-N -1 1 309.312 3.608 20 10 DHCDMM C[C@@H](c1ccco1)N(C)Cc1cc(Cl)cc([N+](=O)[O-])c1[O-] ZINC000131062053 1024254437 /nfs/dbraw/zinc/25/44/37/1024254437.db2.gz DQUZONUMJHSDMZ-VIFPVBQESA-N -1 1 310.737 3.740 20 10 DHCDMM COC(=O)Nc1cccc(NCc2c([O-])ccc(Cl)c2F)c1 ZINC000790953330 1024405222 /nfs/dbraw/zinc/40/52/22/1024405222.db2.gz SGYWTSPMBGZNGM-UHFFFAOYSA-N -1 1 324.739 3.975 20 10 DHCDMM [O-]c1ccc(Cl)c(F)c1CNc1ccn(-c2ccccc2)n1 ZINC000790976853 1024421909 /nfs/dbraw/zinc/42/19/09/1024421909.db2.gz NDTJVCVZFAFZJU-UHFFFAOYSA-N -1 1 317.751 3.983 20 10 DHCDMM CCC(CC)c1cc(CNCc2ccc(F)c(F)c2[O-])on1 ZINC000877062918 1033221529 /nfs/dbraw/zinc/22/15/29/1033221529.db2.gz FKDJCGKXNTYHFI-UHFFFAOYSA-N -1 1 310.344 3.852 20 10 DHCDMM COc1cc2ccccc2cc1NCC(=O)c1ccc([O-])c(O)c1 ZINC001170323294 1024740877 /nfs/dbraw/zinc/74/08/77/1024740877.db2.gz VXEWYFVUDHWJJK-UHFFFAOYSA-N -1 1 323.348 3.554 20 10 DHCDMM [O-]c1ccc(Cl)c(F)c1CNc1ccc(C(F)(F)F)nn1 ZINC000811838399 1027095959 /nfs/dbraw/zinc/09/59/59/1027095959.db2.gz HBRHGTVACONSFJ-UHFFFAOYSA-N -1 1 321.661 3.606 20 10 DHCDMM COc1ccc(NCc2cc(Cl)c(F)cc2[O-])c(OC)c1 ZINC000816522333 1028933050 /nfs/dbraw/zinc/93/30/50/1028933050.db2.gz UPUHTABEZVBHLW-UHFFFAOYSA-N -1 1 311.740 3.814 20 10 DHCDMM COc1cc(NCc2cccc(Cl)c2[O-])cc(OC)c1C ZINC000816620258 1028968599 /nfs/dbraw/zinc/96/85/99/1028968599.db2.gz NYCRGKCDBAMQAK-UHFFFAOYSA-N -1 1 307.777 3.983 20 10 DHCDMM C[C@H]1C[N@H+](Cc2cc(Br)c(F)cc2O)C2(CC2)C1 ZINC001144308128 1031458768 /nfs/dbraw/zinc/45/87/68/1031458768.db2.gz QOZNOZJSTNWCON-SECBINFHSA-N -1 1 314.198 3.668 20 10 DHCDMM CCN1C(=O)c2ccccc2N[C@H]1c1cc(Cl)c(F)cc1[O-] ZINC000877846915 1033484299 /nfs/dbraw/zinc/48/42/99/1033484299.db2.gz KFRLCGWIAYQSML-OAHLLOKOSA-N -1 1 320.751 3.771 20 10 DHCDMM COCc1ccc(NCc2cccc(Cl)c2[O-])cc1OC ZINC000862536765 1033879276 /nfs/dbraw/zinc/87/92/76/1033879276.db2.gz MTFKTXFOGSQDCA-UHFFFAOYSA-N -1 1 307.777 3.813 20 10 DHCDMM C[C@H]1CN(C(=O)c2ccc(O)c([O-])c2Cl)Cc2ccccc21 ZINC001193219557 1035589129 /nfs/dbraw/zinc/58/91/29/1035589129.db2.gz KOHAQBNUGRBRMB-JTQLQIEISA-N -1 1 317.772 3.511 20 10 DHCDMM CN(Cc1ccc(Cl)nc1)Cc1cc(Cl)cc(F)c1[O-] ZINC000775648060 1036187808 /nfs/dbraw/zinc/18/78/08/1036187808.db2.gz OQEQOLUWXWOCJF-UHFFFAOYSA-N -1 1 315.175 3.865 20 10 DHCDMM COc1ccc(OC)c(NCc2cc(Cl)cc(F)c2[O-])c1 ZINC000775749288 1036642366 /nfs/dbraw/zinc/64/23/66/1036642366.db2.gz GFMRXJYIAZYZBF-UHFFFAOYSA-N -1 1 311.740 3.814 20 10 DHCDMM [O-]c1c(Cl)cccc1CNCc1c(Cl)ccnc1F ZINC001184265133 1036790298 /nfs/dbraw/zinc/79/02/98/1036790298.db2.gz POXRWBTYEAUKTN-UHFFFAOYSA-N -1 1 301.148 3.523 20 10 DHCDMM [O-]c1c(Cl)cccc1CNc1ccc(N2CCCC2)cn1 ZINC000776036213 1037371977 /nfs/dbraw/zinc/37/19/77/1037371977.db2.gz DAOUAVWRFXRYTA-UHFFFAOYSA-N -1 1 303.793 3.653 20 10 DHCDMM C[C@@H](NC(=O)c1c([O-])cccc1Cl)c1ccc(N(C)C)cc1 ZINC000775405045 1038371771 /nfs/dbraw/zinc/37/17/71/1038371771.db2.gz QBCMDJRUKPUCJG-LLVKDONJSA-N -1 1 318.804 3.603 20 10 DHCDMM CC[C@H](NCc1ccon1)c1ccc(Cl)c(Cl)c1[O-] ZINC000775513299 1038604940 /nfs/dbraw/zinc/60/49/40/1038604940.db2.gz WCAWICUVBWQYKV-NSHDSACASA-N -1 1 301.173 3.928 20 10 DHCDMM Cc1cnc(CNCc2cc(Cl)cc(Cl)c2[O-])s1 ZINC000230687263 1039961235 /nfs/dbraw/zinc/96/12/35/1039961235.db2.gz QKBPICLSAYIYFM-UHFFFAOYSA-N -1 1 303.214 3.754 20 10 DHCDMM C[C@@H](N[C@@H](C)c1ccc(F)c(F)c1[O-])c1c(F)cncc1F ZINC000285755839 131199938 /nfs/dbraw/zinc/19/99/38/131199938.db2.gz SHMJPURPUWBYSZ-JGVFFNPUSA-N -1 1 314.282 3.755 20 10 DHCDMM [O-]c1cc(F)c(Cl)cc1CNc1ccc(OC2COC2)cc1 ZINC000294551121 1032058305 /nfs/dbraw/zinc/05/83/05/1032058305.db2.gz FHKNIJDYVBWJJJ-UHFFFAOYSA-N -1 1 323.751 3.574 20 10 DHCDMM Cc1cc([O-])c(C[NH2+]C[C@H](CC(=O)[O-])CC(C)C)c(Cl)c1 ZINC001574343209 960948958 /nfs/dbraw/zinc/94/89/58/960948958.db2.gz JEXXHMOKDWFQNA-LBPRGKRZSA-N -1 1 313.825 3.581 20 10 DHCDMM O=C(NCc1cccc(Cl)c1[O-])[C@@H]1CCCc2sccc21 ZINC000890759640 1013334778 /nfs/dbraw/zinc/33/47/78/1013334778.db2.gz FTFBMMIIQXTACR-GFCCVEGCSA-N -1 1 321.829 3.843 20 10 DHCDMM O=C(NCc1cccc(Cl)c1[O-])[C@@H]1C[C@H]1c1ccsc1 ZINC000890763617 1013345669 /nfs/dbraw/zinc/34/56/69/1013345669.db2.gz YZJSISWFDASFRZ-NWDGAFQWSA-N -1 1 307.802 3.527 20 10 DHCDMM C[C@H]1C[C@H](c2cccnc2)[N@H+](Cc2cc(F)cc(F)c2O)C1 ZINC000894461200 1013377658 /nfs/dbraw/zinc/37/76/58/1013377658.db2.gz CYURPFHMYNVYSC-MEDUHNTESA-N -1 1 304.340 3.649 20 10 DHCDMM CC[C@@H](c1ccccc1)[N@@H+](CC(=O)[O-])Cc1cccc(F)c1[O-] ZINC001595362576 980772713 /nfs/dbraw/zinc/77/27/13/980772713.db2.gz KKGVIGMCAIXOPC-INIZCTEOSA-N -1 1 317.360 3.569 20 10 DHCDMM CSc1cc(O)ccc1[N-]S(=O)(=O)c1cc(C)ccc1C ZINC000192155828 1014683672 /nfs/dbraw/zinc/68/36/72/1014683672.db2.gz BBFFVZOJXFSOJT-UHFFFAOYSA-N -1 1 323.439 3.532 20 10 DHCDMM Cn1nccc1[C@H]1CCCC[N@H+]1Cc1cccc(Cl)c1[O-] ZINC000281223241 1016403892 /nfs/dbraw/zinc/40/38/92/1016403892.db2.gz KLQKCTHNPRECFY-OAHLLOKOSA-N -1 1 305.809 3.506 20 10 DHCDMM C[C@H](Cc1ccsc1)NC(=O)NCc1cccc(Cl)c1[O-] ZINC000892233064 1016535232 /nfs/dbraw/zinc/53/52/32/1016535232.db2.gz OBLADOCVKZXELE-SNVBAGLBSA-N -1 1 324.833 3.538 20 10 DHCDMM [O-]c1c(Br)cccc1CNc1ccc2c(c1)CCO2 ZINC000048796581 1016758943 /nfs/dbraw/zinc/75/89/43/1016758943.db2.gz UCFGRKHLYWKXKC-UHFFFAOYSA-N -1 1 320.186 3.702 20 10 DHCDMM O=C(CSc1ccc2c(c1)CCC2)c1ccc([O-])c(O)c1 ZINC000035044975 1011977360 /nfs/dbraw/zinc/97/73/60/1011977360.db2.gz NLGJYIGCOCLKBD-UHFFFAOYSA-N -1 1 300.379 3.562 20 10 DHCDMM C[C@H](N[C@@H](C)c1cccc(C(F)(F)F)c1[O-])c1csnn1 ZINC000840885685 1017358337 /nfs/dbraw/zinc/35/83/37/1017358337.db2.gz FPHYROULVSTEJS-YUMQZZPRSA-N -1 1 317.336 3.674 20 10 DHCDMM [O-]c1cccc(F)c1CN1CCOC[C@H]1c1ccc(Cl)cc1 ZINC001137839492 1018752871 /nfs/dbraw/zinc/75/28/71/1018752871.db2.gz ACQVHHKVURXOEC-INIZCTEOSA-N -1 1 321.779 3.758 20 10 DHCDMM CCNC(=O)c1ccc(NCc2c([O-])ccc(Cl)c2F)cc1 ZINC000195105636 1023212554 /nfs/dbraw/zinc/21/25/54/1023212554.db2.gz UQRTZKSYKPKTPM-UHFFFAOYSA-N -1 1 322.767 3.547 20 10 DHCDMM O=C1c2ccccc2N[C@@H](c2cccc(Cl)c2[O-])N1C1CC1 ZINC000124696650 1023350695 /nfs/dbraw/zinc/35/06/95/1023350695.db2.gz UQAQFEHBUUZPGM-MRXNPFEDSA-N -1 1 314.772 3.775 20 10 DHCDMM CN1C(=O)c2cc(Cl)ccc2N[C@@H]1c1cccc(Cl)c1[O-] ZINC000124738739 1023352452 /nfs/dbraw/zinc/35/24/52/1023352452.db2.gz ZGIPZZUBZBJYMI-AWEZNQCLSA-N -1 1 323.179 3.895 20 10 DHCDMM Cc1ccc2c(c1C)OC[C@@H]2[NH2+]Cc1cc(F)cc(F)c1O ZINC000882986598 1024192951 /nfs/dbraw/zinc/19/29/51/1024192951.db2.gz DHOWPAARXACBKA-HNNXBMFYSA-N -1 1 305.324 3.511 20 10 DHCDMM CCCc1nnc(NCc2c([O-])ccc(Cl)c2F)s1 ZINC000790243842 1024250674 /nfs/dbraw/zinc/25/06/74/1024250674.db2.gz VLVJIGDPCQRTMG-UHFFFAOYSA-N -1 1 301.774 3.601 20 10 DHCDMM Cc1cc2c(cc1NCc1c([O-])ccc(Cl)c1F)OCO2 ZINC000790991295 1024413933 /nfs/dbraw/zinc/41/39/33/1024413933.db2.gz UACRCJWZNQYJBD-UHFFFAOYSA-N -1 1 309.724 3.834 20 10 DHCDMM C[S@@](=O)c1cccc(NCc2c([O-])ccc(Cl)c2F)c1 ZINC000790980896 1024423553 /nfs/dbraw/zinc/42/35/53/1024423553.db2.gz GHIZADLUWOVICW-HXUWFJFHSA-N -1 1 313.781 3.534 20 10 DHCDMM CN(C)c1ccccc1NCc1cccc(Br)c1[O-] ZINC000058624916 1024942235 /nfs/dbraw/zinc/94/22/35/1024942235.db2.gz FTRVIEQOSJVFTO-UHFFFAOYSA-N -1 1 321.218 3.833 20 10 DHCDMM Cn1nccc1[C@H]1CCCC[N@H+]1Cc1cc(Cl)ccc1O ZINC000370201386 1028578061 /nfs/dbraw/zinc/57/80/61/1028578061.db2.gz KASANPPMLMCUSM-OAHLLOKOSA-N -1 1 305.809 3.506 20 10 DHCDMM [O-]c1cc(F)c(Cl)cc1CNc1cccc(-n2ccnc2)c1 ZINC000816479078 1028888626 /nfs/dbraw/zinc/88/86/26/1028888626.db2.gz BOUMLVUTUXZQET-UHFFFAOYSA-N -1 1 317.751 3.983 20 10 DHCDMM O=C(/C=C\C1CCCC1)NCc1cccc(Br)c1[O-] ZINC000843866127 1030871042 /nfs/dbraw/zinc/87/10/42/1030871042.db2.gz DGQXGKWPNRTPOX-HJWRWDBZSA-N -1 1 324.218 3.517 20 10 DHCDMM [O-]c1ccc(Cl)cc1C[NH2+]Cc1cc(Cl)cc(F)c1[O-] ZINC001308845773 1031523699 /nfs/dbraw/zinc/52/36/99/1031523699.db2.gz LRGGFSGOXSBBOZ-UHFFFAOYSA-N -1 1 316.159 3.834 20 10 DHCDMM [O-]c1cc(F)c(F)cc1CN1CCc2cc(Cl)ccc2C1 ZINC001142524867 1031858923 /nfs/dbraw/zinc/85/89/23/1031858923.db2.gz NSINGCLANXNAQM-UHFFFAOYSA-N -1 1 309.743 3.882 20 10 DHCDMM CC[C@H]1CN(Cc2cc(F)cc(F)c2[O-])c2ccccc2O1 ZINC001181074474 1035838732 /nfs/dbraw/zinc/83/87/32/1035838732.db2.gz TZMZAVXQKJAMFS-ZDUSSCGKSA-N -1 1 305.324 3.848 20 10 DHCDMM C[C@@H](NCc1cc([N+](=O)[O-])ccc1[O-])c1c(F)cccc1Cl ZINC001200949494 1037487268 /nfs/dbraw/zinc/48/72/68/1037487268.db2.gz BMOANVZIVGISBH-SECBINFHSA-N -1 1 324.739 3.944 20 10 DHCDMM Cc1cc(F)cc(S(=O)(=O)[N-]c2cc(C)c(O)c(C)c2C)c1 ZINC000775291136 1038194809 /nfs/dbraw/zinc/19/48/09/1038194809.db2.gz AIIAPAJQMMAOPP-UHFFFAOYSA-N -1 1 323.389 3.566 20 10 DHCDMM Cc1cc([N-]S(=O)(=O)c2cccc(F)c2C)c(C)c(C)c1O ZINC000775294438 1038196625 /nfs/dbraw/zinc/19/66/25/1038196625.db2.gz NUXWYCRBAWSSFO-UHFFFAOYSA-N -1 1 323.389 3.566 20 10 DHCDMM CO[C@H]1Cc2ccc(N[C@H](C)c3cc(F)cc(F)c3[O-])cc2C1 ZINC000760888861 1038974167 /nfs/dbraw/zinc/97/41/67/1038974167.db2.gz ZECOFNIUDQLITO-BMIGLBTASA-N -1 1 319.351 3.957 20 10 DHCDMM [O-]c1c(Cl)cccc1CNc1ccc(Br)nc1 ZINC000226664997 1039770857 /nfs/dbraw/zinc/77/08/57/1039770857.db2.gz PNYXSRGUZWAGOM-UHFFFAOYSA-N -1 1 313.582 3.815 20 10 DHCDMM CC(=O)Nc1cc(NCc2cccc(Cl)c2[O-])ccc1F ZINC000158052072 1039775267 /nfs/dbraw/zinc/77/52/67/1039775267.db2.gz PPWBLPKAKDLLRF-UHFFFAOYSA-N -1 1 308.740 3.755 20 10 DHCDMM CCN(CC)c1ccc(NCc2cccc(Cl)c2[O-])cn1 ZINC000158139419 1040057559 /nfs/dbraw/zinc/05/75/59/1040057559.db2.gz NMLXQPAJPRYLQF-UHFFFAOYSA-N -1 1 305.809 3.899 20 10 DHCDMM O=C1N[C@@H](c2cccc(Cl)c2[O-])Nc2cccc(Cl)c21 ZINC000172863236 1040064061 /nfs/dbraw/zinc/06/40/61/1040064061.db2.gz MUNKNQFHSCWZFJ-ZDUSSCGKSA-N -1 1 309.152 3.553 20 10 DHCDMM O=C1N=C(N2CCCCC2)S/C1=C\c1cccc([O-])c1Cl ZINC000295770628 335137952 /nfs/dbraw/zinc/13/79/52/335137952.db2.gz BTBBJDZAXYAVGU-XFXZXTDPSA-N -1 1 322.817 3.502 20 10 DHCDMM CC[N@H+](CCC(=O)[O-])Cc1cc2oc3ccccc3c2cc1[O-] ZINC000737096196 600423122 /nfs/dbraw/zinc/42/31/22/600423122.db2.gz LNICQOPNEWAQEV-UHFFFAOYSA-N -1 1 313.353 3.588 20 10 DHCDMM CC[N@@H+](CCC(=O)[O-])Cc1cc2oc3ccccc3c2cc1[O-] ZINC000737096196 600423125 /nfs/dbraw/zinc/42/31/25/600423125.db2.gz LNICQOPNEWAQEV-UHFFFAOYSA-N -1 1 313.353 3.588 20 10 DHCDMM CC(C)(C)c1cnc(SCc2ccc(-c3nnn[n-]3)o2)s1 ZINC001573884219 950790210 /nfs/dbraw/zinc/79/02/10/950790210.db2.gz LODNHBLAZXQCJF-UHFFFAOYSA-N -1 1 321.431 3.506 20 10 DHCDMM CC(C)(C)c1cnc(SCc2ccc(-c3nn[n-]n3)o2)s1 ZINC001573884219 950790225 /nfs/dbraw/zinc/79/02/25/950790225.db2.gz LODNHBLAZXQCJF-UHFFFAOYSA-N -1 1 321.431 3.506 20 10 DHCDMM CC(C)C[C@H](C)OCCC(=O)NCc1cccc(Cl)c1[O-] ZINC000890760349 1013333453 /nfs/dbraw/zinc/33/34/53/1013333453.db2.gz PALFRUMICPVXBZ-LBPRGKRZSA-N -1 1 313.825 3.503 20 10 DHCDMM O=C(NCc1cccc(Cl)c1[O-])[C@H]1CCCc2sccc21 ZINC000890759641 1013333818 /nfs/dbraw/zinc/33/38/18/1013333818.db2.gz FTFBMMIIQXTACR-LBPRGKRZSA-N -1 1 321.829 3.843 20 10 DHCDMM O=C(NCc1cccc(Cl)c1[O-])[C@@H]1CC[C@@H](C(F)(F)F)C1 ZINC000890759932 1013334589 /nfs/dbraw/zinc/33/45/89/1013334589.db2.gz WGCGUDVGDOTBEM-PSASIEDQSA-N -1 1 321.726 3.640 20 10 DHCDMM CC(=O)CCCCCCC(=O)NCc1cccc(Cl)c1[O-] ZINC000890760803 1013335653 /nfs/dbraw/zinc/33/56/53/1013335653.db2.gz ZINPGDMNXOGNRV-UHFFFAOYSA-N -1 1 311.809 3.591 20 10 DHCDMM O=C(CC[C@H]1CC1(Cl)Cl)NCc1cccc(Cl)c1[O-] ZINC000890761165 1013336443 /nfs/dbraw/zinc/33/64/43/1013336443.db2.gz MPSAIZPHDPSZGC-VIFPVBQESA-N -1 1 322.619 3.636 20 10 DHCDMM C[C@]1(CC(=O)NCc2cccc(Cl)c2[O-])CC1(Cl)Cl ZINC000890761652 1013337953 /nfs/dbraw/zinc/33/79/53/1013337953.db2.gz VHDXPVNXZPFNFY-LBPRGKRZSA-N -1 1 322.619 3.636 20 10 DHCDMM CC[C@H](CC(F)(F)F)C(=O)NCc1cccc(Cl)c1[O-] ZINC000890761512 1013339207 /nfs/dbraw/zinc/33/92/07/1013339207.db2.gz UMPNXPPUWSAJFG-MRVPVSSYSA-N -1 1 309.715 3.640 20 10 DHCDMM CC(=O)c1cc(Cl)cc(CN2CCc3sccc3C2)c1[O-] ZINC000050132357 1017117073 /nfs/dbraw/zinc/11/70/73/1017117073.db2.gz OYHUDZXLZQXVMU-UHFFFAOYSA-N -1 1 321.829 3.868 20 10 DHCDMM CC(C)(C)CCC(=O)NCc1cccc(Br)c1[O-] ZINC000277577942 1016696581 /nfs/dbraw/zinc/69/65/81/1016696581.db2.gz RFGQPQXJJIATIT-UHFFFAOYSA-N -1 1 314.223 3.597 20 10 DHCDMM COc1ccccc1[C@@H](C)[N@@H+](C)Cc1c([O-])cc(F)cc1F ZINC001140584044 1017195847 /nfs/dbraw/zinc/19/58/47/1017195847.db2.gz DRBOANJMNIEMIQ-LLVKDONJSA-N -1 1 307.340 3.872 20 10 DHCDMM CCC[C@H](C)CC(=O)NCc1cccc(Br)c1[O-] ZINC000765737734 1019101257 /nfs/dbraw/zinc/10/12/57/1019101257.db2.gz