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CKAFHFBHOAEVOG-OAHLLOKOSA-N -1 0 340.826 3.728 20 10 EHCDRM [O-]c1c(CN2CCN(C3CC3)c3cc(F)ccc32)ccc(F)c1F ZINC001181023319 1133441555 /nfs/dbraw/zinc/44/15/55/1133441555.db2.gz SCYSNBGVVRQTOG-UHFFFAOYSA-N -1 0 334.341 3.799 20 10 EHCDRM O=C(c1ccccc1)c1cc(Cl)ccc1[N-]S(=O)(=O)CC1CC1 ZINC001188926818 1134519989 /nfs/dbraw/zinc/51/99/89/1134519989.db2.gz JWNFZORXRYBESR-UHFFFAOYSA-N -1 0 349.839 3.723 20 10 EHCDRM C[C@@H](NC(=O)c1cc(O)c([O-])c(Cl)c1)c1cc(F)cc(F)c1 ZINC001193626002 1135161043 /nfs/dbraw/zinc/16/10/43/1135161043.db2.gz QTSMWQUHGHYBEZ-SSDOTTSWSA-N -1 0 327.714 3.520 20 10 EHCDRM C[C@@H](NC(=O)NCc1cc(Cl)cc(Cl)c1[O-])c1ccccn1 ZINC000804894836 1135215425 /nfs/dbraw/zinc/21/54/25/1135215425.db2.gz BFVLRSJMNAYBKU-SECBINFHSA-N -1 0 340.210 3.654 20 10 EHCDRM CC[C@H]([NH2+]Cc1ncnn1CC)c1cc(Cl)cc(Cl)c1[O-] ZINC000806163784 1135405913 /nfs/dbraw/zinc/40/59/13/1135405913.db2.gz VXOTVVQWZRGEGK-LBPRGKRZSA-N -1 0 329.231 3.551 20 10 EHCDRM CO[C@@H](C(=O)NCc1cc(Cl)cc(Cl)c1[O-])c1ccccc1 ZINC000807839993 1135576161 /nfs/dbraw/zinc/57/61/61/1135576161.db2.gz OVXUIPDGWXYEPH-OAHLLOKOSA-N -1 0 340.206 3.703 20 10 EHCDRM CC[C@@H]1C[C@@H](CC(=O)NCc2cc(Cl)cc(Cl)c2[O-])CCO1 ZINC000807838524 1135581179 /nfs/dbraw/zinc/58/11/79/1135581179.db2.gz VVJMCHPJXVJZCE-GXFFZTMASA-N -1 0 346.254 3.911 20 10 EHCDRM O=C(COc1ccc(F)cc1)NCc1cc(Cl)cc(Cl)c1[O-] ZINC000807839293 1135581569 /nfs/dbraw/zinc/58/15/69/1135581569.db2.gz BFPYVXKTCQQTMW-UHFFFAOYSA-N -1 0 344.169 3.533 20 10 EHCDRM CNc1c(Cl)ncnc1NCc1cc(Cl)cc(Cl)c1[O-] ZINC000808090333 1135616722 /nfs/dbraw/zinc/61/67/22/1135616722.db2.gz ZCVHSNSFBZDXMJ-UHFFFAOYSA-N -1 0 333.606 3.796 20 10 EHCDRM Cc1ncsc1/C=C/C(=O)NCc1cc(Cl)cc(Cl)c1[O-] ZINC000813683117 1136356113 /nfs/dbraw/zinc/35/61/13/1136356113.db2.gz UBNYNCMPQYLOGS-NSCUHMNNSA-N -1 0 343.235 3.794 20 10 EHCDRM CC[C@@H](C)CC[C@@H](O)CC(=O)NCc1cc(Cl)cc(Cl)c1[O-] ZINC000813684967 1136356780 /nfs/dbraw/zinc/35/67/80/1136356780.db2.gz ZENCFNUVARBTFJ-ZWNOBZJWSA-N -1 0 348.270 3.893 20 10 EHCDRM CN(Cc1nc2ccccc2n1C)Cc1cc(Cl)c(F)cc1[O-] ZINC000816509901 1136728993 /nfs/dbraw/zinc/72/89/93/1136728993.db2.gz GHVUOPUZBAGKOI-UHFFFAOYSA-N -1 0 333.794 3.703 20 10 EHCDRM CN(c1ccc2ccccc2c1)S(=O)(=O)c1cc(F)cc(F)c1[O-] ZINC000821131792 1137018010 /nfs/dbraw/zinc/01/80/10/1137018010.db2.gz CADZHGMOUXPZSZ-UHFFFAOYSA-N -1 0 349.358 3.649 20 10 EHCDRM CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cc(SC)ccc1O