YABOWKQCOQFSAZ-JTQLQIEISA-N -1 1 314.223 3.597 20 10 DHCDMM CCC(F)(F)CNCc1cc(C)cc(Br)c1[O-] ZINC000858259471 1032822518 /nfs/dbraw/zinc/82/25/18/1032822518.db2.gz UBHGCLPKFHNLHL-UHFFFAOYSA-N -1 1 308.166 3.598 20 10 DHCDMM [O-]c1ccc(Cl)c(Cl)c1CN1CCc2ncsc2C1 ZINC001237084805 1021669405 /nfs/dbraw/zinc/66/94/05/1021669405.db2.gz NPTWUFIPIDMCOY-UHFFFAOYSA-N -1 1 315.225 3.714 20 10 DHCDMM [O-]c1c(Cl)cccc1CNCc1c(F)cc(F)c(F)c1F ZINC000797606078 1022355415 /nfs/dbraw/zinc/35/54/15/1022355415.db2.gz ZLUNNVYBNZLMBU-UHFFFAOYSA-N -1 1 319.685 3.892 20 10 DHCDMM CCN1C(=O)c2ccccc2N[C@H]1c1cc(Cl)cc(F)c1[O-] ZINC000768266546 1022936927 /nfs/dbraw/zinc/93/69/27/1022936927.db2.gz SGPCOOOGXLILFZ-OAHLLOKOSA-N -1 1 320.751 3.771 20 10 DHCDMM [O-]c1cc(Cl)c(F)cc1CN1CC2(C1)CC(F)(F)CS2 ZINC001237949423 1023026824 /nfs/dbraw/zinc/02/68/24/1023026824.db2.gz LNKLKEJQJIYNDM-UHFFFAOYSA-N -1 1 323.767 3.511 20 10 DHCDMM CN1C(=O)c2ccc(Cl)cc2N[C@@H]1c1cccc(Cl)c1[O-] ZINC000124749703 1023351685 /nfs/dbraw/zinc/35/16/85/1023351685.db2.gz LTMQAQJKDOHIPQ-AWEZNQCLSA-N -1 1 323.179 3.895 20 10 DHCDMM COc1cc(NCc2cc(F)cc(F)c2[O-])c(C)c(OC)c1 ZINC000883112699 1024246245 /nfs/dbraw/zinc/24/62/45/1024246245.db2.gz URCNSIDANQZNDQ-UHFFFAOYSA-N -1 1 309.312 3.608 20 10 DHCDMM COc1ccc(NCC(=O)c2ccc([O-])c(O)c2)cc1C(C)C ZINC001170320963 1024740930 /nfs/dbraw/zinc/74/09/30/1024740930.db2.gz SBBOLHLXMOGXTI-UHFFFAOYSA-N -1 1 315.369 3.525 20 10 DHCDMM C[C@@H](NCc1cc(Cl)cc(F)c1[O-])c1c(F)cncc1F ZINC000809715389 1026601973 /nfs/dbraw/zinc/60/19/73/1026601973.db2.gz ASGQSZLKDLGWRO-SSDOTTSWSA-N -1 1 316.710 3.709 20 10 DHCDMM O=C1CCN(Cc2c([O-])ccc(Cl)c2F)c2ccccc2N1 ZINC000811508444 1027024701 /nfs/dbraw/zinc/02/47/01/1027024701.db2.gz QIGQABLXQMVQBC-UHFFFAOYSA-N -1 1 320.751 3.534 20 10 DHCDMM O=C(NCc1cccc(Cl)c1[O-])Nc1ncsc1C1CC1 ZINC000932418350 1027489614 /nfs/dbraw/zinc/48/96/14/1027489614.db2.gz NZZFVLPVLRHHQK-UHFFFAOYSA-N -1 1 323.805 3.701 20 10 DHCDMM O=[N+]([O-])c1ccccc1NCc1cccc(Br)c1[O-] ZINC000048796222 1028252161 /nfs/dbraw/zinc/25/21/61/1028252161.db2.gz SXIKFZGUSWMTPO-UHFFFAOYSA-N -1 1 323.146 3.675 20 10 DHCDMM CCCN1C(=O)c2ccccc2N[C@H]1c1cccc(F)c1[O-] ZINC000778519204 1028678091 /nfs/dbraw/zinc/67/80/91/1028678091.db2.gz GIHRGPBVSNDJJN-MRXNPFEDSA-N -1 1 300.333 3.508 20 10 DHCDMM CCNC(=O)c1cccc(NCc2cc(Cl)c(F)cc2[O-])c1 ZINC000816524981 1028933848 /nfs/dbraw/zinc/93/38/48/1028933848.db2.gz ZOVVTYUCNQHZFX-UHFFFAOYSA-N -1 1 322.767 3.547 20 10 DHCDMM Cc1cc(O)c(C[N@H+]2CCO[C@H](c3cccs3)C2)cc1Cl ZINC000824632663 1030597711 /nfs/dbraw/zinc/59/77/11/1030597711.db2.gz PECNYYBMTZXQMC-HNNXBMFYSA-N -1 1 323.845 3.989 20 10 DHCDMM CC[C@H](NCc1nonc1C)c1ccc(Cl)c(Cl)c1[O-] ZINC000872138076 1031529826 /nfs/dbraw/zinc/52/98/26/1031529826.db2.gz ZMZZDAJZLJPRFQ-JTQLQIEISA-N -1 1 316.188 3.631 20 10 DHCDMM CCN(Cc1ccc(N(C)C)cc1)Cc1c(F)cc([O-])cc1F ZINC001144560936 1031713995 /nfs/dbraw/zinc/71/39/95/1031713995.db2.gz COORXTACJYVPNJ-UHFFFAOYSA-N -1 1 320.383 3.759 20 10 DHCDMM COCc1cc(NCc2cccc(Cl)c2[O-])ccc1OC ZINC000877702767 1033418899 /nfs/dbraw/zinc/41/88/99/1033418899.db2.gz HCVGNANAUFUTIA-UHFFFAOYSA-N -1 1 307.777 3.813 20 10 DHCDMM O=C(Nc1cc(C2CCCC2)no1)c1ccc(O)c([O-])c1Cl ZINC001193209457 1035585765 /nfs/dbraw/zinc/58/57/65/1035585765.db2.gz KPZZOKCQOXLDIB-UHFFFAOYSA-N -1 1 322.748 3.649 20 10 DHCDMM O=C(N[C@@H]1CCCc2ccccc21)c1ccc(O)c([O-])c1Cl ZINC001193209178 1035586676 /nfs/dbraw/zinc/58/66/76/1035586676.db2.gz GACQEKUKUSAUFV-CYBMUJFWSA-N -1 1 317.772 3.559 20 10 DHCDMM C[C@H]1C[C@H](NC(=O)c2ccc(O)c([O-])c2Cl)CC(C)(C)C1 ZINC001193236493 1035592400 /nfs/dbraw/zinc/59/24/00/1035592400.db2.gz FLMBFDPZMBOSTB-UWVGGRQHSA-N -1 1 311.809 3.696 20 10 DHCDMM Cc1ccccc1C(C)(C)NC(=O)c1ccc(O)c([O-])c1Cl ZINC001193247328 1035594422 /nfs/dbraw/zinc/59/44/22/1035594422.db2.gz VARUBMITVXPVQO-UHFFFAOYSA-N -1 1 319.788 3.725 20 10 DHCDMM O=C(NCc1cccc(Cl)c1[O-])c1nc2ccccc2s1 ZINC001180409580 1035674773 /nfs/dbraw/zinc/67/47/73/1035674773.db2.gz CXJGUHDDOMDOFX-UHFFFAOYSA-N -1 1 318.785 3.585 20 10 DHCDMM Cc1ccc(C(=O)NCc2cccc(Cl)c2[O-])c2c1CCC2 ZINC001180410928 1035677620 /nfs/dbraw/zinc/67/76/20/1035677620.db2.gz VNUMEOCMZXTMJB-UHFFFAOYSA-N -1 1 315.800 3.773 20 10 DHCDMM [O-]c1c(Br)cccc1CNc1cccc(Cl)n1 ZINC000149711078 1036522559 /nfs/dbraw/zinc/52/25/59/1036522559.db2.gz AUQGPRJJVCVNOX-UHFFFAOYSA-N -1 1 313.582 3.815 20 10 DHCDMM CCC[C@H]1CCCC[C@@H]1CNC(=O)c1c(F)ccc(O)c1[O-] ZINC001183694935 1036651513 /nfs/dbraw/zinc/65/15/13/1036651513.db2.gz SVFUSSPOZMIGJY-NWDGAFQWSA-N -1 1 309.381 3.573 20 10 DHCDMM CC(C)Oc1cccnc1NCc1cc(Cl)cc(F)c1[O-] ZINC001202031041 1038006944 /nfs/dbraw/zinc/00/69/44/1038006944.db2.gz BWOCQTPBLUMKCD-UHFFFAOYSA-N -1 1 310.756 3.979 20 10 DHCDMM COCCOc1cccc(NCc2cccc(Cl)c2[O-])c1 ZINC000158047273 1039779611 /nfs/dbraw/zinc/77/96/11/1039779611.db2.gz NHOPEOKYWAQAQL-UHFFFAOYSA-N -1 1 307.777 3.683 20 10 DHCDMM C[C@H](c1ccccn1)N(C)Cc1cc(Cl)cc([N+](=O)[O-])c1[O-] ZINC000182067326 526123724 /nfs/dbraw/zinc/12/37/24/526123724.db2.gz RNRHUBQDUMZJBF-SNVBAGLBSA-N -1 1 321.764 3.542 20 10 DHCDMM CC(C)c1scnc1C(=O)NCc1cccc(Cl)c1[O-] ZINC000890759844 1013333364 /nfs/dbraw/zinc/33/33/64/1013333364.db2.gz SBRILBBBYWACLO-UHFFFAOYSA-N -1 1 310.806 3.556 20 10 DHCDMM C[C@H]1C(=O)CC[N@H+](Cc2c(O)cccc2Cl)C12CCCC2 ZINC001140342371 1014639815 /nfs/dbraw/zinc/63/98/15/1014639815.db2.gz GSZHOKVGTLRAKY-LBPRGKRZSA-N -1 1 307.821 3.769 20 10 DHCDMM CN(C)c1ccc2c(c1)OCCN2Cc1cccc(Cl)c1[O-] ZINC000765657455 1019028043 /nfs/dbraw/zinc/02/80/43/1019028043.db2.gz JJJAVYJONLPGNK-UHFFFAOYSA-N -1 1 318.804 3.511 20 10 DHCDMM [O-]c1c(F)cc(Cl)cc1CNc1cccc2c1OCC[C@H]2O ZINC000768528750 1022980949 /nfs/dbraw/zinc/98/09/49/1022980949.db2.gz HJMRNAJMCKQAFC-CQSZACIVSA-N -1 1 323.751 3.613 20 10 DHCDMM [O-]c1c(F)cc(Cl)cc1CNc1cccc2c1OCC[C@@H]2O ZINC000768528748 1022981706 /nfs/dbraw/zinc/98/17/06/1022981706.db2.gz HJMRNAJMCKQAFC-AWEZNQCLSA-N -1 1 323.751 3.613 20 10 DHCDMM [O-]c1c(F)cc(F)cc1CNc1ccc([C@@H]2CCOC2)cc1 ZINC000883131645 1024252670 /nfs/dbraw/zinc/25/26/70/1024252670.db2.gz LTGPDEOQYDVKTR-GFCCVEGCSA-N -1 1 305.324 3.786 20 10 DHCDMM Cc1csc(C2(NCc3ccc(F)c(F)c3[O-])CCC2)n1 ZINC000877000947 1033202754 /nfs/dbraw/zinc/20/27/54/1033202754.db2.gz ZOKVVVLETZLJSI-UHFFFAOYSA-N -1 1 310.369 3.604 20 10 DHCDMM Cc1ccc(C(C)(C)[NH2+]Cc2c(O)ccc(Cl)c2F)cn1 ZINC000790986233 1024412154 /nfs/dbraw/zinc/41/21/54/1024412154.db2.gz KJNGLJMHMMFYBN-UHFFFAOYSA-N -1 1 308.784 3.913 20 10 DHCDMM Cc1cc(NCC(=O)c2ccc([O-])c(O)c2)cc(C(C)(C)C)c1 ZINC001170322195 1024741991 /nfs/dbraw/zinc/74/19/91/1024741991.db2.gz HAVCBSIYTGGALT-UHFFFAOYSA-N -1 1 313.397 3.999 20 10 DHCDMM C[C@@H]1Oc2ccccc2[C@@H]1[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000808443088 1026286855 /nfs/dbraw/zinc/28/68/55/1026286855.db2.gz AILQHXKTNPQAKY-XXFAHNHDSA-N -1 1 307.752 3.797 20 10 DHCDMM [O-]c1cc(F)c(Cl)cc1CNc1cccc2c1OCC[C@@H]2O ZINC000816570483 1028950358 /nfs/dbraw/zinc/95/03/58/1028950358.db2.gz VRKPWSHJINHUJV-AWEZNQCLSA-N -1 1 323.751 3.613 20 10 DHCDMM Cc1cc(F)c(CN[C@@H](C)c2cc([N+](=O)[O-])ccc2[O-])c(F)c1 ZINC000927094246 1031083651 /nfs/dbraw/zinc/08/36/51/1031083651.db2.gz RBGWDKCPXBDZDV-JTQLQIEISA-N -1 1 322.311 3.738 20 10 DHCDMM COCC1(C2CC2)CN(Cc2cc(Cl)cc(Cl)c2[O-])C1 ZINC000877686063 1033412358 /nfs/dbraw/zinc/41/23/58/1033412358.db2.gz KDBXQHZQXZVYAE-UHFFFAOYSA-N -1 1 316.228 3.557 20 10 DHCDMM O=C1c2ccccc2C(=O)c2cc(Nc3ccoc3)c([O-])cc21 ZINC001173935554 1033998851 /nfs/dbraw/zinc/99/88/51/1033998851.db2.gz YKPRNWMEGRBDEM-UHFFFAOYSA-N -1 1 305.289 3.504 20 10 DHCDMM COC[C@H](N[C@@H](C)c1ccc(F)c(F)c1[O-])c1ccc(C)o1 ZINC000187744135 1034729164 /nfs/dbraw/zinc/72/91/64/1034729164.db2.gz SJHWYZOZEAPLKP-GWCFXTLKSA-N -1 1 311.328 3.610 20 10 DHCDMM O=C(NCc1ccccc1C1CC1)c1ccc(O)c([O-])c1Cl ZINC001193236660 1035592207 /nfs/dbraw/zinc/59/22/07/1035592207.db2.gz LPUAPUHVMOJJIB-UHFFFAOYSA-N -1 1 317.772 3.559 20 10 DHCDMM CC(C)c1cccc(S(=O)(=O)[N-]c2cccc(N(C)C)c2)c1 ZINC001195159002 1036163106 /nfs/dbraw/zinc/16/31/06/1036163106.db2.gz JYZWKJVQSYNLNM-UHFFFAOYSA-N -1 1 318.442 3.677 20 10 DHCDMM CCC[C@@H]1CCCC[C@@H]1CNC(=O)c1c(F)ccc(O)c1[O-] ZINC001183694938 1036650969 /nfs/dbraw/zinc/65/09/69/1036650969.db2.gz SVFUSSPOZMIGJY-VXGBXAGGSA-N -1 1 309.381 3.573 20 10 DHCDMM O=C1[N-]C(=S)S/C1=C/c1cc(C(F)(F)F)ccc1Cl ZINC000152130922 1036905455 /nfs/dbraw/zinc/90/54/55/1036905455.db2.gz PBTCIAOPHCPJBY-XBXARRHUSA-N -1 1 323.748 3.848 20 10 DHCDMM [O-]c1c(F)cc(F)cc1CNc1ccc(N2CCCCC2)cn1 ZINC001199554598 1037282437 /nfs/dbraw/zinc/28/24/37/1037282437.db2.gz SEMSYINYNVTBIJ-UHFFFAOYSA-N -1 1 319.355 3.668 20 10 DHCDMM Oc1ccc(Cl)c(F)c1C[N@@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000775136871 1037685361 /nfs/dbraw/zinc/68/53/61/1037685361.db2.gz NIOQKZYQRXJJGL-MRVPVSSYSA-N -1 1 311.706 3.959 20 10 DHCDMM O=C1CCc2cc(NCc3cccc(Cl)c3[O-])ccc2N1 ZINC000158064161 1039773882 /nfs/dbraw/zinc/77/38/82/1039773882.db2.gz WOPIHAOWSYOMAD-UHFFFAOYSA-N -1 1 302.761 3.542 20 10 DHCDMM COc1c([O-])c(C[N@H+](C)[C@@H](C)c2cccs2)ccc1[N+](=O)[O-] ZINC000278274747 334094373 /nfs/dbraw/zinc/09/43/73/334094373.db2.gz RZLVBWBASIGKOL-JTQLQIEISA-N -1 1 322.386 3.564 20 10 DHCDMM [O-]c1ccc(Cl)c(F)c1CNc1cccc(-c2nc[nH]n2)c1 ZINC000372795149 336940097 /nfs/dbraw/zinc/94/00/97/336940097.db2.gz YSQXJIWPBFQIBH-UHFFFAOYSA-N -1 1 318.739 3.582 20 10 DHCDMM C[C@@]1(CC(=O)NCc2cccc(Cl)c2[O-])CC1(Cl)Cl ZINC000890761651 1013338504 /nfs/dbraw/zinc/33/85/04/1013338504.db2.gz VHDXPVNXZPFNFY-GFCCVEGCSA-N -1 1 322.619 3.636 20 10 DHCDMM C[C@@H]1C[C@H](c2cccnc2)[N@H+](Cc2cc(F)cc(F)c2O)C1 ZINC000894461198 1013379246 /nfs/dbraw/zinc/37/92/46/1013379246.db2.gz CYURPFHMYNVYSC-BDJLRTHQSA-N -1 1 304.340 3.649 20 10 DHCDMM CC(=O)c1cc(Nc2cc(Cl)c(C)c(Cl)c2[O-])ccn1 ZINC001210595651 1013962079 /nfs/dbraw/zinc/96/20/79/1013962079.db2.gz MLURJDWMWKZYDN-UHFFFAOYSA-N -1 1 311.168 3.771 20 10 DHCDMM CCC/C(C)=C\C(=O)NCc1cccc(Br)c1[O-] ZINC000765732116 1019081878 /nfs/dbraw/zinc/08/18/78/1019081878.db2.gz PULNCJJFPFHKBE-NTMALXAHSA-N -1 1 312.207 3.517 20 10 DHCDMM O=C1[N-]C(=S)S/C1=C/c1ccc(-c2cccc(F)c2F)o1 ZINC000790100567 1024225826 /nfs/dbraw/zinc/22/58/26/1024225826.db2.gz FMGHNMMCDZUJJG-IZZDOVSWSA-N -1 1 323.345 3.714 20 10 DHCDMM CC(C)NC(=O)c1ccc(NCc2cccc(Cl)c2[O-])cc1 ZINC000317281140 1024520460 /nfs/dbraw/zinc/52/04/60/1024520460.db2.gz JUIGYESQFJFAJV-UHFFFAOYSA-N -1 1 318.804 3.796 20 10 DHCDMM CC(=O)c1cc(Cl)cc(CN2CCCc3occc3C2)c1[O-] ZINC000808797346 1026398429 /nfs/dbraw/zinc/39/84/29/1026398429.db2.gz NOXLIUXHFGNJGD-UHFFFAOYSA-N -1 1 319.788 3.790 20 10 DHCDMM C[C@H](NCc1cc(Cl)cc(F)c1[O-])c1c(F)cncc1F ZINC000809715390 1026602047 /nfs/dbraw/zinc/60/20/47/1026602047.db2.gz ASGQSZLKDLGWRO-ZETCQYMHSA-N -1 1 316.710 3.709 20 10 DHCDMM O=C(NCc1cccc(Cl)c1[O-])Nc1cc(C2CC2)ccn1 ZINC000931496110 1027141553 /nfs/dbraw/zinc/14/15/53/1027141553.db2.gz HFQNNIZIRUEBAI-UHFFFAOYSA-N -1 1 317.776 3.640 20 10 DHCDMM [O-]c1cc(F)c(Cl)cc1CNc1cccc2c1OCCO2 ZINC000816528362 1028935079 /nfs/dbraw/zinc/93/50/79/1028935079.db2.gz ZAIWZORDPXZQTL-UHFFFAOYSA-N -1 1 309.724 3.568 20 10 DHCDMM [O-]c1cc(F)c(Cl)cc1CNc1cnn(-c2ccccc2)c1 ZINC000816559618 1028946244 /nfs/dbraw/zinc/94/62/44/1028946244.db2.gz PLWJKLZHARKMGY-UHFFFAOYSA-N -1 1 317.751 3.983 20 10 DHCDMM Cc1cc2c(cc1NCc1cc(Cl)c(F)cc1[O-])OCO2 ZINC000816566054 1028949299 /nfs/dbraw/zinc/94/92/99/1028949299.db2.gz KHCMITZWATYQRZ-UHFFFAOYSA-N -1 1 309.724 3.834 20 10 DHCDMM C[C@H](N[C@@H](CF)c1ccc(F)cc1)c1cc([N+](=O)[O-])ccc1[O-] ZINC000866596400 1030391147 /nfs/dbraw/zinc/39/11/47/1030391147.db2.gz KETBEBCELQCYBU-BONVTDFDSA-N -1 1 322.311 3.801 20 10 DHCDMM Cc1cc(O)c(C[N@H+]2CCO[C@@H](c3cccs3)C2)cc1Cl ZINC000824632664 1030598008 /nfs/dbraw/zinc/59/80/08/1030598008.db2.gz PECNYYBMTZXQMC-OAHLLOKOSA-N -1 1 323.845 3.989 20 10 DHCDMM CCn1ccnc1[C@@H](C)NCc1cc(Cl)cc(Cl)c1[O-] ZINC000825005031 1030686412 /nfs/dbraw/zinc/68/64/12/1030686412.db2.gz BRXZUBDTSLLZFA-SECBINFHSA-N -1 1 314.216 3.766 20 10 DHCDMM COc1cccc2c1CN(Cc1cccc(Cl)c1[O-])CC2 ZINC000824982545 1030694600 /nfs/dbraw/zinc/69/46/00/1030694600.db2.gz HIXSTENROGZQHT-UHFFFAOYSA-N -1 1 303.789 3.613 20 10 DHCDMM O=C(NCc1cccc(Cl)c1[O-])Nc1scnc1C1CC1 ZINC000930593261 1031881100 /nfs/dbraw/zinc/88/11/00/1031881100.db2.gz QRWZFDTZGLSPPT-UHFFFAOYSA-N -1 1 323.805 3.701 20 10 DHCDMM C[C@H](c1ccco1)[N@H+](C)Cc1c(O)cccc1Br ZINC000862219502 1033784283 /nfs/dbraw/zinc/78/42/83/1033784283.db2.gz HMQCHDMDYWHQLT-SNVBAGLBSA-N -1 1 310.191 3.941 20 10 DHCDMM COC[C@H](N[C@H](C)c1ccc(F)c(F)c1[O-])c1ccc(C)o1 ZINC000187744168 1034728288 /nfs/dbraw/zinc/72/82/88/1034728288.db2.gz SJHWYZOZEAPLKP-MFKMUULPSA-N -1 1 311.328 3.610 20 10 DHCDMM Cn1c2cc(F)ccc2nc1NCc1cc(Cl)cc(F)c1[O-] ZINC001179810463 1035507974 /nfs/dbraw/zinc/50/79/74/1035507974.db2.gz NPHWUFLWKCOJTF-UHFFFAOYSA-N -1 1 323.730 3.823 20 10 DHCDMM C[C@H]1[C@@H](C(F)(F)F)CCC[N@H+]1Cc1cc(F)cc(F)c1O ZINC001180970703 1035798761 /nfs/dbraw/zinc/79/87/61/1035798761.db2.gz WBKRXVGVKNVVRO-KWQFWETISA-N -1 1 309.278 3.833 20 10 DHCDMM Cc1cc(N[C@H](C)c2cc(F)cc(F)c2[O-])cc(OCCO)c1 ZINC000774506724 1036373316 /nfs/dbraw/zinc/37/33/16/1036373316.db2.gz AYFMUIBQMTWJQY-LLVKDONJSA-N -1 1 323.339 3.523 20 10 DHCDMM CCC1(CC)CCCN(C(=O)c2c(F)ccc(O)c2[O-])CC1 ZINC001183193460 1036537104 /nfs/dbraw/zinc/53/71/04/1036537104.db2.gz MKEURGNGODFHQW-UHFFFAOYSA-N -1 1 309.381 3.669 20 10 DHCDMM O=C(CCCC1CCCCC1)OCC(=O)c1ccc([O-])c(O)c1 ZINC000916591221 1037793338 /nfs/dbraw/zinc/79/33/38/1037793338.db2.gz BLPQLSUOYGLEEH-UHFFFAOYSA-N -1 1 320.385 3.574 20 10 DHCDMM CO[C@H]1Cc2ccc(N[C@@H](C)c3cc(F)cc(F)c3[O-])cc2C1 ZINC000760888862 1038974823 /nfs/dbraw/zinc/97/48/23/1038974823.db2.gz ZECOFNIUDQLITO-BONVTDFDSA-N -1 1 319.351 3.957 20 10 DHCDMM CC(C)n1cc(NCc2cccc(Br)c2[O-])cn1 ZINC000061683281 1039504077 /nfs/dbraw/zinc/50/40/77/1039504077.db2.gz AHNAKGFUQKPWCG-UHFFFAOYSA-N -1 1 310.195 3.544 20 10 DHCDMM O=C(NCc1cccc(Cl)c1[O-])[C@@H](c1ccccc1)C1CC1 ZINC000890759673 1013333725 /nfs/dbraw/zinc/33/37/25/1013333725.db2.gz GXJGCHNFYMVZMZ-INIZCTEOSA-N -1 1 315.800 3.856 20 10 DHCDMM CC(C)(CC(=O)NCc1cccc(Cl)c1[O-])CC(F)F ZINC000890762506 1013341255 /nfs/dbraw/zinc/34/12/55/1013341255.db2.gz FLJWWBLCJCWDHS-UHFFFAOYSA-N -1 1 305.752 3.733 20 10 DHCDMM C[C@@H](Cc1cccs1)NC(=O)NCc1cccc(Cl)c1[O-] ZINC000891905718 1015749146 /nfs/dbraw/zinc/74/91/46/1015749146.db2.gz DGARGNXAWWJKNE-JTQLQIEISA-N -1 1 324.833 3.538 20 10 DHCDMM Cc1ccc2oc(SCC(=O)c3ccc([O-])c(O)c3)nc2c1 ZINC000072626548 1016716575 /nfs/dbraw/zinc/71/65/75/1016716575.db2.gz ZULYMZWMPVRKCZ-UHFFFAOYSA-N -1 1 315.350 3.522 20 10 DHCDMM C[C@@H](N[C@@H](C)c1csnn1)c1cccc(C(F)(F)F)c1[O-] ZINC000840885684 1017356966 /nfs/dbraw/zinc/35/69/66/1017356966.db2.gz FPHYROULVSTEJS-SFYZADRCSA-N -1 1 317.336 3.674 20 10 DHCDMM [O-]c1c(Br)cccc1CNc1ncccc1Cl ZINC000764934863 1018433763 /nfs/dbraw/zinc/43/37/63/1018433763.db2.gz OZXJHPADKIAYBL-UHFFFAOYSA-N -1 1 313.582 3.815 20 10 DHCDMM CC/C(C)=C(\C)C(=O)NCc1cccc(Br)c1[O-] ZINC000765750238 1019115838 /nfs/dbraw/zinc/11/58/38/1019115838.db2.gz CQJOCBCREDLDRA-MDZDMXLPSA-N -1 1 312.207 3.517 20 10 DHCDMM O=C1N[C@H](c2cccc(Cl)c2[O-])Nc2cc(Cl)ccc21 ZINC000124720592 1023348264 /nfs/dbraw/zinc/34/82/64/1023348264.db2.gz AEPBYTBGCABTLA-CYBMUJFWSA-N -1 1 309.152 3.553 20 10 DHCDMM Cc1csc2ccc(NCC(=O)c3ccc([O-])c(O)c3)cc12 ZINC001170315207 1024741595 /nfs/dbraw/zinc/74/15/95/1024741595.db2.gz ULUAKQTYHHEVBG-UHFFFAOYSA-N -1 1 313.378 3.916 20 10 DHCDMM [O-]c1ccc(Cl)c(F)c1CNc1cnc2ccccc2n1 ZINC000792693731 1024783906 /nfs/dbraw/zinc/78/39/06/1024783906.db2.gz BOQUUXBOXRRCIW-UHFFFAOYSA-N -1 1 303.724 3.740 20 10 DHCDMM CO[C@H](C)c1nc(CN[C@H](C)c2c([O-])cccc2F)cs1 ZINC000886536742 1025683470 /nfs/dbraw/zinc/68/34/70/1025683470.db2.gz NXUUMEYTHCJYOK-NXEZZACHSA-N -1 1 310.394 3.546 20 10 DHCDMM [O-]c1c(F)cc(Cl)cc1CN(Cc1ccccn1)C1CC1 ZINC000809764595 1026620090 /nfs/dbraw/zinc/62/00/90/1026620090.db2.gz XISGWRKDZQZPOP-UHFFFAOYSA-N -1 1 306.768 3.744 20 10 DHCDMM Cc1nn(C)c2cc(NCc3c([O-])ccc(Cl)c3F)ccc12 ZINC000812773935 1027401116 /nfs/dbraw/zinc/40/11/16/1027401116.db2.gz ABXZFDWYHYBAFR-UHFFFAOYSA-N -1 1 319.767 3.992 20 10 DHCDMM O=C(NCc1cccc(Cl)c1[O-])Nc1ccc(C2CC2)cn1 ZINC000933953641 1027865506 /nfs/dbraw/zinc/86/55/06/1027865506.db2.gz DXUTUMIANIAHEC-UHFFFAOYSA-N -1 1 317.776 3.640 20 10 DHCDMM CCc1nccc(C)c1NC(=O)NCc1cccc(Cl)c1[O-] ZINC000934486302 1028021328 /nfs/dbraw/zinc/02/13/28/1028021328.db2.gz JXXNBZZCVCCDOW-UHFFFAOYSA-N -1 1 319.792 3.633 20 10 DHCDMM [O-]c1cc(F)c(Cl)cc1CNc1ccc(N2CCCC2)nc1 ZINC000816557828 1028942453 /nfs/dbraw/zinc/94/24/53/1028942453.db2.gz CIDTXPPLDKAIBT-UHFFFAOYSA-N -1 1 321.783 3.792 20 10 DHCDMM [O-]c1cc(F)c(Cl)cc1CNc1cccc2c1OCC[C@H]2O ZINC000816570484 1028949817 /nfs/dbraw/zinc/94/98/17/1028949817.db2.gz VRKPWSHJINHUJV-CQSZACIVSA-N -1 1 323.751 3.613 20 10 DHCDMM CCN(Cc1cc(Cl)cc(C(C)=O)c1[O-])CC(F)(F)F ZINC000042774276 1029068446 /nfs/dbraw/zinc/06/84/46/1029068446.db2.gz ZNHYBQIUBKWLSV-UHFFFAOYSA-N -1 1 309.715 3.632 20 10 DHCDMM CC(C)=C(C)CC(=O)NCc1cccc(Br)c1[O-] ZINC000822459696 1030032543 /nfs/dbraw/zinc/03/25/43/1030032543.db2.gz ZBHSHQRVVQVBFI-UHFFFAOYSA-N -1 1 312.207 3.517 20 10 DHCDMM CN(Cc1cc(F)c(F)cc1[O-])[C@H](C1CCC1)C(F)(F)F ZINC001142527361 1031910619 /nfs/dbraw/zinc/91/06/19/1031910619.db2.gz SHWLIOYGBVYSEW-CYBMUJFWSA-N -1 1 309.278 3.833 20 10 DHCDMM C[C@@H]1C[C@H](NC(=O)c2ccc(O)c([O-])c2Cl)c2ccccc21 ZINC001193236575 1035594248 /nfs/dbraw/zinc/59/42/48/1035594248.db2.gz IEURXZPZWVTLKW-RNCFNFMXSA-N -1 1 317.772 3.730 20 10 DHCDMM Cc1ccc(Cl)cc1C(=O)NCc1cccc(Cl)c1[O-] ZINC001180409614 1035673962 /nfs/dbraw/zinc/67/39/62/1035673962.db2.gz FHDBFOJAVPLOSF-UHFFFAOYSA-N -1 1 310.180 3.937 20 10 DHCDMM [O-]c1c(F)cc(Cl)cc1CN1CCC[C@H]1c1ccccn1 ZINC000775650479 1036229970 /nfs/dbraw/zinc/22/99/70/1036229970.db2.gz DQAYOCDBGUCNLA-HNNXBMFYSA-N -1 1 306.768 3.917 20 10 DHCDMM COC(=O)c1ccc(NCc2c([O-])ccc(Cl)c2F)cc1 ZINC000762645025 1036886650 /nfs/dbraw/zinc/88/66/50/1036886650.db2.gz PKMFTSFGUGNPHC-UHFFFAOYSA-N -1 1 309.724 3.583 20 10 DHCDMM C[S@@](=O)Cc1ccccc1NCc1cccc(Cl)c1[O-] ZINC000762790234 1036946739 /nfs/dbraw/zinc/94/67/39/1036946739.db2.gz BEUXTGBYBUYIMK-HXUWFJFHSA-N -1 1 309.818 3.536 20 10 DHCDMM C[C@H](NCc1cc([N+](=O)[O-])ccc1[O-])c1c(F)cccc1Cl ZINC001200949496 1037488404 /nfs/dbraw/zinc/48/84/04/1037488404.db2.gz BMOANVZIVGISBH-VIFPVBQESA-N -1 1 324.739 3.944 20 10 DHCDMM C[C@@H](N[C@H](C)c1c(F)cncc1F)c1ccc(F)c(F)c1[O-] ZINC000285755831 131199668 /nfs/dbraw/zinc/19/96/68/131199668.db2.gz SHMJPURPUWBYSZ-HTQZYQBOSA-N -1 1 314.282 3.755 20 10 DHCDMM COCCC1(C)CN(Cc2cc(Cl)cc(Cl)c2[O-])C1 ZINC000297529547 132020783 /nfs/dbraw/zinc/02/07/83/132020783.db2.gz ZDHFGJLBSWORHS-UHFFFAOYSA-N -1 1 304.217 3.557 20 10 DHCDMM CCCN(Cc1ccccc1O)[C@H](C)c1ncc(C(=O)[O-])s1 ZINC001595891258 982925473 /nfs/dbraw/zinc/92/54/73/982925473.db2.gz QSUZGKHLSCRUSM-LLVKDONJSA-N -1 1 320.414 3.520 20 10 DHCDMM C[C@@H](C(=O)[O-])[N@@H+](Cc1cc(Cl)cc(Cl)c1[O-])C1CCC1 ZINC001589486237 987025123 /nfs/dbraw/zinc/02/51/23/987025123.db2.gz BAIAGRHWARTXJZ-QMMMGPOBSA-N -1 1 318.200 3.527 20 10 DHCDMM CC(C)C[C@H](C)C[N@H+](CC(=O)[O-])Cc1cc(Cl)ccc1[O-] ZINC001591134243 991838183 /nfs/dbraw/zinc/83/81/83/991838183.db2.gz QTMCXJFLYKVRCB-LBPRGKRZSA-N -1 1 313.825 3.614 20 10 DHCDMM CC(C)C[C@H](C)C[N@@H+](CC(=O)[O-])Cc1cc(Cl)ccc1[O-] ZINC001591134243 991838193 /nfs/dbraw/zinc/83/81/93/991838193.db2.gz QTMCXJFLYKVRCB-LBPRGKRZSA-N -1 1 313.825 3.614 20 10 DHCDMM CC(C)CCOc1ccc(C=C2SC(=S)[N-]C2=O)cc1 ZINC000001484864 1011977188 /nfs/dbraw/zinc/97/71/88/1011977188.db2.gz XAHBPLXTYDNHNV-UKTHLTGXSA-N -1 1 307.440 3.600 20 10 DHCDMM CCC(C)(CC)C(=O)NCc1cccc(Br)c1[O-] ZINC000765726674 1019077316 /nfs/dbraw/zinc/07/73/16/1019077316.db2.gz JDBHSBNSXRVKQC-UHFFFAOYSA-N -1 1 314.223 3.597 20 10 DHCDMM C[C@@]1(F)CCN(Cc2cc(Cl)c(Cl)cc2[O-])C[C@@H]1F ZINC001236792087 1021268255 /nfs/dbraw/zinc/26/82/55/1021268255.db2.gz BFVLSNKMXUBRQW-QWHCGFSZSA-N -1 1 310.171 3.971 20 10 DHCDMM COCCOc1cccc(N[C@@H](C)c2cc(F)cc(F)c2[O-])c1 ZINC000756817623 1023972293 /nfs/dbraw/zinc/97/22/93/1023972293.db2.gz ARQQPLIYTBUZSV-NSHDSACASA-N -1 1 323.339 3.869 20 10 DHCDMM CCOc1cc(NCc2cc(F)cc(F)c2[O-])ccc1OC ZINC000882908131 1024168004 /nfs/dbraw/zinc/16/80/04/1024168004.db2.gz FBWRAZPKMIRACQ-UHFFFAOYSA-N -1 1 309.312 3.690 20 10 DHCDMM [O-]c1ccc(Cl)c(F)c1CNc1ccc2c(c1)OCCCO2 ZINC000790951923 1024405359 /nfs/dbraw/zinc/40/53/59/1024405359.db2.gz SYQPOZWFCOYYIO-UHFFFAOYSA-N -1 1 323.751 3.958 20 10 DHCDMM [O-]c1ccc(Cl)c(F)c1CNc1ccc(OC(F)F)cn1 ZINC000793270960 1024969879 /nfs/dbraw/zinc/96/98/79/1024969879.db2.gz MVFHCCGSSVMUFV-UHFFFAOYSA-N -1 1 318.682 3.793 20 10 DHCDMM C[C@H](N[C@H]1COc2cc(F)cc(F)c21)c1c([O-])cccc1F ZINC000886587807 1025724896 /nfs/dbraw/zinc/72/48/96/1025724896.db2.gz GCGMQWMERPTCCQ-UFBFGSQYSA-N -1 1 309.287 3.594 20 10 DHCDMM C[C@H]1Oc2ccccc2[C@H]1[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000808443083 1026285710 /nfs/dbraw/zinc/28/57/10/1026285710.db2.gz AILQHXKTNPQAKY-ABKXIKBNSA-N -1 1 307.752 3.797 20 10 DHCDMM C[C@@H]1Oc2ccccc2[C@H]1[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000808443084 1026285994 /nfs/dbraw/zinc/28/59/94/1026285994.db2.gz AILQHXKTNPQAKY-FVMDXXJSSA-N -1 1 307.752 3.797 20 10 DHCDMM CCOc1ncccc1NCc1cccc(Br)c1[O-] ZINC000048796129 1028249789 /nfs/dbraw/zinc/24/97/89/1028249789.db2.gz VQGNYCYEWJCEFF-UHFFFAOYSA-N -1 1 323.190 3.561 20 10 DHCDMM O=C1N[C@H](c2cccc(F)c2[O-])Nc2c3ccccc3sc21 ZINC000778524416 1028681975 /nfs/dbraw/zinc/68/19/75/1028681975.db2.gz INNLFBIMWXPQLW-OAHLLOKOSA-N -1 1 314.341 3.600 20 10 DHCDMM [O-]c1c(Cl)cc(Cl)cc1CN1CC(Cc2ccco2)C1 ZINC000529648688 1029483201 /nfs/dbraw/zinc/48/32/01/1029483201.db2.gz GTIKIEKTVQYJFE-UHFFFAOYSA-N -1 1 312.196 3.967 20 10 DHCDMM [O-]c1c(Cl)cc(Cl)cc1CNCc1cc(C2CC2)no1 ZINC000877529444 1033336592 /nfs/dbraw/zinc/33/65/92/1033336592.db2.gz DIHYPOWDGFNQKT-UHFFFAOYSA-N -1 1 313.184 3.854 20 10 DHCDMM CCN1C(=O)c2ccccc2N[C@@H]1c1cc(Cl)c(F)cc1[O-] ZINC000877846914 1033483774 /nfs/dbraw/zinc/48/37/74/1033483774.db2.gz KFRLCGWIAYQSML-HNNXBMFYSA-N -1 1 320.751 3.771 20 10 DHCDMM Cc1ccc(CN(C)C(=O)c2ccc(O)c([O-])c2Cl)cc1C ZINC001193232933 1035590936 /nfs/dbraw/zinc/59/09/36/1035590936.db2.gz RBBSQNVARWJHAS-UHFFFAOYSA-N -1 1 319.788 3.640 20 10 DHCDMM Cc1cccc([C@@H](C)NC(=O)c2ccc(O)c([O-])c2Cl)c1C ZINC001193247025 1035593846 /nfs/dbraw/zinc/59/38/46/1035593846.db2.gz IFYZEHHJGNKWPY-LLVKDONJSA-N -1 1 319.788 3.859 20 10 DHCDMM C[C@@H](Cc1cccc(F)c1)C(=O)NCc1cccc(Cl)c1[O-] ZINC001180409867 1035672569 /nfs/dbraw/zinc/67/25/69/1035672569.db2.gz HENXYRARJIXWOV-NSHDSACASA-N -1 1 321.779 3.680 20 10 DHCDMM CCC(=O)c1ccc(C(=O)NCc2cccc(Cl)c2[O-])cc1 ZINC001180410148 1035674042 /nfs/dbraw/zinc/67/40/42/1035674042.db2.gz KOWBPBUGVQIYQI-UHFFFAOYSA-N -1 1 317.772 3.568 20 10 DHCDMM C[C@H]1CN(Cc2cc(Cl)c(F)cc2[O-])c2ccccc2O1 ZINC001180612736 1035722988 /nfs/dbraw/zinc/72/29/88/1035722988.db2.gz MAFDQRCFMONLDZ-JTQLQIEISA-N -1 1 307.752 3.972 20 10 DHCDMM Cc1ccc2c(c1)OCCN2Cc1cc(Cl)cc(F)c1[O-] ZINC001180646691 1035734463 /nfs/dbraw/zinc/73/44/63/1035734463.db2.gz ORADBMRLYVNERH-UHFFFAOYSA-N -1 1 307.752 3.892 20 10 DHCDMM [O-]c1c(Br)cccc1CNc1ccc(Cl)nc1 ZINC000149374092 1036204034 /nfs/dbraw/zinc/20/40/34/1036204034.db2.gz FPYAWVMNBVLJKQ-UHFFFAOYSA-N -1 1 313.582 3.815 20 10 DHCDMM COc1cc(F)c(NCc2cccc(Cl)c2[O-])cc1OC ZINC000775749397 1036638329 /nfs/dbraw/zinc/63/83/29/1036638329.db2.gz KJPKZPVNBRSUNH-UHFFFAOYSA-N -1 1 311.740 3.814 20 10 DHCDMM CC[C@H](NCc1cocn1)c1ccc(Cl)c(Cl)c1[O-] ZINC000775536644 1038679023 /nfs/dbraw/zinc/67/90/23/1038679023.db2.gz LGZICRZFJVBNQZ-NSHDSACASA-N -1 1 301.173 3.928 20 10 DHCDMM COC[C@H](NCc1cc(Cl)cc(Cl)c1[O-])c1ccco1 ZINC000080240701 192015529 /nfs/dbraw/zinc/01/55/29/192015529.db2.gz COTJKGQJVBEISD-LBPRGKRZSA-N -1 1 316.184 3.769 20 10 DHCDMM Cc1ccc(CCC(=O)NCc2cccc(Cl)c2[O-])s1 ZINC000890759764 1013333286 /nfs/dbraw/zinc/33/32/86/1013333286.db2.gz QPVAQILTZROYTJ-UHFFFAOYSA-N -1 1 309.818 3.665 20 10 DHCDMM [O-]c1c(CN[C@H]2c3ccccc3CC[C@@H]2F)ccc(F)c1F ZINC000895690221 1015258060 /nfs/dbraw/zinc/25/80/60/1015258060.db2.gz CCLZMRLGOGKBJI-HOCLYGCPSA-N -1 1 307.315 3.786 20 10 DHCDMM C[C@H](C(=O)[O-])[N@@H+](Cc1cc(Cl)cc(Cl)c1[O-])C1CCC1 ZINC001589486235 987024538 /nfs/dbraw/zinc/02/45/38/987024538.db2.gz BAIAGRHWARTXJZ-MRVPVSSYSA-N -1 1 318.200 3.527 20 10 DHCDMM CC[C@](C)(NC(=O)NCc1cccc(Cl)c1[O-])C(F)(F)F ZINC000933501860 1015377732 /nfs/dbraw/zinc/37/77/32/1015377732.db2.gz VBWLLLTYGGMPKV-LBPRGKRZSA-N -1 1 324.730 3.576 20 10 DHCDMM O=C(C=C1CCCCC1)NCc1cccc(Br)c1[O-] ZINC000277564175 1016641131 /nfs/dbraw/zinc/64/11/31/1016641131.db2.gz PRTKBARCCYPBTH-UHFFFAOYSA-N -1 1 324.218 3.661 20 10 DHCDMM [O-]c1cccc(F)c1CN1Cc2ccc(Br)cc2C1 ZINC001137831820 1018134660 /nfs/dbraw/zinc/13/46/60/1018134660.db2.gz OUKMYZJWEPMICV-UHFFFAOYSA-N -1 1 322.177 3.810 20 10 DHCDMM CC(C)c1nccc(NCc2cccc(Br)c2[O-])n1 ZINC000764935377 1018433948 /nfs/dbraw/zinc/43/39/48/1018433948.db2.gz SHLMVKXJLVAFAN-UHFFFAOYSA-N -1 1 322.206 3.680 20 10 DHCDMM [O-]c1ccc(F)c(Cl)c1CN1CCCC(F)(F)[C@@H](F)C1 ZINC001237119332 1021701574 /nfs/dbraw/zinc/70/15/74/1021701574.db2.gz DIFVRGRIPWCKOP-NSHDSACASA-N -1 1 311.706 3.754 20 10 DHCDMM Cc1cc(Br)c([O-])c(CN2Cc3ccccc3C2)c1 ZINC000781907594 1022934663 /nfs/dbraw/zinc/93/46/63/1022934663.db2.gz IWNMVLQEOGRIHU-UHFFFAOYSA-N -1 1 318.214 3.979 20 10 DHCDMM CSc1cc(O)ccc1[N-]S(=O)(=O)c1ccc(C)cc1C ZINC000192155567 1023008627 /nfs/dbraw/zinc/00/86/27/1023008627.db2.gz PAZGPVALEFSQIJ-UHFFFAOYSA-N -1 1 323.439 3.532 20 10 DHCDMM CCCN(Cc1ccccc1O)C(=O)c1c([O-])cccc1Cl ZINC000769995151 1023259307 /nfs/dbraw/zinc/25/93/07/1023259307.db2.gz ZQKYFCQCZFJGCF-UHFFFAOYSA-N -1 1 319.788 3.804 20 10 DHCDMM Cc1ccc2c(c1C)OC[C@H]2[NH2+]Cc1cc(F)cc(F)c1O ZINC000882986599 1024194454 /nfs/dbraw/zinc/19/44/54/1024194454.db2.gz DHOWPAARXACBKA-OAHLLOKOSA-N -1 1 305.324 3.511 20 10 DHCDMM CC(C)Cc1nnc(NCc2c([O-])ccc(Cl)c2F)s1 ZINC000790242549 1024250643 /nfs/dbraw/zinc/25/06/43/1024250643.db2.gz HMIJXRCYRJFJGH-UHFFFAOYSA-N -1 1 315.801 3.847 20 10 DHCDMM CC[C@@H](NC1(c2ncccn2)CCC1)c1cccc(Cl)c1[O-] ZINC000883312261 1024367189 /nfs/dbraw/zinc/36/71/89/1024367189.db2.gz YJJBJMWQOGSSCZ-CQSZACIVSA-N -1 1 317.820 3.956 20 10 DHCDMM [O-]c1ccc(Cl)c(F)c1CNc1ccccc1-n1cccn1 ZINC000790976303 1024422336 /nfs/dbraw/zinc/42/23/36/1024422336.db2.gz IXRLQQFQHMWYEV-UHFFFAOYSA-N -1 1 317.751 3.983 20 10 DHCDMM Cn1ccc2ccc(NCc3cccc(Cl)c3[O-])cc2c1=O ZINC000793620144 1025134069 /nfs/dbraw/zinc/13/40/69/1025134069.db2.gz LUMCPPOXYDALON-UHFFFAOYSA-N -1 1 314.772 3.510 20 10 DHCDMM CC(C)n1cc(Cl)c(NCc2cc(F)cc(F)c2[O-])n1 ZINC000886367320 1025605667 /nfs/dbraw/zinc/60/56/67/1025605667.db2.gz UZWLTUJVYIRTPY-UHFFFAOYSA-N -1 1 301.724 3.713 20 10 DHCDMM [O-]c1c(Cl)cccc1CN1CCO[C@H](c2ccccc2)C1 ZINC000271709471 1027124365 /nfs/dbraw/zinc/12/43/65/1027124365.db2.gz AJIZVFSIMDINNQ-INIZCTEOSA-N -1 1 303.789 3.619 20 10 DHCDMM CCN1C(=O)c2cc(Cl)ccc2N[C@@H]1c1cccc(F)c1[O-] ZINC000778525980 1028687439 /nfs/dbraw/zinc/68/74/39/1028687439.db2.gz PTFOOEZRNUFGGH-HNNXBMFYSA-N -1 1 320.751 3.771 20 10 DHCDMM [O-]c1cc(F)c(Cl)cc1CNc1cccc(-n2cccn2)c1 ZINC000816479755 1028889281 /nfs/dbraw/zinc/88/92/81/1028889281.db2.gz TXVWGXDLCVCBEK-UHFFFAOYSA-N -1 1 317.751 3.983 20 10 DHCDMM COC(=O)Cc1cccc(NCc2cc(Cl)c(F)cc2[O-])c1 ZINC000816565454 1028945274 /nfs/dbraw/zinc/94/52/74/1028945274.db2.gz PJDDSXCUTLYRCV-UHFFFAOYSA-N -1 1 323.751 3.512 20 10 DHCDMM O=C1CCN1c1cccc(NCc2cc(Cl)c(F)cc2[O-])c1 ZINC000816594706 1028957126 /nfs/dbraw/zinc/95/71/26/1028957126.db2.gz MYFSEWAHVHBPTK-UHFFFAOYSA-N -1 1 320.751 3.534 20 10 DHCDMM [O-]c1c(Cl)cc(Br)cc1Nc1ccncc1F ZINC001175204696 1034849001 /nfs/dbraw/zinc/84/90/01/1034849001.db2.gz RXSOKQNIDJSIOK-UHFFFAOYSA-N -1 1 317.545 3.508 20 10 DHCDMM CC1(C)Cc2cc(NCc3cc(F)cc(F)c3[O-])ccc2O1 ZINC001178072739 1035409417 /nfs/dbraw/zinc/40/94/17/1035409417.db2.gz LUHDHADMUFTLSR-UHFFFAOYSA-N -1 1 305.324 3.996 20 10 DHCDMM C[C@@H]1C[C@@H](NC(=O)c2ccc(O)c([O-])c2Cl)CC(C)(C)C1 ZINC001193236492 1035593935 /nfs/dbraw/zinc/59/39/35/1035593935.db2.gz FLMBFDPZMBOSTB-NXEZZACHSA-N -1 1 311.809 3.696 20 10 DHCDMM Cc1ccc2[nH]c(C(=O)NCc3cccc(Cl)c3[O-])cc2c1 ZINC001180410334 1035673140 /nfs/dbraw/zinc/67/31/40/1035673140.db2.gz NNKUEVHLNCEZJN-UHFFFAOYSA-N -1 1 314.772 3.765 20 10 DHCDMM CCCN(Cc1ccccc1O)C(=O)c1ccc(Cl)cc1[O-] ZINC000170732286 1038937183 /nfs/dbraw/zinc/93/71/83/1038937183.db2.gz NKBDXZCZMHKWBS-UHFFFAOYSA-N -1 1 319.788 3.804 20 10 DHCDMM CC(C)c1csc(CN[C@@H](C)c2cc([N+](=O)[O-])ccc2[O-])n1 ZINC000273565272 130137631 /nfs/dbraw/zinc/13/76/31/130137631.db2.gz JGIFNZQYICGXJI-JTQLQIEISA-N -1 1 321.402 3.731 20 10 DHCDMM [O-]c1ccc(Cl)c(F)c1CNc1cccc2c1OCC[C@H]2O ZINC000191606324 337297922 /nfs/dbraw/zinc/29/79/22/337297922.db2.gz CPVYHGMMPCGKFX-CQSZACIVSA-N -1 1 323.751 3.613 20 10 DHCDMM COCCOc1ccc(NCc2cccc(Cl)c2[O-])cc1 ZINC000158046960 524050503 /nfs/dbraw/zinc/05/05/03/524050503.db2.gz XOMBQNZYKNAPSO-UHFFFAOYSA-N -1 1 307.777 3.683 20 10 DHCDMM O=C(CCCc1cccs1)NCc1cccc(Cl)c1[O-] ZINC000890756331 1013326374 /nfs/dbraw/zinc/32/63/74/1013326374.db2.gz BLXFZIYSPNBUCV-UHFFFAOYSA-N -1 1 309.818 3.746 20 10 DHCDMM Oc1cc(F)c(Cl)cc1C[NH2+]Cc1nccc2c1CCCC2 ZINC000896280668 1015532722 /nfs/dbraw/zinc/53/27/22/1015532722.db2.gz HUFCIDXEEMKFNT-UHFFFAOYSA-N -1 1 320.795 3.748 20 10 DHCDMM O=S(=O)(Nc1cc(Cl)c([O-])c(Cl)c1)c1ccsc1 ZINC000714385328 1032595332 /nfs/dbraw/zinc/59/53/32/1032595332.db2.gz QXAIZAYYEOMSLN-UHFFFAOYSA-N -1 1 324.210 3.561 20 10 DHCDMM [O-]c1c(Br)cccc1CNc1nccc2occc21 ZINC000764934225 1018434318 /nfs/dbraw/zinc/43/43/18/1018434318.db2.gz KHXXXJBRHDAZTR-UHFFFAOYSA-N -1 1 319.158 3.908 20 10 DHCDMM [O-]c1cccc(F)c1CN1CCOC[C@@H]1c1ccccc1Cl ZINC001137839541 1018754786 /nfs/dbraw/zinc/75/47/86/1018754786.db2.gz CDCMJFSREKGPKT-MRXNPFEDSA-N -1 1 321.779 3.758 20 10 DHCDMM COCc1ccc(N[C@@H](C)c2cc(F)cc(F)c2[O-])cc1OC ZINC000858567595 1032948697 /nfs/dbraw/zinc/94/86/97/1032948697.db2.gz GLLGERMGDSGWAO-JTQLQIEISA-N -1 1 323.339 3.999 20 10 DHCDMM Cc1ccc2c(c1)C(=O)N(C)[C@@H](c1cc(Cl)cc(F)c1[O-])N2 ZINC000768274823 1022938455 /nfs/dbraw/zinc/93/84/55/1022938455.db2.gz UGFLOPFFKKGMBB-HNNXBMFYSA-N -1 1 320.751 3.689 20 10 DHCDMM CN1C(=O)c2cc(Cl)ccc2N[C@H]1c1cccc(Cl)c1[O-] ZINC000124738534 1023352810 /nfs/dbraw/zinc/35/28/10/1023352810.db2.gz ZGIPZZUBZBJYMI-CQSZACIVSA-N -1 1 323.179 3.895 20 10 DHCDMM C[C@@H](C1CC1)n1cc(NCc2c([O-])ccc(Cl)c2F)cn1 ZINC000790989139 1024410975 /nfs/dbraw/zinc/41/09/75/1024410975.db2.gz YIWRLYMROVAKDC-VIFPVBQESA-N -1 1 309.772 3.964 20 10 DHCDMM CC1(C)CN(Cc2cc(Cl)cc(F)c2[O-])[C@@H]1[C@@H]1CCCO1 ZINC000811510351 1027027719 /nfs/dbraw/zinc/02/77/19/1027027719.db2.gz CYJDNNTYMOFFRG-DZGCQCFKSA-N -1 1 313.800 3.574 20 10 DHCDMM C[C@@H](N[C@@H]1COc2cccc(F)c21)c1cc(Cl)ccc1O ZINC000368411271 1028353275 /nfs/dbraw/zinc/35/32/75/1028353275.db2.gz NMAVBTNOBQKMCG-NOZJJQNGSA-N -1 1 307.752 3.969 20 10 DHCDMM O=C(C[C@@H]1CC=CCC1)NCc1cccc(Br)c1[O-] ZINC000935662783 1028353182 /nfs/dbraw/zinc/35/31/82/1028353182.db2.gz KHONAUVAOBXRRD-LLVKDONJSA-N -1 1 324.218 3.517 20 10 DHCDMM O=C1N[C@@H](c2cccc(F)c2[O-])Nc2c3ccccc3sc21 ZINC000778524412 1028687420 /nfs/dbraw/zinc/68/74/20/1028687420.db2.gz INNLFBIMWXPQLW-HNNXBMFYSA-N -1 1 314.341 3.600 20 10 DHCDMM O=C1CCc2cc(NCc3cc(Cl)c(F)cc3[O-])ccc2N1 ZINC000816528365 1028935002 /nfs/dbraw/zinc/93/50/02/1028935002.db2.gz ZDEMVIPGEUUFIA-UHFFFAOYSA-N -1 1 320.751 3.682 20 10 DHCDMM CO[C@@H]1Cc2ccc(NCc3cc(Cl)c(F)cc3[O-])cc2C1 ZINC000816568185 1028947253 /nfs/dbraw/zinc/94/72/53/1028947253.db2.gz ZPQUJTJJCYNHMH-CQSZACIVSA-N -1 1 321.779 3.910 20 10 DHCDMM C[C@@H](O)c1cc(NCc2cc(Cl)c(F)cc2[O-])ccc1F ZINC000816609915 1028959845 /nfs/dbraw/zinc/95/98/45/1028959845.db2.gz REJXRNXFKDCPQS-MRVPVSSYSA-N -1 1 313.731 3.989 20 10 DHCDMM COCc1cc(N[C@H](C)c2cc(F)cc(F)c2[O-])ccc1OC ZINC000866500662 1030327536 /nfs/dbraw/zinc/32/75/36/1030327536.db2.gz XXKPHCTXENXSJY-SNVBAGLBSA-N -1 1 323.339 3.999 20 10 DHCDMM CC(C)c1csc(SCC(=O)c2ccc([O-])c(O)c2)n1 ZINC000845329174 1031537738 /nfs/dbraw/zinc/53/77/38/1031537738.db2.gz XKPWINBBKGBVGW-UHFFFAOYSA-N -1 1 309.412 3.653 20 10 DHCDMM CC1(C)C[N@@H+](Cc2cc(F)c(F)cc2O)Cc2ccccc21 ZINC001142527056 1031906975 /nfs/dbraw/zinc/90/69/75/1031906975.db2.gz ISCCKWNQCDMIQP-UHFFFAOYSA-N -1 1 303.352 3.964 20 10 DHCDMM [O-]c1c(F)cc(F)cc1CNc1nnc(C2CCCCC2)o1 ZINC000905404918 1035515311 /nfs/dbraw/zinc/51/53/11/1035515311.db2.gz FBPBTONFUJSMEJ-UHFFFAOYSA-N -1 1 309.316 3.713 20 10 DHCDMM [O-]c1ccc(Cl)c(F)c1CNc1nnc(C2CCCC2)o1 ZINC000905424667 1035525573 /nfs/dbraw/zinc/52/55/73/1035525573.db2.gz CGAFYHWVDLXJGE-UHFFFAOYSA-N -1 1 311.744 3.837 20 10 DHCDMM COC(=O)c1cccc(NCc2cc(Cl)cc(F)c2[O-])c1 ZINC001179970292 1035551371 /nfs/dbraw/zinc/55/13/71/1035551371.db2.gz VZSDOPXVFGRNKO-UHFFFAOYSA-N -1 1 309.724 3.583 20 10 DHCDMM O=C(Nc1nc2ccccc2s1)c1ccc(O)c([O-])c1Cl ZINC001193210128 1035586877 /nfs/dbraw/zinc/58/68/77/1035586877.db2.gz UZFFISNKPRBBSA-UHFFFAOYSA-N -1 1 320.757 3.613 20 10 DHCDMM O=C(NCc1cccc(Cl)c1[O-])c1cc2cc(F)ccc2o1 ZINC001180409888 1035674201 /nfs/dbraw/zinc/67/42/01/1035674201.db2.gz HSEBXAXXPWJVHT-UHFFFAOYSA-N -1 1 319.719 3.861 20 10 DHCDMM O=C(NCc1cccc(Cl)c1[O-])[C@@H]1CCc2cc(F)ccc21 ZINC001180421146 1035680258 /nfs/dbraw/zinc/68/02/58/1035680258.db2.gz XHLFUMZBUVLCHK-CQSZACIVSA-N -1 1 319.763 3.531 20 10 DHCDMM Cc1cc(C[NH2+][C@H](C)c2cc(Cl)c(Cl)cc2O)ncn1 ZINC000774266029 1036266866 /nfs/dbraw/zinc/26/68/66/1036266866.db2.gz MYJOREZWJCZIDW-SECBINFHSA-N -1 1 312.200 3.648 20 10 DHCDMM Cc1cc(N[C@@H](C)c2cc(F)cc(F)c2[O-])cc(OCCO)c1 ZINC000774506725 1036371907 /nfs/dbraw/zinc/37/19/07/1036371907.db2.gz AYFMUIBQMTWJQY-NSHDSACASA-N -1 1 323.339 3.523 20 10 DHCDMM O=S(=O)([N-]c1ccc(O)cc1F)c1cc2ccccc2s1 ZINC001185454682 1037147721 /nfs/dbraw/zinc/14/77/21/1037147721.db2.gz SCMZSYOVVBGGFZ-UHFFFAOYSA-N -1 1 323.370 3.547 20 10 DHCDMM Cc1csc([C@H](C)NCc2cc(Cl)cc(F)c2[O-])n1 ZINC000776163102 1037636422 /nfs/dbraw/zinc/63/64/22/1037636422.db2.gz OTCMKHWTJNVSLF-QMMMGPOBSA-N -1 1 300.786 3.800 20 10 DHCDMM [O-]c1c(Cl)cccc1CNc1nc2ccccc2nc1F ZINC001187861665 1037740398 /nfs/dbraw/zinc/74/03/98/1037740398.db2.gz OGENOWPBSSVLBC-UHFFFAOYSA-N -1 1 303.724 3.740 20 10 DHCDMM [O-]c1c(Cl)cccc1CNc1ncnc2ccc(F)cc21 ZINC001187862301 1037740626 /nfs/dbraw/zinc/74/06/26/1037740626.db2.gz RWBRVPRUHWJLFB-UHFFFAOYSA-N -1 1 303.724 3.740 20 10 DHCDMM CON(Cc1ccccc1)Cc1cc(Cl)cc(C(C)=O)c1[O-] ZINC001192481091 1038669624 /nfs/dbraw/zinc/66/96/24/1038669624.db2.gz IKSLJDAOOCIYAX-UHFFFAOYSA-N -1 1 319.788 3.812 20 10 DHCDMM C[C@@H](N[C@@H](C)c1cc([N+](=O)[O-])ccc1[O-])c1c(F)cccc1F ZINC000273396259 130115442 /nfs/dbraw/zinc/11/54/42/130115442.db2.gz LWSZBGGSPZGOOO-VHSXEESVSA-N -1 1 322.311 3.990 20 10 DHCDMM C[C@H](N[C@@H]1COc2cccc(F)c21)c1ccc(F)c(F)c1[O-] ZINC000364789722 525586278 /nfs/dbraw/zinc/58/62/78/525586278.db2.gz NASOAEOWWOGJJL-QPUJVOFHSA-N -1 1 309.287 3.594 20 10 DHCDMM C[C@@H](N[C@@H]1COc2cccc(F)c21)c1ccc(F)c(F)c1[O-] ZINC000364789721 525651991 /nfs/dbraw/zinc/65/19/91/525651991.db2.gz NASOAEOWWOGJJL-PRHODGIISA-N -1 1 309.287 3.594 20 10 DHCDMM CC[C@H](NCc1ncnn1C(C)(C)C)c1cccc(Cl)c1[O-] ZINC000287104637 535921947 /nfs/dbraw/zinc/92/19/47/535921947.db2.gz QHDAEYLLTQPTGP-ZDUSSCGKSA-N -1 1 322.840 3.633 20 10 DHCDMM CC(C)c1ncc(C(=O)NCc2cccc(Cl)c2[O-])s1 ZINC000890760402 1013334039 /nfs/dbraw/zinc/33/40/39/1013334039.db2.gz QVLUERCRYIOMGZ-UHFFFAOYSA-N -1 1 310.806 3.556 20 10 DHCDMM CC(C)(CC(F)(F)F)C(=O)NCc1cccc(Cl)c1[O-] ZINC000890761031 1013336078 /nfs/dbraw/zinc/33/60/78/1013336078.db2.gz IWBZZHCJEBICEM-UHFFFAOYSA-N -1 1 309.715 3.640 20 10 DHCDMM CC1(C(=O)NCc2cccc(Cl)c2[O-])CCC(F)(F)CC1 ZINC000890763500 1013345386 /nfs/dbraw/zinc/34/53/86/1013345386.db2.gz XBSZPTLIWSBSNI-UHFFFAOYSA-N -1 1 317.763 3.877 20 10 DHCDMM CC[C@H](C)c1nnc([C@@H](C)N[C@H](C)c2ccc(F)c(F)c2[O-])[nH]1 ZINC000276816332 1015679770 /nfs/dbraw/zinc/67/97/70/1015679770.db2.gz AGZILKAEYIZTBO-IVZWLZJFSA-N -1 1 324.375 3.714 20 10 DHCDMM C[C@@H]([NH2+]Cc1ccccc1CC(=O)[O-])c1cc(Cl)ccc1[O-] ZINC001593304454 994748252 /nfs/dbraw/zinc/74/82/52/994748252.db2.gz NVHUSUJMWPQDFY-LLVKDONJSA-N -1 1 319.788 3.524 20 10 DHCDMM COc1ccc2c(c1)N(Cc1cc(Cl)cc(F)c1[O-])CCO2 ZINC000765650967 1019028530 /nfs/dbraw/zinc/02/85/30/1019028530.db2.gz JJQBFNYHPUZJPD-UHFFFAOYSA-N -1 1 323.751 3.592 20 10 DHCDMM Cn1c(=O)ccc2ccc(NCc3cccc(Cl)c3[O-])cc21 ZINC000787295240 1023779692 /nfs/dbraw/zinc/77/96/92/1023779692.db2.gz AEEKXJJOQLBDGS-UHFFFAOYSA-N -1 1 314.772 3.510 20 10 DHCDMM COC(=O)Nc1ccc(NCc2c([O-])ccc(Cl)c2F)cc1 ZINC000790953452 1024405340 /nfs/dbraw/zinc/40/53/40/1024405340.db2.gz ZJPYNLVLLXIJKP-UHFFFAOYSA-N -1 1 324.739 3.975 20 10 DHCDMM C[C@H](C1CC1)n1cc(NCc2c([O-])ccc(Cl)c2F)cn1 ZINC000790989138 1024411804 /nfs/dbraw/zinc/41/18/04/1024411804.db2.gz YIWRLYMROVAKDC-SECBINFHSA-N -1 1 309.772 3.964 20 10 DHCDMM