ZINC000824234788 1137129065 /nfs/dbraw/zinc/12/90/65/1137129065.db2.gz RGNRPFGALHAWJT-UHFFFAOYSA-N -1 0 344.480 3.842 20 10 EHCDRM O=C(NCC[C@@H]1CCSC1)NCc1cc(Cl)cc(Cl)c1[O-] ZINC000868825741 1137425195 /nfs/dbraw/zinc/42/51/95/1137425195.db2.gz JZGXTSJHCNKWCS-SECBINFHSA-N -1 0 349.283 3.641 20 10 EHCDRM Cc1cc(O)c(C(C)C)cc1[N-]S(=O)(=O)c1c(F)cccc1F ZINC000123888513 1137564010 /nfs/dbraw/zinc/56/40/10/1137564010.db2.gz ISSIERWCJQCYLJ-UHFFFAOYSA-N -1 0 341.379 3.903 20 10 EHCDRM CC1(C)N[C@H](c2cc(Cl)cc(F)c2[O-])N(c2ccccc2)C1=O ZINC000877857558 1137693706 /nfs/dbraw/zinc/69/37/06/1137693706.db2.gz UMTPEQLYIODKBH-HNNXBMFYSA-N -1 0 334.778 3.598 20 10 EHCDRM CCc1cc(NCc2cc(Cl)cc(Br)c2[O-])n(C)n1 ZINC000883035363 1137842320 /nfs/dbraw/zinc/84/23/20/1137842320.db2.gz ZOZOIWGDIGYZNC-UHFFFAOYSA-N -1 0 344.640 3.716 20 10 EHCDRM O=C([O-])/C=C\c1ccc(N2CCC[C@@H]2c2ccco2)c([N+](=O)[O-])c1 ZINC000739625699 600215355 /nfs/dbraw/zinc/21/53/55/600215355.db2.gz RCXQWAMDKJTBAS-IQCBXXCUSA-N -1 0 328.324 3.627 20 10 EHCDRM Cc1cc(C(=O)NC(C)(C)CCC(=O)[O-])c(C)n1-c1cccc(C)c1 ZINC000237730162 600384604 /nfs/dbraw/zinc/38/46/04/600384604.db2.gz YCZACRCMNWOKKC-UHFFFAOYSA-N -1 0 342.439 3.776 20 10 EHCDRM CCSCC[C@@H](C)N(C)c1ccc(/C=C\C(=O)[O-])cc1[N+](=O)[O-] ZINC000830164190 600986618 /nfs/dbraw/zinc/98/66/18/600986618.db2.gz RDFRWMKUBDPIIP-XYLWRLHESA-N -1 0 338.429 3.661 20 10 EHCDRM O=C([O-])CCCN1C(=O)/C(=C\c2ccccc2C2CC2)SC1=S ZINC000750817704 601145120 /nfs/dbraw/zinc/14/51/20/601145120.db2.gz IMDVYLHZELGRAW-GXDHUFHOSA-N -1 0 347.461 3.630 20 10 EHCDRM CCc1oc(C(=O)[O-])cc1COc1ccc2c(C)cc(=O)oc2c1 ZINC000830395311 601388616 /nfs/dbraw/zinc/38/86/16/601388616.db2.gz YAUXYRWXYJPHHF-UHFFFAOYSA-N -1 0 328.320 3.534 20 10 EHCDRM CCCN(Cc1ccccc1O)C(=O)c1ccc(F)c(NC(=O)[O-])c1 ZINC000739359161 602546299 /nfs/dbraw/zinc/54/62/99/602546299.db2.gz IWLXVOXWGBSZIT-UHFFFAOYSA-N -1 0 346.358 3.674 20 10 EHCDRM O=C([O-])c1ccc(C(=O)Nc2cccc(N3CCCCC3)c2)cc1F ZINC000833159263 604816239 /nfs/dbraw/zinc/81/62/39/604816239.db2.gz RXFXYLRYSHZNIJ-UHFFFAOYSA-N -1 0 342.370 3.767 20 10 EHCDRM Cc1cc(C(=O)Nc2ccc(C(=O)[O-])nc2)c(C)n1-c1cccc(C)c1 ZINC000833752254 605254406 /nfs/dbraw/zinc/25/44/06/605254406.db2.gz OOCIEODIYDYRKH-UHFFFAOYSA-N -1 0 349.390 3.748 20 10 EHCDRM Cc1cc(NC(=O)N[C@@H](C)c2ccc(N(C)C)cc2)ccc1C(=O)[O-] ZINC001605202501 972943964 /nfs/dbraw/zinc/94/39/64/972943964.db2.gz OPYAQJBBHXMVDD-ZDUSSCGKSA-N -1 0 341.411 3.642 20 10 EHCDRM