CO[C@H]1Cc2ccc(NCc3c([O-])ccc(Cl)c3F)cc2C1 ZINC000790986292 1024412129 /nfs/dbraw/zinc/41/21/29/1024412129.db2.gz MPVZRDRZJSZOIT-ZDUSSCGKSA-N -1 1 321.779 3.910 20 10 DHCDMM CC(C)n1ccnc1CNCc1cc(Cl)cc(Cl)c1[O-] ZINC000825939645 1033261262 /nfs/dbraw/zinc/26/12/62/1033261262.db2.gz FEACCPOIUGJRIE-UHFFFAOYSA-N -1 1 314.216 3.766 20 10 DHCDMM O=C(NCc1cccc(Cl)c1[O-])Nc1cccc(C2CC2)n1 ZINC000931550872 1027167035 /nfs/dbraw/zinc/16/70/35/1027167035.db2.gz DXWJNTKBUZGTLR-UHFFFAOYSA-N -1 1 317.776 3.640 20 10 DHCDMM C[C@@H](C1CC1)n1nccc1NCc1cc(Cl)c(F)cc1[O-] ZINC000816546703 1028928455 /nfs/dbraw/zinc/92/84/55/1028928455.db2.gz SZWVMQBOMJDLJP-VIFPVBQESA-N -1 1 309.772 3.964 20 10 DHCDMM [O-]c1cc(F)c(Cl)cc1CNc1ccc(-n2ccnc2)cc1 ZINC000816522795 1028932343 /nfs/dbraw/zinc/93/23/43/1028932343.db2.gz NYJQEWZONVCUOM-UHFFFAOYSA-N -1 1 317.751 3.983 20 10 DHCDMM C[S@@](=O)c1cccc(NCc2cc(Cl)c(F)cc2[O-])c1 ZINC000816526118 1028932864 /nfs/dbraw/zinc/93/28/64/1028932864.db2.gz UOJFBZNHTLYDAQ-HXUWFJFHSA-N -1 1 313.781 3.534 20 10 DHCDMM [O-]c1cc(F)c(Cl)cc1CNc1ccc(OC(F)F)nc1 ZINC000816600555 1028956468 /nfs/dbraw/zinc/95/64/68/1028956468.db2.gz AYXIDHBKTXMQAZ-UHFFFAOYSA-N -1 1 318.682 3.793 20 10 DHCDMM C[C@H]1C[C@H](NCc2cc(Cl)cc(Cl)c2[O-])c2nccn21 ZINC000825017599 1030699204 /nfs/dbraw/zinc/69/92/04/1030699204.db2.gz VOJUMCFFRCGHOJ-UFBFGSQYSA-N -1 1 312.200 3.691 20 10 DHCDMM CN(Cc1cc(F)c(F)cc1[O-])[C@@H](C1CCC1)C(F)(F)F ZINC001142527363 1031910918 /nfs/dbraw/zinc/91/09/18/1031910918.db2.gz SHWLIOYGBVYSEW-ZDUSSCGKSA-N -1 1 309.278 3.833 20 10 DHCDMM C[C@H](NCc1nc(C2CC2)cs1)c1ccc(F)c(F)c1[O-] ZINC000187796886 1034733253 /nfs/dbraw/zinc/73/32/53/1034733253.db2.gz PHTKZUJUNBLION-QMMMGPOBSA-N -1 1 310.369 3.855 20 10 DHCDMM O=C(NCc1cccc(Cl)c1[O-])[C@H]1CCc2cc(F)ccc21 ZINC001180421144 1035679293 /nfs/dbraw/zinc/67/92/93/1035679293.db2.gz XHLFUMZBUVLCHK-AWEZNQCLSA-N -1 1 319.763 3.531 20 10 DHCDMM C[C@@H]1[C@H](C(F)(F)F)CCC[N@H+]1Cc1cc(F)cc(F)c1O ZINC001180970704 1035798246 /nfs/dbraw/zinc/79/82/46/1035798246.db2.gz WBKRXVGVKNVVRO-LDYMZIIASA-N -1 1 309.278 3.833 20 10 DHCDMM COC(=O)N(C)c1ccc(NCc2cccc(Cl)c2[O-])cc1 ZINC000775748236 1036630861 /nfs/dbraw/zinc/63/08/61/1036630861.db2.gz YQBVADBCMVNHAQ-UHFFFAOYSA-N -1 1 320.776 3.860 20 10 DHCDMM COCCOc1ccccc1NCc1cccc(Cl)c1[O-] ZINC000775754850 1036666899 /nfs/dbraw/zinc/66/68/99/1036666899.db2.gz CUGDSGXFKXNGEU-UHFFFAOYSA-N -1 1 307.777 3.683 20 10 DHCDMM O=C(NCc1cccc(Br)c1[O-])C1CCC=CCC1 ZINC000822459584 1037041505 /nfs/dbraw/zinc/04/15/05/1037041505.db2.gz WLHCGPFLFDEHLL-UHFFFAOYSA-N -1 1 324.218 3.517 20 10 DHCDMM [O-]c1c(Cl)cccc1CNc1cccc(-c2nnco2)c1 ZINC000158015908 1039754730 /nfs/dbraw/zinc/75/47/30/1039754730.db2.gz MOXZJKYYCWWCEF-UHFFFAOYSA-N -1 1 301.733 3.708 20 10 DHCDMM COC(=O)Nc1cccc(NCc2cccc(Cl)c2[O-])c1 ZINC000158047956 1039780385 /nfs/dbraw/zinc/78/03/85/1039780385.db2.gz DERIAVFVLIZLBX-UHFFFAOYSA-N -1 1 306.749 3.836 20 10 DHCDMM O=C1N[C@H](c2cccc(Cl)c2[O-])Nc2cccc(Cl)c21 ZINC000172863230 1040065466 /nfs/dbraw/zinc/06/54/66/1040065466.db2.gz MUNKNQFHSCWZFJ-CYBMUJFWSA-N -1 1 309.152 3.553 20 10 DHCDMM CCC[N@H+](CC(=O)[O-])Cc1cc2oc3ccccc3c2cc1[O-] ZINC000737014382 599992610 /nfs/dbraw/zinc/99/26/10/599992610.db2.gz HXQLAGAEOJVXLU-UHFFFAOYSA-N -1 1 313.353 3.588 20 10 DHCDMM CCC[N@@H+](CC(=O)[O-])Cc1cc2oc3ccccc3c2cc1[O-] ZINC000737014382 599992611 /nfs/dbraw/zinc/99/26/11/599992611.db2.gz HXQLAGAEOJVXLU-UHFFFAOYSA-N -1 1 313.353 3.588 20 10 DHCDMM [O-]c1c(CN[C@H]2c3ccccc3CC[C@H]2F)ccc(F)c1F ZINC000895690222 1015257454 /nfs/dbraw/zinc/25/74/54/1015257454.db2.gz CCLZMRLGOGKBJI-ZBFHGGJFSA-N -1 1 307.315 3.786 20 10 DHCDMM C[N@@H+](Cc1ccc(C(=O)[O-])cc1)Cc1cc(Cl)c(F)cc1[O-] ZINC001598512963 992581736 /nfs/dbraw/zinc/58/17/36/992581736.db2.gz DLNJQSNEUKKFFL-UHFFFAOYSA-N -1 1 323.751 3.515 20 10 DHCDMM C[C@@H](Cc1ccsc1)NC(=O)NCc1cccc(Cl)c1[O-] ZINC000892233063 1016535168 /nfs/dbraw/zinc/53/51/68/1016535168.db2.gz OBLADOCVKZXELE-JTQLQIEISA-N -1 1 324.833 3.538 20 10 DHCDMM COc1nc(C)cc(C)c1CN(C)Cc1cccc(Cl)c1[O-] ZINC000857068939 1022940227 /nfs/dbraw/zinc/94/02/27/1022940227.db2.gz JJGNZDCSUGSHTN-UHFFFAOYSA-N -1 1 320.820 3.698 20 10 DHCDMM Cc1nc(C)c(C[NH2+]Cc2c(O)ccc(Cl)c2F)s1 ZINC000790974364 1024420161 /nfs/dbraw/zinc/42/01/61/1024420161.db2.gz UDFBJENLABBRDT-UHFFFAOYSA-N -1 1 300.786 3.548 20 10 DHCDMM CO[C@@H](C)c1nc(CN[C@@H](C)c2c([O-])cccc2F)cs1 ZINC000886536743 1025684078 /nfs/dbraw/zinc/68/40/78/1025684078.db2.gz NXUUMEYTHCJYOK-UWVGGRQHSA-N -1 1 310.394 3.546 20 10 DHCDMM C[C@H]1Oc2ccccc2[C@@H]1[NH2+]Cc1c(O)ccc(Cl)c1F ZINC000808443086 1026286969 /nfs/dbraw/zinc/28/69/69/1026286969.db2.gz AILQHXKTNPQAKY-JDNHERCYSA-N -1 1 307.752 3.797 20 10 DHCDMM CC[C@H](CC(F)(F)F)NC(=O)NCc1cccc(Cl)c1[O-] ZINC000894212334 1026443274 /nfs/dbraw/zinc/44/32/74/1026443274.db2.gz JJGUIKWGELUEFJ-SECBINFHSA-N -1 1 324.730 3.576 20 10 DHCDMM CC1(C)CN(Cc2cc(Cl)cc(F)c2[O-])[C@H]1[C@@H]1CCCO1 ZINC000811510354 1027026306 /nfs/dbraw/zinc/02/63/06/1027026306.db2.gz CYJDNNTYMOFFRG-ZFWWWQNUSA-N -1 1 313.800 3.574 20 10 DHCDMM [O-]c1c(Cl)cc(Cl)cc1CNCc1cnc(C2CC2)o1 ZINC000825172355 1030739180 /nfs/dbraw/zinc/73/91/80/1030739180.db2.gz PGGKKEZYKAFBRE-UHFFFAOYSA-N -1 1 313.184 3.854 20 10 DHCDMM Cc1ccc(-c2ccc(C=C3SC(=S)[N-]C3=O)o2)cc1 ZINC000019798917 1031701563 /nfs/dbraw/zinc/70/15/63/1031701563.db2.gz RCBMCYDIJCNXTE-JYRVWZFOSA-N -1 1 301.392 3.744 20 10 DHCDMM O=C(C/C=C\c1ccc(F)cc1)NCc1cccc(Cl)c1[O-] ZINC001180409852 1035672755 /nfs/dbraw/zinc/67/27/55/1035672755.db2.gz GXPCUEDUMMQAPJ-IWQZZHSRSA-N -1 1 319.763 3.904 20 10 DHCDMM CC(C)[C@H]1CC[C@@H](C)C[C@H]1CNC(=O)c1c(F)ccc(O)c1[O-] ZINC001182510292 1036369910 /nfs/dbraw/zinc/36/99/10/1036369910.db2.gz QJCHRFNXIJDBFZ-FRRDWIJNSA-N -1 1 323.408 3.675 20 10 DHCDMM [O-]c1c(Cl)cccc1CNc1nnc(C(F)(F)F)s1 ZINC001187861233 1037740867 /nfs/dbraw/zinc/74/08/67/1037740867.db2.gz IYYQMHWXAXKKDX-UHFFFAOYSA-N -1 1 309.700 3.528 20 10 DHCDMM CC(=O)c1cc(Cl)cc(CN2CCc3ccsc3C2)c1[O-] ZINC000761123466 1040200582 /nfs/dbraw/zinc/20/05/82/1040200582.db2.gz OEWUQYTUXKNDCR-UHFFFAOYSA-N -1 1 321.829 3.868 20 10 DHCDMM Cc1cccc2cc(C=C3SC(=S)[N-]C3=O)c(Cl)nc12 ZINC000007155176 181442419 /nfs/dbraw/zinc/44/24/19/181442419.db2.gz JQOKIJSOAWHBQK-POHAHGRESA-N -1 1 320.826 3.685 20 10 DHCDMM C[C@@H]([NH2+]Cc1ccc(C(=O)[O-])cc1)c1cc(Cl)ccc1[O-] ZINC001589128802 956183514 /nfs/dbraw/zinc/18/35/14/956183514.db2.gz NWHLXZQKGMMVKF-SNVBAGLBSA-N -1 1 305.761 3.595 20 10 DHCDMM Cc1cc([O-])c(C[NH2+][C@@H](CCC(C)(C)C)C(=O)[O-])cc1Cl ZINC001594326706 958180173 /nfs/dbraw/zinc/18/01/73/958180173.db2.gz IGDQJQWJTQCXJW-ZDUSSCGKSA-N -1 1 313.825 3.723 20 10 DHCDMM O=C(NCc1cccc(Cl)c1[O-])C1(Cc2ccccc2)CC1 ZINC000890760590 1013332804 /nfs/dbraw/zinc/33/28/04/1013332804.db2.gz UJIDADKREIQMHD-UHFFFAOYSA-N -1 1 315.800 3.685 20 10 DHCDMM CC(C)(C)c1ncsc1C(=O)NCc1cccc(Cl)c1[O-] ZINC000890760400 1013333953 /nfs/dbraw/zinc/33/39/53/1013333953.db2.gz QUVYUHUSWWMZPR-UHFFFAOYSA-N -1 1 324.833 3.730 20 10 DHCDMM CC(C)C[C@@H](C)OCCC(=O)NCc1cccc(Cl)c1[O-] ZINC000890760348 1013334903 /nfs/dbraw/zinc/33/49/03/1013334903.db2.gz PALFRUMICPVXBZ-GFCCVEGCSA-N -1 1 313.825 3.503 20 10 DHCDMM C[C@H]([NH2+]Cc1ccccc1CC(=O)[O-])c1cc(Cl)ccc1[O-] ZINC001593304455 994747918 /nfs/dbraw/zinc/74/79/18/994747918.db2.gz NVHUSUJMWPQDFY-NSHDSACASA-N -1 1 319.788 3.524 20 10 DHCDMM O=C(NCc1cccc(Cl)c1[O-])N[C@H]1CCCc2occc21 ZINC000891974409 1015988400 /nfs/dbraw/zinc/98/84/00/1015988400.db2.gz OBSKRCYMBXZUSG-ZDUSSCGKSA-N -1 1 320.776 3.515 20 10 DHCDMM O=C(NCc1cccc(Cl)c1[O-])N[C@@H]1CCCc2occc21 ZINC000891974408 1015988947 /nfs/dbraw/zinc/98/89/47/1015988947.db2.gz OBSKRCYMBXZUSG-CYBMUJFWSA-N -1 1 320.776 3.515 20 10 DHCDMM O=C(NCc1cccc(Br)c1[O-])C1=CCCCCC1 ZINC000277582100 1016703370 /nfs/dbraw/zinc/70/33/70/1016703370.db2.gz RMIJGPJXHPJGTE-UHFFFAOYSA-N -1 1 324.218 3.661 20 10 DHCDMM Cc1c(NCc2cccc(Br)c2[O-])n[nH]c1C(C)C ZINC000842748370 1018254607 /nfs/dbraw/zinc/25/46/07/1018254607.db2.gz CCHASQGIIGDKGI-UHFFFAOYSA-N -1 1 324.222 3.922 20 10 DHCDMM [O-]c1c(Cl)cc(Cl)cc1CN[C@H](c1ncccn1)C1CC1 ZINC000922579766 1020138284 /nfs/dbraw/zinc/13/82/84/1020138284.db2.gz LLTMISFDYQXUFI-ZDUSSCGKSA-N -1 1 324.211 3.730 20 10 DHCDMM Cc1cc([N-]S(=O)(=O)c2cccc3ccccc32)ccc1O ZINC000182476359 1021557882 /nfs/dbraw/zinc/55/78/82/1021557882.db2.gz DHSBISLRLLQXGD-UHFFFAOYSA-N -1 1 313.378 3.655 20 10 DHCDMM CC[C@@H](NCc1ncccn1)c1cc(Cl)cc(Cl)c1[O-] ZINC000850551724 1021600890 /nfs/dbraw/zinc/60/08/90/1021600890.db2.gz JMNZTGQFEKSWHF-GFCCVEGCSA-N -1 1 312.200 3.730 20 10 DHCDMM Cc1ccc(/C=C\S(=O)(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000776750331 1022499785 /nfs/dbraw/zinc/49/97/85/1022499785.db2.gz AGYAZBFEZJDWTG-HJWRWDBZSA-N -1 1 323.801 3.767 20 10 DHCDMM Cc1ccc(/C=C/S(=O)(=O)Nc2ccc([O-])c(Cl)c2)cc1 ZINC000776750329 1022501605 /nfs/dbraw/zinc/50/16/05/1022501605.db2.gz AGYAZBFEZJDWTG-CMDGGOBGSA-N -1 1 323.801 3.767 20 10 DHCDMM Cn1c2cccc(F)c2nc1NCc1c([O-])ccc(Cl)c1F ZINC000790240512 1024250547 /nfs/dbraw/zinc/25/05/47/1024250547.db2.gz GZJDPGKYRCFDST-UHFFFAOYSA-N -1 1 323.730 3.823 20 10 DHCDMM [O-]c1c(Br)cccc1CN1CCc2ccccc21 ZINC000131794340 1024434483 /nfs/dbraw/zinc/43/44/83/1024434483.db2.gz JUTODRWXWDGCBR-UHFFFAOYSA-N -1 1 304.187 3.717 20 10 DHCDMM CC[C@@H](NCc1ccon1)c1cc(Cl)cc(Cl)c1[O-] ZINC000806141775 1025805283 /nfs/dbraw/zinc/80/52/83/1025805283.db2.gz LZMFHDWNMJEKEE-GFCCVEGCSA-N -1 1 301.173 3.928 20 10 DHCDMM CCn1ccnc1CN[C@@H](C)c1ccc(Cl)c(Cl)c1[O-] ZINC000295836742 1027451011 /nfs/dbraw/zinc/45/10/11/1027451011.db2.gz AFXZGSLJWJIBEK-VIFPVBQESA-N -1 1 314.216 3.766 20 10 DHCDMM CCCN1C(=O)c2ccccc2N[C@@H]1c1cccc(F)c1[O-] ZINC000778519203 1028677956 /nfs/dbraw/zinc/67/79/56/1028677956.db2.gz GIHRGPBVSNDJJN-INIZCTEOSA-N -1 1 300.333 3.508 20 10 DHCDMM CC(C)c1cc(NCc2cccc(Br)c2[O-])no1 ZINC000777519267 1030080628 /nfs/dbraw/zinc/08/06/28/1030080628.db2.gz MEAJWNTYDXFJMK-UHFFFAOYSA-N -1 1 311.179 3.878 20 10 DHCDMM C[C@H]1C[C@@H](NCc2cc(Cl)cc(Cl)c2[O-])c2nccn21 ZINC000825017598 1030701002 /nfs/dbraw/zinc/70/10/02/1030701002.db2.gz VOJUMCFFRCGHOJ-QPUJVOFHSA-N -1 1 312.200 3.691 20 10 DHCDMM CC(C)(C)C(=O)c1ccc(NC(=O)c2cccc(O)c2[O-])cc1 ZINC001137044780 1030827733 /nfs/dbraw/zinc/82/77/33/1030827733.db2.gz MJKCXIJSDMMYDJ-UHFFFAOYSA-N -1 1 313.353 3.579 20 10 DHCDMM [O-]c1c(F)cc(Cl)cc1CN1CC(c2ccc(F)cc2)C1 ZINC001206174051 1033336733 /nfs/dbraw/zinc/33/67/33/1033336733.db2.gz GRYIZLAJFFAKEL-UHFFFAOYSA-N -1 1 309.743 3.923 20 10 DHCDMM CCc1nc2cc(NCc3cc(F)cc(F)c3[O-])ccc2o1 ZINC001177399860 1035368515 /nfs/dbraw/zinc/36/85/15/1035368515.db2.gz OWBZLFHRVHICPS-UHFFFAOYSA-N -1 1 304.296 3.986 20 10 DHCDMM CC(C)(C)C1CCN(C(=O)c2ccc(O)c([O-])c2Cl)CC1 ZINC001193209975 1035587382 /nfs/dbraw/zinc/58/73/82/1035587382.db2.gz SAYALWFZNLURIN-UHFFFAOYSA-N -1 1 311.809 3.650 20 10 DHCDMM O=C(NCc1cccc(Cl)c1[O-])c1ccc2ccncc2c1 ZINC001180420749 1035676309 /nfs/dbraw/zinc/67/63/09/1035676309.db2.gz OCHFXTYMQRXTKX-UHFFFAOYSA-N -1 1 312.756 3.524 20 10 DHCDMM COC(=O)[C@@H](C)c1cccc(NCc2cc(F)cc(F)c2[O-])c1 ZINC001182332530 1036233222 /nfs/dbraw/zinc/23/32/22/1036233222.db2.gz DDFAJWXKBBMCLQ-JTQLQIEISA-N -1 1 321.323 3.559 20 10 DHCDMM C[N@@H+](Cc1c(O)ccc(Cl)c1F)C1CC(OC(C)(C)C)C1 ZINC001182443478 1036302497 /nfs/dbraw/zinc/30/24/97/1036302497.db2.gz JUSGXARWCHZIKX-UHFFFAOYSA-N -1 1 315.816 3.963 20 10 DHCDMM CN(Cc1cc(Cl)cn1C)Cc1cc(Cl)cc(F)c1[O-] ZINC000775736905 1036587307 /nfs/dbraw/zinc/58/73/07/1036587307.db2.gz FXNMKAKFTDLIDQ-UHFFFAOYSA-N -1 1 317.191 3.809 20 10 DHCDMM O=C(CSc1ccc2ccccc2n1)c1ccc([O-])c(O)c1 ZINC000005627020 1037741544 /nfs/dbraw/zinc/74/15/44/1037741544.db2.gz OLTONGSWHUCPLK-UHFFFAOYSA-N -1 1 311.362 3.621 20 10 DHCDMM CCOc1cccc(NCc2cccc(Br)c2[O-])n1 ZINC000776250377 1038068031 /nfs/dbraw/zinc/06/80/31/1038068031.db2.gz HQZMCFWWOKHDKR-UHFFFAOYSA-N -1 1 323.190 3.561 20 10 DHCDMM C[C@H](NC(=O)c1c([O-])cccc1Cl)c1ccc(N(C)C)cc1 ZINC000775405047 1038373152 /nfs/dbraw/zinc/37/31/52/1038373152.db2.gz QBCMDJRUKPUCJG-NSHDSACASA-N -1 1 318.804 3.603 20 10 DHCDMM CC[C@@H](NCc1cocn1)c1ccc(Cl)c(Cl)c1[O-] ZINC000775536643 1038678808 /nfs/dbraw/zinc/67/88/08/1038678808.db2.gz LGZICRZFJVBNQZ-LLVKDONJSA-N -1 1 301.173 3.928 20 10 DHCDMM CO[C@@H]1Cc2ccc(N[C@@H](C)c3cc(F)cc(F)c3[O-])cc2C1 ZINC000760888864 1038976339 /nfs/dbraw/zinc/97/63/39/1038976339.db2.gz