C[C@H](CN(C)c1ccc(/C=C/C(=O)[O-])cc1[N+](=O)[O-])c1ccccc1 ZINC001592588957 978515389 /nfs/dbraw/zinc/51/53/89/978515389.db2.gz UFZLBXMIRBKYJM-CFRMROPGSA-N -1 0 340.379 3.933 20 10 EHCDRM C[C@H]1CN(c2ccc(/C=C\C(=O)[O-])cc2[N+](=O)[O-])Cc2ccccc21 ZINC000916992986 982678408 /nfs/dbraw/zinc/67/84/08/982678408.db2.gz FSRJUJVVBWRVSP-JWJUJFCLSA-N -1 0 338.363 3.816 20 10 EHCDRM CCc1ccccc1NC(=O)[C@@H](C)Sc1ncc(C(=O)[O-])s1 ZINC001597610620 988503864 /nfs/dbraw/zinc/50/38/64/988503864.db2.gz BHAJECALQCKANZ-SECBINFHSA-N -1 0 336.438 3.523 20 10 EHCDRM CN(C)c1ccc(OC[C@H]2CC3(CO2)CCCCC3)cc1C(=O)[O-] ZINC001598328057 991347237 /nfs/dbraw/zinc/34/72/37/991347237.db2.gz CROHHRWZPPGJRY-OAHLLOKOSA-N -1 0 333.428 3.569 20 10 EHCDRM COc1ccc(N(C)Cc2cccc(C(=O)[O-])c2Cl)cc1OC ZINC001599584587 993595279 /nfs/dbraw/zinc/59/52/79/993595279.db2.gz YTTXKTUYKVOXBL-UHFFFAOYSA-N -1 0 335.787 3.692 20 10 EHCDRM COc1ccc2c(c1)C[C@@H](C(C)C)CN2Cc1ccc(C(=O)[O-])cn1 ZINC001599627151 994165271 /nfs/dbraw/zinc/16/52/71/994165271.db2.gz SRCXBGYMQJDMRB-MRXNPFEDSA-N -1 0 340.423 3.623 20 10 EHCDRM C[C@@H](Sc1ncc(C(=O)[O-])s1)C(=O)Nc1cccc(Cl)c1 ZINC001593679379 996099892 /nfs/dbraw/zinc/09/98/92/996099892.db2.gz JHCBOSDYYRJYAO-SSDOTTSWSA-N -1 0 342.829 3.614 20 10 EHCDRM [O-]c1cc(F)c(Cl)cc1CN[C@@H]1c2ccccc2OC[C@H]1F ZINC000896424086 1025437348 /nfs/dbraw/zinc/43/73/48/1025437348.db2.gz XRLSLCHEESLEOA-CZUORRHYSA-N -1 0 325.742 3.746 20 10 EHCDRM [O-]c1ccc(Cl)c(F)c1CNCc1nnc(-c2ccccc2)s1 ZINC000191320367 1036366739 /nfs/dbraw/zinc/36/67/39/1036366739.db2.gz BFJOASYPOBMNNO-UHFFFAOYSA-N -1 0 349.818 3.993 20 10 EHCDRM CC[C@H](C(=O)[O-])C(=O)N(Cc1ccccc1O)[C@H](C)c1ccccc1 ZINC000911096533 1039233246 /nfs/dbraw/zinc/23/32/46/1039233246.db2.gz OYAXTMZUYZKAPH-PBHICJAKSA-N -1 0 341.407 3.593 20 10 EHCDRM C[C@H]1CN(Cc2cc(F)cc(F)c2[O-])C[C@H](c2ccsc2)O1 ZINC000894073392 1040050747 /nfs/dbraw/zinc/05/07/47/1040050747.db2.gz XJSCQSYNCUOKIM-ZUZCIYMTSA-N -1 0 325.380 3.694 20 10 EHCDRM O=S(=O)([N-]c1nc(-c2cccc(F)c2)cs1)c1ccccc1 ZINC000070831489 1125406423 /nfs/dbraw/zinc/40/64/23/1125406423.db2.gz LXZDYSQKTQSTBC-UHFFFAOYSA-N -1 0 334.397 3.750 20 10 EHCDRM COc1cc(NCc2cc(Cl)cc(Cl)c2[O-])cnc1OC ZINC001179177205 1133234318 /nfs/dbraw/zinc/23/43/18/1133234318.db2.gz AXIGZULWPFSMPU-UHFFFAOYSA-N -1 0 329.183 3.723 20 10 EHCDRM C[C@H]1CN(Cc2cc(Cl)cc(Cl)c2[O-])C[C@H](C(F)(F)F)O1 ZINC000769499051 1133302505 /nfs/dbraw/zinc/30/25/05/1133302505.db2.gz VSAXXAJHNNOTOI-WRWORJQWSA-N -1 0 344.160 3.851 20 10 