ZECOFNIUDQLITO-ZUZCIYMTSA-N -1 1 319.351 3.957 20 10 DHCDMM CC(=O)Nc1cc(NCc2cccc(Cl)c2[O-])ccc1C ZINC000158052715 1039772339 /nfs/dbraw/zinc/77/23/39/1039772339.db2.gz FJCMKRURXGDDTI-UHFFFAOYSA-N -1 1 304.777 3.925 20 10 DHCDMM O=C1CSc2ccc(NCc3cccc(Cl)c3[O-])cc2N1 ZINC000158063831 1039775075 /nfs/dbraw/zinc/77/50/75/1039775075.db2.gz CNVLMQVAGROZDY-UHFFFAOYSA-N -1 1 320.801 3.702 20 10 DHCDMM Cc1nc(C(C)C)sc1C(=O)NCc1cccc(Cl)c1[O-] ZINC000890757490 1013328477 /nfs/dbraw/zinc/32/84/77/1013328477.db2.gz FMFUNNFFHNRABC-UHFFFAOYSA-N -1 1 324.833 3.864 20 10 DHCDMM CCC[C@@H](C(=O)NCc1cccc(Cl)c1[O-])c1ccccn1 ZINC000890759396 1013332983 /nfs/dbraw/zinc/33/29/83/1013332983.db2.gz KUOIMRSGEKXRIY-CYBMUJFWSA-N -1 1 318.804 3.641 20 10 DHCDMM O=C(NCc1cccc(Cl)c1[O-])[C@H]1CC[C@@H](C(F)(F)F)C1 ZINC000890759934 1013333422 /nfs/dbraw/zinc/33/34/22/1013333422.db2.gz WGCGUDVGDOTBEM-WCBMZHEXSA-N -1 1 321.726 3.640 20 10 DHCDMM CC[C@@H](CC(F)(F)F)C(=O)NCc1cccc(Cl)c1[O-] ZINC000890761513 1013338065 /nfs/dbraw/zinc/33/80/65/1013338065.db2.gz UMPNXPPUWSAJFG-QMMMGPOBSA-N -1 1 309.715 3.640 20 10 DHCDMM C[N@@H+](Cc1ccc(F)cc1)Cc1c(O)cccc1Br ZINC001140098506 1013430404 /nfs/dbraw/zinc/43/04/04/1013430404.db2.gz CGXLNNOPRHJDLF-UHFFFAOYSA-N -1 1 324.193 3.926 20 10 DHCDMM Cc1ccc(-c2ncc(C=C3SC(=S)[N-]C3=O)s2)cc1 ZINC000255303943 1014835374 /nfs/dbraw/zinc/83/53/74/1014835374.db2.gz SISDOBUTSQJPMK-IZZDOVSWSA-N -1 1 318.448 3.607 20 10 DHCDMM C[C@H](N[C@H](C(=O)[O-])c1c(F)cccc1Cl)c1ccccc1O ZINC001599901142 984829722 /nfs/dbraw/zinc/82/97/22/984829722.db2.gz TWLUPXFMQHKILC-VFZGTOFNSA-N -1 1 323.751 3.661 20 10 DHCDMM CN(Cc1ccns1)Cc1cc(Cl)cc(Cl)c1[O-] ZINC000895453265 1015155628 /nfs/dbraw/zinc/15/56/28/1015155628.db2.gz HRUGQUIWFKIELS-UHFFFAOYSA-N -1 1 303.214 3.788 20 10 DHCDMM CC(=O)c1cc(Cl)cc(CN2CCn3cccc3[C@@H]2C)c1[O-] ZINC000177236697 1020536703 /nfs/dbraw/zinc/53/67/03/1020536703.db2.gz GVMLNLBUUGQWAN-NSHDSACASA-N -1 1 318.804 3.627 20 10 DHCDMM C[C@]1(F)CCN(Cc2cc(Cl)c(Cl)cc2[O-])C[C@H]1F ZINC001236792082 1021265877 /nfs/dbraw/zinc/26/58/77/1021265877.db2.gz BFVLSNKMXUBRQW-OLZOCXBDSA-N -1 1 310.171 3.971 20 10 DHCDMM CCCc1nccnc1NCc1cccc(Br)c1[O-] ZINC000853027695 1022202543 /nfs/dbraw/zinc/20/25/43/1022202543.db2.gz DSAPKWYWCFTZJQ-UHFFFAOYSA-N -1 1 322.206 3.509 20 10 DHCDMM O=C1[N-]C(=S)S/C1=C\c1cc(Cl)c2ccccc2c1O ZINC000180484453 1022736492 /nfs/dbraw/zinc/73/64/92/1022736492.db2.gz NTBSYJRROWPMRO-WDZFZDKYSA-N -1 1 321.810 3.688 20 10 DHCDMM Cc1occc1C[N@@H+](C)Cc1cccc(Br)c1O ZINC000092438678 1022843096 /nfs/dbraw/zinc/84/30/96/1022843096.db2.gz COKPRSDSJXDAEU-UHFFFAOYSA-N -1 1 310.191 3.688 20 10 DHCDMM CC(=O)N(C)c1ccc(NCc2c([O-])ccc(Cl)c2F)cc1 ZINC000790972727 1024420200 /nfs/dbraw/zinc/42/02/00/1024420200.db2.gz GKKIRSQINMDOKM-UHFFFAOYSA-N -1 1 322.767 3.780 20 10 DHCDMM Cc1cc(Cl)cc(C)c1NCC(=O)c1ccc([O-])c(O)c1 ZINC001170314787 1024741128 /nfs/dbraw/zinc/74/11/28/1024741128.db2.gz ILXUWYJMUKLICM-UHFFFAOYSA-N -1 1 305.761 3.663 20 10 DHCDMM O=C(CNc1ccc(F)c2ccccc12)c1ccc([O-])c(O)c1 ZINC001170315187 1024742245 /nfs/dbraw/zinc/74/22/45/1024742245.db2.gz SWRUVKUXAYAMJY-UHFFFAOYSA-N -1 1 311.312 3.685 20 10 DHCDMM Oc1cccc(Br)c1C[NH+]1CC(CC(F)(F)F)C1 ZINC000862389160 1024789919 /nfs/dbraw/zinc/78/99/19/1024789919.db2.gz GTLSUJHORUQSCJ-UHFFFAOYSA-N -1 1 324.140 3.539 20 10 DHCDMM COCc1ccc([C@H]2CCCN2Cc2ccc(F)c(F)c2[O-])o1 ZINC000877395905 1033293860 /nfs/dbraw/zinc/29/38/60/1033293860.db2.gz PBDRBTZOGAFQTD-CQSZACIVSA-N -1 1 323.339 3.747 20 10 DHCDMM CO[C@H](C)c1nc(CN[C@@H](C)c2c([O-])cccc2F)cs1 ZINC000886536744 1025684525 /nfs/dbraw/zinc/68/45/25/1025684525.db2.gz NXUUMEYTHCJYOK-VHSXEESVSA-N -1 1 310.394 3.546 20 10 DHCDMM Cc1ccc2c(c1)CN(Cc1cccc(Cl)c1[O-])CCO2 ZINC000809704257 1026600113 /nfs/dbraw/zinc/60/01/13/1026600113.db2.gz XNVUKBJSMQKDDY-UHFFFAOYSA-N -1 1 303.789 3.749 20 10 DHCDMM CC(C)CN1C(=O)c2ccccc2N[C@H]1c1cccc(F)c1[O-] ZINC000778519576 1028680459 /nfs/dbraw/zinc/68/04/59/1028680459.db2.gz IQZSDMKTPVOEIJ-QGZVFWFLSA-N -1 1 314.360 3.754 20 10 DHCDMM COc1ccc(OC)c(NCc2cc(Cl)c(F)cc2[O-])c1 ZINC000816524388 1028932845 /nfs/dbraw/zinc/93/28/45/1028932845.db2.gz DDQUIOFEUQBACH-UHFFFAOYSA-N -1 1 311.740 3.814 20 10 DHCDMM Cc1c(NCc2cc(Cl)c(F)cc2[O-])cnn1CC(C)C ZINC000816560753 1028945481 /nfs/dbraw/zinc/94/54/81/1028945481.db2.gz ZFIFZVOYJQRTGF-UHFFFAOYSA-N -1 1 311.788 3.958 20 10 DHCDMM Cc1ccc2c(c1)C(=O)N(C)[C@H](c1cc(Cl)c(F)cc1[O-])N2 ZINC000877855896 1033489874 /nfs/dbraw/zinc/48/98/74/1033489874.db2.gz VMBJSQOXTSQMRD-OAHLLOKOSA-N -1 1 320.751 3.689 20 10 DHCDMM COC[C@@H](N[C@@H](C)c1ccc(F)c(F)c1[O-])c1ccc(C)o1 ZINC000187744118 1034727952 /nfs/dbraw/zinc/72/79/52/1034727952.db2.gz SJHWYZOZEAPLKP-GXFFZTMASA-N -1 1 311.328 3.610 20 10 DHCDMM C[C@@H](NCc1nc(C2CC2)cs1)c1ccc(F)c(F)c1[O-] ZINC000187796905 1034733630 /nfs/dbraw/zinc/73/36/30/1034733630.db2.gz PHTKZUJUNBLION-MRVPVSSYSA-N -1 1 310.369 3.855 20 10 DHCDMM CC(C)c1cccc(NC(=O)c2ccc(O)c([O-])c2Cl)n1 ZINC001193208996 1035587742 /nfs/dbraw/zinc/58/77/42/1035587742.db2.gz DRTHTZNMBQYIMG-UHFFFAOYSA-N -1 1 306.749 3.522 20 10 DHCDMM COc1cc(C)c(NC(=O)c2ccc(O)c([O-])c2Cl)cc1C ZINC001193230261 1035597838 /nfs/dbraw/zinc/59/78/38/1035597838.db2.gz STWOUXNQNVNFJU-UHFFFAOYSA-N -1 1 321.760 3.629 20 10 DHCDMM CCN1CCN(Cc2cc(F)cc(F)c2[O-])c2ccccc21 ZINC001180731739 1035755867 /nfs/dbraw/zinc/75/58/67/1035755867.db2.gz BHNYXALJPKOOTH-UHFFFAOYSA-N -1 1 304.340 3.517 20 10 DHCDMM CCC[C@@H]1CCCC[C@H]1CNC(=O)c1c(F)ccc(O)c1[O-] ZINC001183694934 1036652483 /nfs/dbraw/zinc/65/24/83/1036652483.db2.gz SVFUSSPOZMIGJY-NEPJUHHUSA-N -1 1 309.381 3.573 20 10 DHCDMM COC[C@H](NCc1cc(Cl)cc(F)c1[O-])c1ccc(C)o1 ZINC000776229747 1037942962 /nfs/dbraw/zinc/94/29/62/1037942962.db2.gz CNABEDMQZDSSCI-ZDUSSCGKSA-N -1 1 313.756 3.563 20 10 DHCDMM C[C@@H](N[C@@H](C)c1c(F)cccc1F)c1cc([N+](=O)[O-])ccc1[O-] ZINC000273396262 130116127 /nfs/dbraw/zinc/11/61/27/130116127.db2.gz LWSZBGGSPZGOOO-ZJUUUORDSA-N -1 1 322.311 3.990 20 10 DHCDMM C[C@@H](CN(C)C(=O)c1c(F)ccc(O)c1[O-])C1CCCCC1 ZINC000530275713 340784616 /nfs/dbraw/zinc/78/46/16/340784616.db2.gz HQDVKKHEOUTQPW-NSHDSACASA-N -1 1 309.381 3.525 20 10 DHCDMM O=C([O-])CCC1CC[NH+](Cc2c([O-])ccc3ccccc32)CC1 ZINC000321080412 601798683 /nfs/dbraw/zinc/79/86/83/601798683.db2.gz RSKKFRWTFKWNGB-UHFFFAOYSA-N -1 1 313.397 3.622 20 10 DHCDMM CC(C)(C)SCCCC(=O)NCc1cccc(Cl)c1[O-] ZINC000890760407 1013333503 /nfs/dbraw/zinc/33/35/03/1013333503.db2.gz REGNFKDBIXCWND-UHFFFAOYSA-N -1 1 315.866 3.974 20 10 DHCDMM O=C(NCc1cccc(Cl)c1[O-])C1(C(F)(F)F)CCCC1 ZINC000890760987 1013336414 /nfs/dbraw/zinc/33/64/14/1013336414.db2.gz HMKKYXUSJOMZKK-UHFFFAOYSA-N -1 1 321.726 3.785 20 10 DHCDMM Cc1nc(C2CC2)ccc1C(=O)NCc1cccc(Cl)c1[O-] ZINC000890761825 1013339882 /nfs/dbraw/zinc/33/98/82/1013339882.db2.gz ZCRBSUTWXUFIMA-UHFFFAOYSA-N -1 1 316.788 3.556 20 10 DHCDMM COCc1ccccc1NCc1cccc(Br)c1[O-] ZINC000048795849 1013483639 /nfs/dbraw/zinc/48/36/39/1013483639.db2.gz KITGBWCATQDEAF-UHFFFAOYSA-N -1 1 322.202 3.913 20 10 DHCDMM CC[C@H](c1ccccc1)[N@@H+](CC(=O)[O-])Cc1cccc(F)c1[O-] ZINC001595362577 980772729 /nfs/dbraw/zinc/77/27/29/980772729.db2.gz KKGVIGMCAIXOPC-MRXNPFEDSA-N -1 1 317.360 3.569 20 10 DHCDMM Cc1cc(O)ccc1[N-]S(=O)(=O)c1cccc2ccccc21 ZINC000035685904 1012182736 /nfs/dbraw/zinc/18/27/36/1012182736.db2.gz BCGXEWFAUYMENM-UHFFFAOYSA-N -1 1 313.378 3.655 20 10 DHCDMM CCCC[N@H+](C)Cc1c([O-])ccc(C(=O)c2ccccc2)c1[O-] ZINC000728196877 1012377093 /nfs/dbraw/zinc/37/70/93/1012377093.db2.gz XALILTPLSBJVKY-UHFFFAOYSA-N -1 1 313.397 3.561 20 10 DHCDMM CCCC[N@@H+](C)Cc1c([O-])ccc(C(=O)c2ccccc2)c1[O-] ZINC000728196877 1012377114 /nfs/dbraw/zinc/37/71/14/1012377114.db2.gz XALILTPLSBJVKY-UHFFFAOYSA-N -1 1 313.397 3.561 20 10 DHCDMM [O-]c1cc(Cl)c(Cl)cc1CN1CCc2ncsc2C1 ZINC001236798091 1021280136 /nfs/dbraw/zinc/28/01/36/1021280136.db2.gz GJJAJSNRVWWXSA-UHFFFAOYSA-N -1 1 315.225 3.714 20 10 DHCDMM C[C@@H](N[C@@H](C)c1ccc(Cl)c(Cl)c1[O-])c1nccn1C ZINC000850572951 1021616776 /nfs/dbraw/zinc/61/67/76/1021616776.db2.gz RDJZNRQNKUCFBC-DTWKUNHWSA-N -1 1 314.216 3.844 20 10 DHCDMM CC(=O)[C@H]1CCCCN1Cc1c([O-])ccc(Cl)c1Cl ZINC001237085394 1021670278 /nfs/dbraw/zinc/67/02/78/1021670278.db2.gz ZAQUXDKIKRIWGD-GFCCVEGCSA-N -1 1 302.201 3.643 20 10 DHCDMM Cc1c(F)cccc1-c1ccc(C=C2SC(=S)[N-]C2=O)o1 ZINC000114990902 1022972779 /nfs/dbraw/zinc/97/27/79/1022972779.db2.gz FEANFJYAARQCKJ-QPEQYQDCSA-N -1 1 319.382 3.883 20 10 DHCDMM COC(=O)Cc1cccc(NCc2c([O-])ccc(Cl)c2F)c1 ZINC000792173359 1024640344 /nfs/dbraw/zinc/64/03/44/1024640344.db2.gz CHMAEPWQNQOORB-UHFFFAOYSA-N -1 1 323.751 3.512 20 10 DHCDMM C[C@H](N[C@@H]1COc2cc(F)cc(F)c21)c1c([O-])cccc1F ZINC000886587806 1025724053 /nfs/dbraw/zinc/72/40/53/1025724053.db2.gz GCGMQWMERPTCCQ-QPUJVOFHSA-N -1 1 309.287 3.594 20 10 DHCDMM CC[C@H](NCc1cocn1)c1cc(Cl)cc(Cl)c1[O-] ZINC000806153724 1025815826 /nfs/dbraw/zinc/81/58/26/1025815826.db2.gz VCFDWILWXJFRNH-LBPRGKRZSA-N -1 1 301.173 3.928 20 10 DHCDMM C[C@H](O)c1cc(NCc2cc(Cl)cc(F)c2[O-])ccc1F ZINC000809716735 1026603956 /nfs/dbraw/zinc/60/39/56/1026603956.db2.gz YIEWPCXEBDTNHD-QMMMGPOBSA-N -1 1 313.731 3.989 20 10 DHCDMM O=C1CCN(Cc2cc(Cl)cc(F)c2[O-])c2ccccc2N1 ZINC000811508187 1027024913 /nfs/dbraw/zinc/02/49/13/1027024913.db2.gz DYGJBTZBTUYAIR-UHFFFAOYSA-N -1 1 320.751 3.534 20 10 DHCDMM CNC(=O)Oc1cccc(NCc2cc(Cl)cc(F)c2[O-])c1 ZINC000814175312 1027910061 /nfs/dbraw/zinc/91/00/61/1027910061.db2.gz RVSHSCQKCJVBSG-UHFFFAOYSA-N -1 1 324.739 3.515 20 10 DHCDMM O=C(Nc1cccc(N2CCCCC2)c1)c1cc(F)ccc1[O-] ZINC000748036357 1028654958 /nfs/dbraw/zinc/65/49/58/1028654958.db2.gz VBSROOFLWQGREN-UHFFFAOYSA-N -1 1 314.360 3.774 20 10 DHCDMM O=C1CCN(Cc2cc(Cl)c(F)cc2[O-])c2ccccc2N1 ZINC000816613913 1028964829 /nfs/dbraw/zinc/96/48/29/1028964829.db2.gz IKXKMGARUJYUHR-UHFFFAOYSA-N -1 1 320.751 3.534 20 10 DHCDMM CC1(C)CCC[C@H]1[C@H]1CCN(C(=O)c2c([O-])c(O)ccc2F)C1 ZINC000844148682 1030983223 /nfs/dbraw/zinc/98/32/23/1030983223.db2.gz AEMLYYBSYNRLBP-RYUDHWBXSA-N -1 1 321.392 3.525 20 10 DHCDMM [O-]c1cc(F)c(Br)cc1CN1CC2(C1)CCCC2 ZINC001144292270 1031432572 /nfs/dbraw/zinc/43/25/72/1031432572.db2.gz ADKGYCPFKDPCNX-UHFFFAOYSA-N -1 1 314.198 3.670 20 10 DHCDMM CC[C@@H](NCc1nonc1C)c1cc(Cl)cc(Cl)c1[O-] ZINC000872136770 1031530958 /nfs/dbraw/zinc/53/09/58/1031530958.db2.gz ORTMKXSSCMGRBD-LLVKDONJSA-N -1 1 316.188 3.631 20 10 DHCDMM [O-]c1c(Cl)cccc1CNc1ccc2oc(CO)cc2c1 ZINC000864041812 1034272245 /nfs/dbraw/zinc/27/22/45/1034272245.db2.gz REAWXZVISSELPC-UHFFFAOYSA-N -1 1 303.745 3.896 20 10 DHCDMM O=C(NCc1cccc(Cl)c1[O-])c1sccc1Cl ZINC001180409923 1035674108 /nfs/dbraw/zinc/67/41/08/1035674108.db2.gz JKQPWOQOVDSWRJ-UHFFFAOYSA-N -1 1 302.182 3.691 20 10 DHCDMM [O-]c1c(F)cc(Cl)cc1CN1CCC(C(F)(F)F)CC1 ZINC000775647947 1036189447 /nfs/dbraw/zinc/18/94/47/1036189447.db2.gz IYDWHYJLUKFMKB-UHFFFAOYSA-N -1 1 311.706 3.959 20 10 DHCDMM Cc1ccccc1[C@@H]1CN(Cc2cccc(Cl)c2[O-])CCO1 ZINC000775703734 1036485061 /nfs/dbraw/zinc/48/50/61/1036485061.db2.gz WEIPIXREOVKFHD-KRWDZBQOSA-N -1 1 317.816 3.928 20 10 DHCDMM CCC[C@H]1CCCC[C@H]1CNC(=O)c1c(F)ccc(O)c1[O-] ZINC001183694936 1036652301 /nfs/dbraw/zinc/65/23/01/1036652301.db2.gz SVFUSSPOZMIGJY-RYUDHWBXSA-N -1 1 309.381 3.573 20 10 DHCDMM CCCCCOc1ccc(C=C2SC(=S)[N-]C2=O)cc1 ZINC000016406722 182043627 /nfs/dbraw/zinc/04/36/27/182043627.db2.gz NPFOZSGGYPJHKD-RAXLEYEMSA-N -1 1 307.440 3.744 20 10 DHCDMM Cc1cc(O)c(C(C)C)cc1[N-]S(=O)(=O)c1ccsc1 ZINC000285144402 131142286 /nfs/dbraw/zinc/14/22/86/131142286.db2.gz OUQHKAYQKRKSFA-UHFFFAOYSA-N -1 1 311.428 3.686 20 10 DHCDMM CCC(CC)(C[NH2+]Cc1ccc2ccccc2c1[O-])C(=O)[O-] ZINC001589506756 955034788 /nfs/dbraw/zinc/03/47/88/955034788.db2.gz GYEWBYJKNSIOBH-UHFFFAOYSA-N -1 1 301.386 3.526 20 10 DHCDMM CCCCS[C@@H](C)C(=O)NCc1cccc(Cl)c1[O-] ZINC000890757503 1013328401 /nfs/dbraw/zinc/32/84/01/1013328401.db2.gz GCRFGFDBTNWJKL-JTQLQIEISA-N -1 1 301.839 3.584 20 10 DHCDMM Cc1scc(CNC(=O)NCc2cccc(Cl)c2[O-])c1C ZINC000896095554 1015452767 /nfs/dbraw/zinc/45/27/67/1015452767.db2.gz KPKLQFTVVNAUOK-UHFFFAOYSA-N -1 1 324.833 3.723 20 10 DHCDMM CCC(=CC(=O)NCc1cccc(Br)c1[O-])CC ZINC000277513509 1016493974 /nfs/dbraw/zinc/49/39/74/1016493974.db2.gz LDCJIJWFSFNBLP-UHFFFAOYSA-N -1 1 312.207 3.517 20 10 DHCDMM [O-]c1c(Br)cc(Cl)cc1CN1C2CCC1CC2 ZINC000708075398 1016996499 /nfs/dbraw/zinc/99/64/99/1016996499.db2.gz MRDLLYMMIVFKCM-UHFFFAOYSA-N -1 1 316.626 3.935 20 10 DHCDMM [O-]c1c(Br)cc(Cl)cc1CN1CCC(F)CC1 ZINC000708075110 1016997666 /nfs/dbraw/zinc/99/76/66/1016997666.db2.gz JJLVJISXFQSGBG-UHFFFAOYSA-N -1 1 322.605 3.742 20 10 DHCDMM O=C(NCc1ccccc1O)c1cccc(-c2ccccc2)c1[O-] ZINC001148870380 1032450056 /nfs/dbraw/zinc/45/00/56/1032450056.db2.gz VMXDBNQVDKLWHF-UHFFFAOYSA-N -1 1 319.360 3.695 20 10 DHCDMM CCCCCCC(=O)NCc1cccc(Br)c1[O-] ZINC000765726669 1019077665 /nfs/dbraw/zinc/07/76/65/1019077665.db2.gz IUZAYPOLHPUBEA-UHFFFAOYSA-N -1 1 314.223 3.741 20 10 DHCDMM [O-]c1ccc(Cl)c(Cl)c1CN1CC2(C1)CC(F)(F)C2 ZINC001237078129 1021630751 /nfs/dbraw/zinc/63/07/51/1021630751.db2.gz OJJYDFGQKAYFFO-UHFFFAOYSA-N -1 1 308.155 3.930 20 10 DHCDMM CC(=O)[C@@H]1CCCCN1Cc1c([O-])ccc(Cl)c1Cl ZINC001237085397 1021670021 /nfs/dbraw/zinc/67/00/21/1021670021.db2.gz ZAQUXDKIKRIWGD-LBPRGKRZSA-N -1 1 302.201 3.643 20 10 DHCDMM O=C1c2ccccc2N[C@H](c2cccc(Cl)c2[O-])N1C1CC1 ZINC000124696867 1023350846 /nfs/dbraw/zinc/35/08/46/1023350846.db2.gz UQAQFEHBUUZPGM-INIZCTEOSA-N -1 1 314.772 3.775 20 10 DHCDMM COCCCCc1ccc[nH+]c1NCc1cc(F)cc(F)c1O ZINC000883126171 1024251246 /nfs/dbraw/zinc/25/12/46/1024251246.db2.gz HXXVDBXOTMZUCD-UHFFFAOYSA-N -1 1 322.355 3.647 20 10 DHCDMM COC(=O)c1cccc(NCc2c([O-])ccc(Cl)c2F)c1 ZINC000792172665 1024641518 /nfs/dbraw/zinc/64/15/18/1024641518.db2.gz MMKZXLFVATVBOL-UHFFFAOYSA-N -1 1 309.724 3.583 20 10 DHCDMM Cc1cc2ccccc2c(NCC(=O)c2ccc([O-])c(O)c2)c1 ZINC001170320524 1024741169 /nfs/dbraw/zinc/74/11/69/1024741169.db2.gz FJSZGYLZCCWZSS-UHFFFAOYSA-N -1 1 307.349 3.854 20 10 DHCDMM CC[C@@H](NCc1cocn1)c1cc(Cl)cc(Cl)c1[O-] ZINC000806153723 1025815771 /nfs/dbraw/zinc/81/57/71/1025815771.db2.gz VCFDWILWXJFRNH-GFCCVEGCSA-N -1 1 301.173 3.928 20 10 DHCDMM [O-]c1c(F)cc(Cl)cc1CN1CC(c2ccccc2F)C1 ZINC000812790755 1027407814 /nfs/dbraw/zinc/40/78/14/1027407814.db2.gz GRZUPKYNRUSCOY-UHFFFAOYSA-N -1 1 309.743 3.923 20 10 DHCDMM Cn1c(-c2ccccc2)cnc1SCC(=O)c1ccc([O-])cc1 ZINC000007179337 1027738993 /nfs/dbraw/zinc/73/89/93/1027738993.db2.gz GSAJGDBPFVHZBM-UHFFFAOYSA-N -1 1 324.405 3.768 20 10 DHCDMM COC(=O)c1cc(NCc2cccc(Cl)c2[O-])ccc1C ZINC000779158353 1028487708 /nfs/dbraw/zinc/48/77/08/1028487708.db2.gz NBCQBBLRGXFHJH-UHFFFAOYSA-N -1 1 305.761 3.753 20 10 DHCDMM [O-]c1cc(F)c(Cl)cc1CNc1ccc2c(c1)OCCCO2 ZINC000816536882 1028925389 /nfs/dbraw/zinc/92/53/89/1028925389.db2.gz MTRJVVBRUNBULJ-UHFFFAOYSA-N -1 1 323.751 3.958 20 10 DHCDMM CN1CCOc2ccc(NCc3cc(Cl)c(F)cc3[O-])cc21 ZINC000816563575 1028946503 /nfs/dbraw/zinc/94/65/03/1028946503.db2.gz BYNSUSZAFLXPPK-UHFFFAOYSA-N -1 1 322.767 3.625 20 10 DHCDMM CO[C@H]1Cc2ccc(NCc3cc(Cl)c(F)cc3[O-])cc2C1 ZINC000816568184 1028949552 /nfs/dbraw/zinc/94/95/52/1028949552.db2.gz ZPQUJTJJCYNHMH-AWEZNQCLSA-N -1 1 321.779 3.910 20 10 DHCDMM CCc1nnc(CN[C@@H](CC)c2cccc(Cl)c2[O-])s1 ZINC000290129895 1029907814 /nfs/dbraw/zinc/90/78/14/1029907814.db2.gz JYNQZRLQWDVPEB-NSHDSACASA-N -1 1 311.838 3.700 20 10 DHCDMM O=C(/C=C/C1CCCC1)NCc1cccc(Br)c1[O-] ZINC000843866124 1030869904 /nfs/dbraw/zinc/86/99/04/1030869904.db2.gz DGQXGKWPNRTPOX-CMDGGOBGSA-N -1 1 324.218 3.517 20 10 DHCDMM CC1(C)CCC[C@@H]1[C@H]1CCN(C(=O)c2c([O-])c(O)ccc2F)C1 ZINC000844148681 1030982436 /nfs/dbraw/zinc/98/24/36/1030982436.db2.gz AEMLYYBSYNRLBP-NWDGAFQWSA-N -1 1 321.392 3.525 20 10 DHCDMM [O-]c1c(Cl)cccc1CNc1cccc2c1OCCCO2 ZINC000877768340 1033442989 /nfs/dbraw/zinc/44/29/89/1033442989.db2.gz OZSZEAGCYUXSFQ-UHFFFAOYSA-N -1 1 305.761 3.819 20 10 DHCDMM [O-]c1cc(Cl)ccc1CN1CC(F)(c2ccccc2F)C1 ZINC001206195348 1033602604 /nfs/dbraw/zinc/60/26/04/1033602604.db2.gz REUYYOABDRBNIM-UHFFFAOYSA-N -1 1 309.743 3.865 20 10 DHCDMM O=C1c2ccccc2C(=O)c2cc(Nc3ccccc3)c([O-])cc21 ZINC001173794416 1033866141 /nfs/dbraw/zinc/86/61/41/1033866141.db2.gz OPFDCAJUZBKRDF-UHFFFAOYSA-N -1 1 315.328 3.911 20 10 DHCDMM COc1ccc(NCc2cc(Cl)cc(F)c2[O-])c(OC)c1 ZINC001177416113 1035369495 /nfs/dbraw/zinc/36/94/95/1035369495.db2.gz IBKVISJAJVDYMD-UHFFFAOYSA-N -1 1 311.740 3.814 20 10 DHCDMM Cc1ccc(-c2nnco2)cc1NCc1cc(F)cc(F)c1[O-] ZINC001178124842 1035412451 /nfs/dbraw/zinc/41/24/51/1035412451.db2.gz NUTDKSKYPXQKQM-UHFFFAOYSA-N -1 1 317.295 3.641 20 10 DHCDMM CC(C)n1ncc2cc(NCc3cc(F)cc(F)c3[O-])cnc21 ZINC000905410769 1035518011 /nfs/dbraw/zinc/51/80/11/1035518011.db2.gz BJVXRZIZQSIUPU-UHFFFAOYSA-N -1 1 318.327 3.608 20 10 DHCDMM CC(C)c1cccnc1NC(=O)c1ccc(O)c([O-])c1Cl ZINC001193220089 1035588715 /nfs/dbraw/zinc/58/87/15/1035588715.db2.gz QHVTYDZEYYFDBY-UHFFFAOYSA-N -1 1 306.749 3.522 20 10 DHCDMM Cc1ccc(CC(=O)NCc2cccc(Cl)c2[O-])c(Cl)c1 ZINC001180410894 1035677262 /nfs/dbraw/zinc/67/72/62/1035677262.db2.gz VEMZXWDOELBJDG-UHFFFAOYSA-N -1 1 324.207 3.866 20 10 DHCDMM O=C(NCc1cccc(Cl)c1[O-])c1cccc2scnc21 ZINC001180420801 1035677357 /nfs/dbraw/zinc/67/73/57/1035677357.db2.gz PCCLUGOCNFORDF-UHFFFAOYSA-N -1 1 318.785 3.585 20 10 DHCDMM Cc1ccc2c(c1)OCCN2Cc1c([O-])ccc(Cl)c1F ZINC001180633495 1035735302 /nfs/dbraw/zinc/73/53/02/1035735302.db2.gz PCHCLZMDQCYVCB-UHFFFAOYSA-N -1 1 307.752 3.892 20 10 DHCDMM CN(Cc1cc(Cl)cc(F)c1[O-])Cc1ccccc1[N+](=O)[O-] ZINC000775652191 1036230226 /nfs/dbraw/zinc/23/02/26/1036230226.db2.gz HIBRLBCJRCYTIY-UHFFFAOYSA-N -1 1 324.739 3.725 20 10 DHCDMM CC(C)[C@@H]1CC[C@@H](C)C[C@H]1CNC(=O)c1c(F)ccc(O)c1[O-] ZINC001182510291 1036370599 /nfs/dbraw/zinc/37/05/99/1036370599.db2.gz QJCHRFNXIJDBFZ-AGIUHOORSA-N -1 1 323.408 3.675 20 10 DHCDMM [O-]c1c(Cl)cccc1CNCc1coc(-c2ccccc2)n1 ZINC000776177184 1037682189 /nfs/dbraw/zinc/68/21/89/1037682189.db2.gz KMAAURQIJOPUPB-UHFFFAOYSA-N -1 1 314.772 3.990 20 10 DHCDMM Cc1c(NCc2cc(Cl)cc(F)c2[O-])cnn1CC(C)C ZINC000776256123 1038113485 /nfs/dbraw/zinc/11/34/85/1038113485.db2.gz KTMDOVJSBZYUET-UHFFFAOYSA-N -1 1 311.788 3.958 20 10 DHCDMM CN(C)c1ccc(NCc2cccc(Br)c2[O-])cc1 ZINC000058624869 1039349497 /nfs/dbraw/zinc/34/94/97/1039349497.db2.gz JWXXVNVYQAWKJP-UHFFFAOYSA-N -1 1 321.218 3.833 20 10 DHCDMM CC(=O)Nc1ccc(NCc2cccc(Cl)c2[O-])cc1C ZINC000158052411 1039772766 /nfs/dbraw/zinc/77/27/66/1039772766.db2.gz HCGJZOFUEIBMGQ-UHFFFAOYSA-N -1 1 304.777 3.925 20 10 DHCDMM C[C@H](N[C@@H](C)c1c(F)cccc1F)c1cc([N+](=O)[O-])ccc1[O-] ZINC000273396256 130115905 /nfs/dbraw/zinc/11/59/05/130115905.db2.gz LWSZBGGSPZGOOO-UWVGGRQHSA-N -1 1 322.311 3.990 20 10 DHCDMM O=C([O-])C[N@@H+](Cc1cc(Cl)cc(Cl)c1[O-])C1CCCC1 ZINC000086749440 957981493 /nfs/dbraw/zinc/98/14/93/957981493.db2.gz UHBWGKIGCXIZBP-UHFFFAOYSA-N -1 1 318.200 3.528 20 10 DHCDMM O=C(NCc1cccc(Cl)c1[O-])c1sccc1C1CC1 ZINC000890758418 1013331618 /nfs/dbraw/zinc/33/16/18/1013331618.db2.gz XGBRCTNIJPKGDO-UHFFFAOYSA-N -1 1 307.802 3.915 20 10 DHCDMM CC(C)(CC(=O)NCc1cccc(Cl)c1[O-])C(F)(F)F ZINC000890759708 1013334753 /nfs/dbraw/zinc/33/47/53/1013334753.db2.gz PDKJEYBAKRTYTJ-UHFFFAOYSA-N -1 1 309.715 3.640 20 10 DHCDMM CCc1csc(NCc2cccc(Br)c2[O-])n1 ZINC000764934858 1018434232 /nfs/dbraw/zinc/43/42/32/1018434232.db2.gz ORFFWIFYOSZBDR-UHFFFAOYSA-N -1 1 313.220 3.786 20 10 DHCDMM CCC(C)(C)CC(=O)NCc1cccc(Br)c1[O-] ZINC000765729627 1019083637 /nfs/dbraw/zinc/08/36/37/1019083637.db2.gz QMLGCRXNMQMXEB-UHFFFAOYSA-N -1 1 314.223 3.597 20 10 DHCDMM O=C(NCc1cccc(Cl)c1[O-])Nc1nc(C2CC2)cs1 ZINC000929376348 1019117529 /nfs/dbraw/zinc/11/75/29/1019117529.db2.gz NHIGGBNJGBTBKU-UHFFFAOYSA-N -1 1 323.805 3.701 20 10 DHCDMM [O-]c1c(Cl)cc(Cl)cc1CN[C@@H](c1ncccn1)C1CC1 ZINC000922579765 1020138938 /nfs/dbraw/zinc/13/89/38/1020138938.db2.gz LLTMISFDYQXUFI-CYBMUJFWSA-N -1 1 324.211 3.730 20 10 DHCDMM Cc1cc(NCc2cccc(Cl)c2[O-])ccc1C(=O)N(C)C ZINC000194918685 1023199356 /nfs/dbraw/zinc/19/93/56/1023199356.db2.gz GCCBKPYSVXLELI-UHFFFAOYSA-N -1 1 318.804 3.668 20 10 DHCDMM [O-]c1c(Cl)cccc1CN1CCN(c2ccccc2F)CC1 ZINC000317083326 1024457899 /nfs/dbraw/zinc/45/78/99/1024457899.db2.gz YJGOBKAEIPDBAJ-UHFFFAOYSA-N -1 1 320.795 3.507 20 10 DHCDMM CN(CC(=O)[O-])Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O ZINC000000235808 1024986250 /nfs/dbraw/zinc/98/62/50/1024986250.db2.gz GHTPJHCVRABNRC-UHFFFAOYSA-N -1 1 307.434 3.504 20 10 DHCDMM Cc1c(NCc2cccc(Cl)c2[O-])cnn1C1CCOCC1 ZINC000295137014 1027115894 /nfs/dbraw/zinc/11/58/94/1027115894.db2.gz PGZRSLOIMZVQPN-UHFFFAOYSA-N -1 1 321.808 3.514 20 10 DHCDMM O=C(C[C@H]1CC=CCC1)NCc1cccc(Br)c1[O-] ZINC000935662784 1028352692 /nfs/dbraw/zinc/35/26/92/1028352692.db2.gz KHONAUVAOBXRRD-NSHDSACASA-N -1 1 324.218 3.517 20 10 DHCDMM CCN1C(=O)c2cc(Cl)ccc2N[C@H]1c1cccc(F)c1[O-] ZINC000778525983 1028688055 /nfs/dbraw/zinc/68/80/55/1028688055.db2.gz PTFOOEZRNUFGGH-OAHLLOKOSA-N -1 1 320.751 3.771 20 10 DHCDMM [O-]c1cc(F)c(Cl)cc1CNc1ccccc1-n1cccn1 ZINC000816523870 1028931604 /nfs/dbraw/zinc/93/16/04/1028931604.db2.gz IADGKRPMVXLGDW-UHFFFAOYSA-N -1 1 317.751 3.983 20 10 DHCDMM CC(=O)Nc1cccc(NCc2cc(Cl)c(F)cc2[O-])c1 ZINC000816522561 1028932599 /nfs/dbraw/zinc/93/25/99/1028932599.db2.gz FBRHJNWSYQQXPL-UHFFFAOYSA-N -1 1 308.740 3.755 20 10 DHCDMM CC(=O)N(C)c1ccc(NCc2cc(Cl)c(F)cc2[O-])cc1 ZINC000816524930 1028932957 /nfs/dbraw/zinc/93/29/57/1028932957.db2.gz XDZOKIMIGCFMHU-UHFFFAOYSA-N -1 1 322.767 3.780 20 10 DHCDMM COC(=O)Nc1ccc(NCc2cc(Cl)c(F)cc2[O-])cc1 ZINC000816523233 1028933445 /nfs/dbraw/zinc/93/34/45/1028933445.db2.gz IQMTZIAHLFDLNX-UHFFFAOYSA-N -1 1 324.739 3.975 20 10 DHCDMM [O-]c1cc(F)c(Cl)cc1CNc1cccc(-c2nc[nH]n2)c1 ZINC000816523694 1028933755 /nfs/dbraw/zinc/93/37/55/1028933755.db2.gz AYVBLZCMTAOBIV-UHFFFAOYSA-N -1 1 318.739 3.582 20 10 DHCDMM CC1(C)CCC[C@@H]1[C@@H]1CCN(C(=O)c2c([O-])c(O)ccc2F)C1 ZINC000844148683 1030984671 /nfs/dbraw/zinc/98/46/71/1030984671.db2.gz AEMLYYBSYNRLBP-VXGBXAGGSA-N -1 1 321.392 3.525 20 10 DHCDMM Cc1cnc(OC(C)C)c(NCc2cc(F)cc(F)c2[O-])c1 ZINC001202536130 1031672189 /nfs/dbraw/zinc/67/21/89/1031672189.db2.gz JOTVZADBFPXFMH-UHFFFAOYSA-N -1 1 308.328 3.773 20 10 DHCDMM CC(C)c1nc(CN(C)Cc2cc(F)c(F)cc2[O-])cs1 ZINC001142525115 1031898199 /nfs/dbraw/zinc/89/81/99/1031898199.db2.gz YFDJRFUAWVHPHW-UHFFFAOYSA-N -1 1 312.385 3.882 20 10 DHCDMM CC(=O)c1cc(Cl)cc(CN(CC(F)(F)F)C2CC2)c1[O-] ZINC000042775893 1035327352 /nfs/dbraw/zinc/32/73/52/1035327352.db2.gz CYBQPOKEAJDCDV-UHFFFAOYSA-N -1 1 321.726 3.775 20 10 DHCDMM C[C@@H]1CN(Cc2cc(Cl)c(F)cc2[O-])c2ccccc2O1 ZINC001180612737 1035721428 /nfs/dbraw/zinc/72/14/28/1035721428.db2.gz MAFDQRCFMONLDZ-SNVBAGLBSA-N -1 1 307.752 3.972 20 10 DHCDMM Cn1cccc1[C@H]1CCC[N@H+]1Cc1cc(Cl)cc(F)c1[O-] ZINC000775644519 1036182269 /nfs/dbraw/zinc/18/22/69/1036182269.db2.gz MTZYLWHVHCPRSG-OAHLLOKOSA-N -1 1 308.784 3.860 20 10 DHCDMM Cc1nn(C)cc1[C@H]1CCCN1Cc1cc(Cl)cc(F)c1[O-] ZINC000775737003 1036586464 /nfs/dbraw/zinc/58/64/64/1036586464.db2.gz JNTGZXKWNFNXTJ-OAHLLOKOSA-N -1 1 323.799 3.564 20 10 DHCDMM Cc1nn(C)cc1[C@@H]1CCCN1Cc1cc(Cl)cc(F)c1[O-] ZINC000775737001 1036587633 /nfs/dbraw/zinc/58/76/33/1036587633.db2.gz JNTGZXKWNFNXTJ-HNNXBMFYSA-N -1 1 323.799 3.564 20 10 DHCDMM [O-]c1c(Cl)cccc1CNCc1cc(-c2ccccc2)on1 ZINC000776150943 1037589660 /nfs/dbraw/zinc/58/96/60/1037589660.db2.gz CPLGGHSLWVYNPK-UHFFFAOYSA-N -1 1 314.772 3.990 20 10 DHCDMM COC[C@@H](NCc1cc(Cl)cc(F)c1[O-])c1ccc(C)o1 ZINC000776229746 1037942148 /nfs/dbraw/zinc/94/21/48/1037942148.db2.gz CNABEDMQZDSSCI-CYBMUJFWSA-N -1 1 313.756 3.563 20 10 DHCDMM COC(=O)c1cccc(NCc2cccc(Cl)c2[O-])c1C ZINC000164977024 1038395336 /nfs/dbraw/zinc/39/53/36/1038395336.db2.gz VDQPDWIWKVMTEV-UHFFFAOYSA-N -1 1 305.761 3.753 20 10 DHCDMM CC(C)c1csc(CN[C@H](C)c2cc([N+](=O)[O-])ccc2[O-])n1 ZINC000273565274 130137240 /nfs/dbraw/zinc/13/72/40/130137240.db2.gz JGIFNZQYICGXJI-SNVBAGLBSA-N -1 1 321.402 3.731 20 10 DHCDMM C[C@@H](N[C@H]1COc2cccc(F)c21)c1ccc(F)c(F)c1[O-] ZINC000364789717 525692035 /nfs/dbraw/zinc/69/20/35/525692035.db2.gz NASOAEOWWOGJJL-PELKAZGASA-N -1 1 309.287 3.594 20 10 DHCDMM [O-]c1c(Cl)cccc1CNc1ccc(N2CCCC2)nc1 ZINC000158139127 526329605 /nfs/dbraw/zinc/32/96/05/526329605.db2.gz IENXHSVCKDSWRD-UHFFFAOYSA-N -1 1 303.793 3.653 20 10 DHCDMM O=[N+]([O-])c1ccc(NCc2cccc(Br)c2[O-])cc1 ZINC000048796283 1013486024 /nfs/dbraw/zinc/48/60/24/1013486024.db2.gz CYLTZZDVEWSLNF-UHFFFAOYSA-N -1 1 323.146 3.675 20 10 DHCDMM C[C@H]([NH2+]Cc1ccccc1CC(=O)[O-])c1ccc(Cl)cc1[O-] ZINC001593305210 994761089 /nfs/dbraw/zinc/76/10/89/994761089.db2.gz UZKKJRCXBIFIDO-NSHDSACASA-N -1 1 319.788 3.524 20 10 DHCDMM CC(C)c1ncc(CN(C)Cc2cc(Cl)cc(F)c2[O-])cn1 ZINC000799737198 1012606856 /nfs/dbraw/zinc/60/68/56/1012606856.db2.gz YPXHZCBZBHUSIE-UHFFFAOYSA-N -1 1 323.799 3.730 20 10 DHCDMM C[C@@H](N[C@@H](C)c1cccc(C(F)(F)F)c1[O-])c1csnn1 ZINC000840885683 1017357042 /nfs/dbraw/zinc/35/70/42/1017357042.db2.gz FPHYROULVSTEJS-JGVFFNPUSA-N -1 1 317.336 3.674 20 10 DHCDMM O=C(C[C@@H]1C=CCCC1)NCc1cccc(Br)c1[O-] ZINC000765754277 1019116579 /nfs/dbraw/zinc/11/65/79/1019116579.db2.gz UMDWFLWGUCNVRM-LLVKDONJSA-N -1 1 324.218 3.517 20 10 DHCDMM Cc1ccn(-c2ccc(NCc3cc(F)cc(F)c3[O-])cc2)n1 ZINC001202365365 1021228113 /nfs/dbraw/zinc/22/81/13/1021228113.db2.gz CMCVAXCBUZAKNI-UHFFFAOYSA-N -1 1 315.323 3.777 20 10 DHCDMM C[C@]1(F)CCN(Cc2cc(Cl)c(Cl)cc2[O-])C[C@@H]1F ZINC001236792089 1021269114 /nfs/dbraw/zinc/26/91/14/1021269114.db2.gz BFVLSNKMXUBRQW-STQMWFEESA-N -1 1 310.171 3.971 20 10 DHCDMM [O-]c1c(F)cc(F)cc1CNc1ccc(N2CCCC2)cc1 ZINC000882907414 1024167822 /nfs/dbraw/zinc/16/78/22/1024167822.db2.gz ZSPJYCZNOFVBGO-UHFFFAOYSA-N -1 1 304.340 3.883 20 10 DHCDMM Cn1nc(C2CCCC2)cc1NCc1cc(F)cc(F)c1[O-] ZINC000883085997 1024235745 /nfs/dbraw/zinc/23/57/45/1024235745.db2.gz IKZUIYDSXRVDTG-UHFFFAOYSA-N -1 1 307.344 3.674 20 10 DHCDMM [O-]c1ccc(Cl)c(F)c1CNc1ccc(OC2COC2)cc1 ZINC000790993727 1024413487 /nfs/dbraw/zinc/41/34/87/1024413487.db2.gz YJXDCMYWXSYXEB-UHFFFAOYSA-N -1 1 323.751 3.574 20 10 DHCDMM COc1cc(NCC(=O)c2ccc([O-])c(O)c2)cc(C(C)C)c1 ZINC001170320486 1024740836 /nfs/dbraw/zinc/74/08/36/1024740836.db2.gz CUFDHWSZGSDACM-UHFFFAOYSA-N -1 1 315.369 3.525 20 10 DHCDMM O=C1[N-]C(=S)S/C1=C\c1cc(C(F)(F)F)ccc1Cl ZINC000178863181 1026432905 /nfs/dbraw/zinc/43/29/05/1026432905.db2.gz PBTCIAOPHCPJBY-YWEYNIOJSA-N -1 1 323.748 3.848 20 10 DHCDMM CCN1C(=O)c2ccc(Cl)cc2N[C@H]1c1cccc(F)c1[O-] ZINC000778520310 1028682613 /nfs/dbraw/zinc/68/26/13/1028682613.db2.gz SSLTWYBNOREVOV-OAHLLOKOSA-N -1 1 320.751 3.771 20 10 DHCDMM O=C1CCCc2cc(NCc3cccc(Cl)c3[O-])ccc2N1 ZINC000777497631 1030040856 /nfs/dbraw/zinc/04/08/56/1030040856.db2.gz YSRUYJJFRMWWAE-UHFFFAOYSA-N -1 1 316.788 3.933 20 10 DHCDMM C[C@@H]1C[N@H+](Cc2cc(Br)c(F)cc2O)C2(CC2)C1 ZINC001144308129 1031459378 /nfs/dbraw/zinc/45/93/78/1031459378.db2.gz QOZNOZJSTNWCON-VIFPVBQESA-N -1 1 314.198 3.668 20 10 DHCDMM COC[C@@H](N[C@H](C)c1ccc(F)c(F)c1[O-])c1ccc(C)o1 ZINC000187744150 1034728152 /nfs/dbraw/zinc/72/81/52/1034728152.db2.gz SJHWYZOZEAPLKP-ZWNOBZJWSA-N -1 1 311.328 3.610 20 10 DHCDMM [O-]c1c(Br)ccc(Cl)c1Nc1ccncc1F ZINC001175204200 1034848799 /nfs/dbraw/zinc/84/87/99/1034848799.db2.gz CXWNKFFYCPMHHO-UHFFFAOYSA-N -1 1 317.545 3.508 20 10 DHCDMM C[C@H](Cc1cccc(F)c1)C(=O)NCc1cccc(Cl)c1[O-] ZINC001180409866 1035674183 /nfs/dbraw/zinc/67/41/83/1035674183.db2.gz HENXYRARJIXWOV-LLVKDONJSA-N -1 1 321.779 3.680 20 10 DHCDMM C[C@@H](c1ccccn1)N(C)Cc1cc(Cl)cc([N+](=O)[O-])c1[O-] ZINC000182067307 526112379 /nfs/dbraw/zinc/11/23/79/526112379.db2.gz RNRHUBQDUMZJBF-JTQLQIEISA-N -1 1 321.764 3.542 20 10 DHCDMM Cc1ccc(C(=O)NCc2cccc(Cl)c2[O-])c(C2CC2)n1 ZINC000890761179 1013336204 /nfs/dbraw/zinc/33/62/04/1013336204.db2.gz MYGPSKKTXPIWNB-UHFFFAOYSA-N -1 1 316.788 3.556 20 10 DHCDMM [O-]c1c(CN[C@@H]2c3ccccc3CC[C@H]2F)ccc(F)c1F ZINC000895690219 1015258229 /nfs/dbraw/zinc/25/82/29/1015258229.db2.gz CCLZMRLGOGKBJI-GDBMZVCRSA-N -1 1 307.315 3.786 20 10 DHCDMM O=C1[N-]C(=S)S/C1=C/c1cc(Cl)cc(C(F)(F)F)c1 ZINC000588534546 1017046627 /nfs/dbraw/zinc/04/66/27/1017046627.db2.gz SBNGOWNTKMYETD-FPYGCLRLSA-N -1 1 323.748 3.848 20 10 DHCDMM [O-]c1ccc(Cl)c(F)c1CNc1ccc2c(c1)CCOC2 ZINC000850381315 1021501582 /nfs/dbraw/zinc/50/15/82/1021501582.db2.gz ANSWVCXYZOEMJV-UHFFFAOYSA-N -1 1 307.752 3.870 20 10 DHCDMM CC[C@H](NCc1ncccn1)c1cc(Cl)cc(Cl)c1[O-] ZINC000850551727 1021600557 /nfs/dbraw/zinc/60/05/57/1021600557.db2.gz JMNZTGQFEKSWHF-LBPRGKRZSA-N -1 1 312.200 3.730 20 10 DHCDMM Cc1cc(Br)c([O-])c(CN2CCC=C(F)C2)c1 ZINC000770666299 1023336387 /nfs/dbraw/zinc/33/63/87/1023336387.db2.gz IZNYMLUOVOUOME-UHFFFAOYSA-N -1 1 300.171 3.522 20 10 DHCDMM COc1cc(C)c(NCc2cc(F)cc(F)c2[O-])cc1OC ZINC000882905872 1024164316 /nfs/dbraw/zinc/16/43/16/1024164316.db2.gz XBFIIMIBYBSLGV-UHFFFAOYSA-N -1 1 309.312 3.608 20 10 DHCDMM Cc1cc(C)c2nc(NCC(=O)c3ccc([O-])c(O)c3)ccc2c1 ZINC001170316555 1024741516 /nfs/dbraw/zinc/74/15/16/1024741516.db2.gz IVRDUAKOPAOIQC-UHFFFAOYSA-N -1 1 322.364 3.558 20 10 DHCDMM O=C(Nc1cccc(N2CCCC2)c1)c1c(F)ccc([O-])c1F ZINC000809614799 1026565629 /nfs/dbraw/zinc/56/56/29/1026565629.db2.gz VDAVMGGASVWNLU-UHFFFAOYSA-N -1 1 318.323 3.523 20 10 DHCDMM Cc1noc(C(C)C)c1NC(=O)NCc1cccc(Cl)c1[O-] ZINC000932830738 1027620340 /nfs/dbraw/zinc/62/03/40/1027620340.db2.gz KJHINSSYQBQTMA-UHFFFAOYSA-N -1 1 323.780 3.787 20 10 DHCDMM [O-]c1cc(F)c(Cl)cc1C[N@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000816592283 1028939444 /nfs/dbraw/zinc/93/94/44/1028939444.db2.gz FSEPNJLCLDLTJS-QMMMGPOBSA-N -1 1 311.706 3.959 20 10 DHCDMM [O-]c1cc(F)c(Cl)cc1CNc1cccc(CCCO)c1 ZINC000816566893 1028947658 /nfs/dbraw/zinc/94/76/58/1028947658.db2.gz KLNPUPIEARSHNN-UHFFFAOYSA-N -1 1 309.768 3.722 20 10 DHCDMM [O-]c1c(F)cc(Cl)cc1CNc1ccc(N2CCCC2)cn1 ZINC000822490248 1030025852 /nfs/dbraw/zinc/02/58/52/1030025852.db2.gz RMENPEJHTRECIK-UHFFFAOYSA-N -1 1 321.783 3.792 20 10 DHCDMM C[C@@H]1C[C@H](NCc2cc(Cl)cc(Cl)c2[O-])c2nccn21 ZINC000825017596 1030701076 /nfs/dbraw/zinc/70/10/76/1030701076.db2.gz VOJUMCFFRCGHOJ-PELKAZGASA-N -1 1 312.200 3.691 20 10 DHCDMM CCc1ncc(CNCc2cc(Cl)cc(Cl)c2[O-])o1 ZINC000825079463 1030719153 /nfs/dbraw/zinc/71/91/53/1030719153.db2.gz VCPYNYIAPYVRQD-UHFFFAOYSA-N -1 1 301.173 3.539 20 10 DHCDMM CN=[S@](C)(=O)c1cccc(NCc2cccc(Cl)c2[O-])c1 ZINC000864013721 1034252207 /nfs/dbraw/zinc/25/22/07/1034252207.db2.gz CLHNVHRTSWKJOA-OAQYLSRUSA-N -1 1 324.833 3.744 20 10 DHCDMM [O-]c1c(CN2CCOC3(C2)CCCCCC3)ccc(F)c1F ZINC001180077239 1035586084 /nfs/dbraw/zinc/58/60/84/1035586084.db2.gz OFKJVQVTTCCEDM-UHFFFAOYSA-N -1 1 311.372 3.596 20 10 DHCDMM COC(=O)[C@H](C)c1cccc(NCc2cc(F)cc(F)c2[O-])c1 ZINC001182332531 1036231150 /nfs/dbraw/zinc/23/11/50/1036231150.db2.gz DDFAJWXKBBMCLQ-SNVBAGLBSA-N -1 1 321.323 3.559 20 10 DHCDMM CC(C)(NCc1cc(Cl)cc(F)c1[O-])c1nccs1 ZINC000776175873 1037678322 /nfs/dbraw/zinc/67/83/22/1037678322.db2.gz WBCCOJWSXNCKRL-UHFFFAOYSA-N -1 1 300.786 3.666 20 10 DHCDMM [O-]c1c(F)cc(F)cc1CNc1cc2c(cc1Cl)OCO2 ZINC001201872206 1037925483 /nfs/dbraw/zinc/92/54/83/1037925483.db2.gz GDWLIUPLRGMTLI-UHFFFAOYSA-N -1 1 313.687 3.665 20 10 DHCDMM C[N@H+](Cc1ncc(-c2cccc(F)c2)o1)Cc1ccccc1O ZINC000177676300 337158407 /nfs/dbraw/zinc/15/84/07/337158407.db2.gz HCPKFJBGNKLTEB-UHFFFAOYSA-N -1 1 312.344 3.818 20 10 DHCDMM O=C(NCc1cccc(Cl)c1[O-])[C@@H]1CC[C@H](C(F)(F)F)C1 ZINC000890759933 1013333983 /nfs/dbraw/zinc/33/39/83/1013333983.db2.gz WGCGUDVGDOTBEM-SCZZXKLOSA-N -1 1 321.726 3.640 20 10 DHCDMM Cc1ccsc1[C@H]1C[C@@H]1C(=O)NCc1cccc(Cl)c1[O-] ZINC000890760132 1013334498 /nfs/dbraw/zinc/33/44/98/1013334498.db2.gz JCVCMLFGLLIKMK-RYUDHWBXSA-N -1 1 321.829 3.835 20 10 DHCDMM CCC(CC)n1nccc1C(=O)NCc1cccc(Cl)c1[O-] ZINC000890760716 1013336290 /nfs/dbraw/zinc/33/62/90/1013336290.db2.gz XLWDSBISTWBZFW-UHFFFAOYSA-N -1 1 321.808 3.533 20 10 DHCDMM Cc1cc(C)c(CC(=O)NCc2cccc(Cl)c2[O-])s1 ZINC000890762586 1013341505 /nfs/dbraw/zinc/34/15/05/1013341505.db2.gz GSOZSUDZANSUNB-UHFFFAOYSA-N -1 1 309.818 3.583 20 10 DHCDMM Cc1csc(CNCc2cc(Cl)cc(Cl)c2[O-])n1 ZINC000038090701 1013856266 /nfs/dbraw/zinc/85/62/66/1013856266.db2.gz GIWZVOAUFGOKHD-UHFFFAOYSA-N -1 1 303.214 3.754 20 10 DHCDMM CC[C@@](C)(NC(=O)NCc1cccc(Cl)c1[O-])C(F)(F)F ZINC000933501859 1015376367 /nfs/dbraw/zinc/37/63/67/1015376367.db2.gz VBWLLLTYGGMPKV-GFCCVEGCSA-N -1 1 324.730 3.576 20 10 DHCDMM Cn1nccc1[C@@H]1CCCC[N@H+]1Cc1cccc(Cl)c1[O-] ZINC000281223236 1016403853 /nfs/dbraw/zinc/40/38/53/1016403853.db2.gz KLQKCTHNPRECFY-HNNXBMFYSA-N -1 1 305.809 3.506 20 10 DHCDMM Cc1nc(NCc2cccc(Br)c2[O-])sc1C ZINC000764935418 1018433813 /nfs/dbraw/zinc/43/38/13/1018433813.db2.gz TWDPHXIIVKVYAO-UHFFFAOYSA-N -1 1 313.220 3.840 20 10 DHCDMM [O-]c1cccc(F)c1CN1Cc2cccc(Br)c2C1 ZINC001137837925 1018668147 /nfs/dbraw/zinc/66/81/47/1018668147.db2.gz ZKFNKTXSEKTDQI-UHFFFAOYSA-N -1 1 322.177 3.810 20 10 DHCDMM C[C@@H](N[C@@H](C)c1nccn1C)c1ccc(Cl)c(Cl)c1[O-] ZINC000850572950 1021614347 /nfs/dbraw/zinc/61/43/47/1021614347.db2.gz RDJZNRQNKUCFBC-BDAKNGLRSA-N -1 1 314.216 3.844 20 10 DHCDMM CN(Cc1nccs1)Cc1c([O-])ccc(Cl)c1Cl ZINC001237084807 1021670450 /nfs/dbraw/zinc/67/04/50/1021670450.db2.gz NRCBOMQQORNWFJ-UHFFFAOYSA-N -1 1 303.214 3.788 20 10 DHCDMM CC(C)(C)[C@H]1CCCN(C(=O)c2c([O-])c(O)ccc2F)CC1 ZINC000825882827 1033073906 /nfs/dbraw/zinc/07/39/06/1033073906.db2.gz OFFZRYXLHBHBON-NSHDSACASA-N -1 1 309.381 3.525 20 10 DHCDMM Cc1ccc(-c2ncc(C=C3SC(=S)[N-]C3=O)s2)cc1 ZINC000114990904 1022973942 /nfs/dbraw/zinc/97/39/42/1022973942.db2.gz SISDOBUTSQJPMK-WDZFZDKYSA-N -1 1 318.448 3.607 20 10 DHCDMM O=C1N[C@@H](c2cccc(Cl)c2[O-])Nc2cc(Cl)ccc21 ZINC000124720778 1023348228 /nfs/dbraw/zinc/34/82/28/1023348228.db2.gz AEPBYTBGCABTLA-ZDUSSCGKSA-N -1 1 309.152 3.553 20 10 DHCDMM [O-]c1ccc(Cl)c(F)c1CNc1ccc(-n2ccnc2)cc1 ZINC000790951980 1024403861 /nfs/dbraw/zinc/40/38/61/1024403861.db2.gz UZCHMZKMELIRNK-UHFFFAOYSA-N -1 1 317.751 3.983 20 10 DHCDMM [O-]c1ccc(Cl)c(F)c1CNc1cccc(-n2cccn2)c1 ZINC000790976436 1024421997 /nfs/dbraw/zinc/42/19/97/1024421997.db2.gz PKLIDAWXWVFDEC-UHFFFAOYSA-N -1 1 317.751 3.983 20 10 DHCDMM CCOc1ncc(C)cc1NCc1c([O-])ccc(Cl)c1F ZINC001202570456 1024573605 /nfs/dbraw/zinc/57/36/05/1024573605.db2.gz MUDPLHKESUGFQE-UHFFFAOYSA-N -1 1 310.756 3.899 20 10 DHCDMM CC[C@H](NCc1ccon1)c1cc(Cl)cc(Cl)c1[O-] ZINC000806141778 1025805317 /nfs/dbraw/zinc/80/53/17/1025805317.db2.gz LZMFHDWNMJEKEE-LBPRGKRZSA-N -1 1 301.173 3.928 20 10 DHCDMM C[C@H](C1CC1)n1cc(NCc2cc(Cl)cc(F)c2[O-])cn1 ZINC000779190084 1028669438 /nfs/dbraw/zinc/66/94/38/1028669438.db2.gz BWKHMDDQKHCPHC-SECBINFHSA-N -1 1 309.772 3.964 20 10 DHCDMM [O-]c1cc(F)c(Cl)cc1CN1CCOCc2ccccc21 ZINC000816613809 1028962855 /nfs/dbraw/zinc/96/28/55/1028962855.db2.gz FVZQQYONJXQSOK-UHFFFAOYSA-N -1 1 307.752 3.722 20 10 DHCDMM [O-]c1cc(F)c(F)cc1CN1CCc2c(Cl)cccc2C1 ZINC001142527259 1031909801 /nfs/dbraw/zinc/90/98/01/1031909801.db2.gz QOGVMWRMRUCARI-UHFFFAOYSA-N -1 1 309.743 3.882 20 10 DHCDMM CC1(C)CCc2onc(CNCc3cccc(Cl)c3[O-])c2C1 ZINC000877810417 1033460417 /nfs/dbraw/zinc/46/04/17/1033460417.db2.gz UQPBMWLQDPAALH-UHFFFAOYSA-N -1 1 320.820 3.838 20 10 DHCDMM O=C(Nc1ccc(C2CCC2)nc1)c1ccc(O)c([O-])c1Cl ZINC001193220087 1035590055 /nfs/dbraw/zinc/59/00/55/1035590055.db2.gz QGWPGVRYUZVUGM-UHFFFAOYSA-N -1 1 318.760 3.666 20 10 DHCDMM C[C@H]1C[C@@H](NC(=O)c2ccc(O)c([O-])c2Cl)c2ccccc21 ZINC001193236576 1035593765 /nfs/dbraw/zinc/59/37/65/1035593765.db2.gz IEURXZPZWVTLKW-TVQRCGJNSA-N -1 1 317.772 3.730 20 10 DHCDMM O=C(c1ccc(O)c([O-])c1Cl)N1CCC[C@H]1C1CCCCC1 ZINC001193233457 1035594370 /nfs/dbraw/zinc/59/43/70/1035594370.db2.gz ZGXDECTWMBIOEB-ZDUSSCGKSA-N -1 1 323.820 3.936 20 10 DHCDMM Cc1cc(C(=O)NCc2cccc(Cl)c2[O-])c(C)n1C(C)C ZINC001180411488 1035677650 /nfs/dbraw/zinc/67/76/50/1035677650.db2.gz YWMXDDBYYNBVDK-UHFFFAOYSA-N -1 1 320.820 3.975 20 10 DHCDMM CN1CCN(Cc2cc(Cl)c(F)cc2[O-])c2ccccc21 ZINC001180716766 1035740795 /nfs/dbraw/zinc/74/07/95/1035740795.db2.gz WWMAQDXSVNJXIZ-UHFFFAOYSA-N -1 1 306.768 3.641 20 10 DHCDMM CC[C@@H]1CN(Cc2cc(F)cc(F)c2[O-])c2ccccc2O1 ZINC001181074470 1035839942 /nfs/dbraw/zinc/83/99/42/1035839942.db2.gz TZMZAVXQKJAMFS-CYBMUJFWSA-N -1 1 305.324 3.848 20 10 DHCDMM O=C1[N-]C(=S)S/C1=C/c1ccc(Cl)c(C(F)(F)F)c1 ZINC000171157394 1039306991 /nfs/dbraw/zinc/30/69/91/1039306991.db2.gz FSPTUHPKJLNXSA-XBXARRHUSA-N -1 1 323.748 3.848 20 10 DHCDMM O=C1[N-]C(=S)S/C1=C\c1ccc(F)c(Cl)c1Cl ZINC000761377921 1039962049 /nfs/dbraw/zinc/96/20/49/1039962049.db2.gz WZYLUNFRAVKNIN-UTCJRWHESA-N -1 1 308.186 3.621 20 10 DHCDMM [O-]c1c(Cl)cccc1CN[C@@H]1COc2cccc(Cl)c21 ZINC000377885000 337063292 /nfs/dbraw/zinc/06/32/92/337063292.db2.gz QQLMVLSWGGFJTO-GFCCVEGCSA-N -1 1 310.180 3.922 20 10 DHCDMM [O-]c1ccc(Cl)c(F)c1CNc1cccc2c1OCC[C@@H]2O ZINC000191606313 337297850 /nfs/dbraw/zinc/29/78/50/337297850.db2.gz CPVYHGMMPCGKFX-AWEZNQCLSA-N -1 1 323.751 3.613 20 10 DHCDMM CCc1nc([C@H](C)N[C@@H](C)c2cc([N+](=O)[O-])ccc2[O-])cs1 ZINC000273580371 536153195 /nfs/dbraw/zinc/15/31/95/536153195.db2.gz MKIQLFAMZZBNJF-UWVGGRQHSA-N -1 1 321.402 3.731 20 10 DHCDMM