EHCDRM CN(Cc1cc(Cl)cn1C)Cc1cc(Cl)cc([N+](=O)[O-])c1[O-] ZINC000770304966 1133409131 /nfs/dbraw/zinc/40/91/31/1133409131.db2.gz OHYBWNQLPILGND-UHFFFAOYSA-N -1 0 344.198 3.578 20 10 EHCDRM C[N@H+](Cc1cnc2ccccn12)Cc1cc(Cl)cc(Cl)c1[O-] ZINC001203574232 1133838130 /nfs/dbraw/zinc/83/81/30/1133838130.db2.gz QOJLBWSYUIYJPH-UHFFFAOYSA-N -1 0 336.222 3.979 20 10 EHCDRM CCOC(=O)[C@H](C)N(Cc1cc(Cl)cc(Cl)c1[O-])C1CC1 ZINC000787442980 1134004862 /nfs/dbraw/zinc/00/48/62/1134004862.db2.gz YHPCUNAQDMMYGB-VIFPVBQESA-N -1 0 332.227 3.615 20 10 EHCDRM Cc1c(O)ccc([N-]S(=O)(=O)c2cc3c(s2)CCCC3)c1C ZINC001187210240 1134315273 /nfs/dbraw/zinc/31/52/73/1134315273.db2.gz UALDKFBQGQIARQ-UHFFFAOYSA-N -1 0 337.466 3.750 20 10 EHCDRM O=C(Nc1cc(Cl)cc(Cl)n1)c1cc(O)c([O-])c(Cl)c1 ZINC001193589923 1135155829 /nfs/dbraw/zinc/15/58/29/1135155829.db2.gz SBQHFQNFUSVRLO-UHFFFAOYSA-N -1 0 333.558 3.705 20 10 EHCDRM COC(=O)Nc1ccc(N=Nc2ccc(S(=O)(=O)[O-])cc2)cc1 ZINC001193912759 1135204128 /nfs/dbraw/zinc/20/41/28/1135204128.db2.gz MBDDFVPYFANFGK-WUKNDPDISA-N -1 0 335.341 3.527 20 10 EHCDRM C[C@@H](NC(=O)NCc1cc(Cl)cc(Cl)c1[O-])c1ccc[nH]1 ZINC000805238686 1135247673 /nfs/dbraw/zinc/24/76/73/1135247673.db2.gz WWKBKELNHCQCAY-MRVPVSSYSA-N -1 0 328.199 3.588 20 10 EHCDRM O=C(NCc1cc(Cl)cc(Cl)c1[O-])NOC1CCCCC1 ZINC000805315153 1135257831 /nfs/dbraw/zinc/25/78/31/1135257831.db2.gz LHBCFGARZUJLDQ-UHFFFAOYSA-N -1 0 333.215 3.763 20 10 EHCDRM O=C(NCc1cc(Cl)cc(Cl)c1[O-])NC[C@H]1CCCCS1 ZINC000805380240 1135268399 /nfs/dbraw/zinc/26/83/99/1135268399.db2.gz IHAKTBSSNSYIIX-LLVKDONJSA-N -1 0 349.283 3.784 20 10 EHCDRM CC(=O)Nc1cccc2c1CCN(Cc1cc(Cl)cc(F)c1[O-])C2 ZINC000775664567 1135439823 /nfs/dbraw/zinc/43/98/23/1135439823.db2.gz YKPBVAIPASHNHG-UHFFFAOYSA-N -1 0 348.805 3.701 20 10 EHCDRM Cc1ccc(C(=O)NCc2cc(Cl)cc(Cl)c2[O-])c(C)n1 ZINC000807839860 1135576204 /nfs/dbraw/zinc/57/62/04/1135576204.db2.gz MQINOAMMSNVPBD-UHFFFAOYSA-N -1 0 325.195 3.641 20 10 EHCDRM CC(C)(C)n1cc(C(=O)NCc2cc(Cl)cc(Cl)c2[O-])cn1 ZINC000807833518 1135579376 /nfs/dbraw/zinc/57/93/76/1135579376.db2.gz AVQHTNRDFXIYIP-UHFFFAOYSA-N -1 0 342.226 3.581 20 10 EHCDRM Cc1nc(Cl)ccc1C(=O)NCc1cc(Cl)cc(Cl)c1[O-] ZINC000807835279 1135580552 /nfs/dbraw/zinc/58/05/52/1135580552.db2.gz CSTCWIIOLYSPNU-UHFFFAOYSA-N -1 0 345.613 3.986 20 10 EHCDRM COc1cccc(C(=O)NCc2cc(Cl)cc(Cl)c2[O-])c1 ZINC000807835274 1135580781 /nfs/dbraw/zinc/58/07/81/1135580781.db2.gz CMSPHKPTSBVZJN-UHFFFAOYSA-N -1 0 326.179 3.638 20 10 EHCDRM CCn1nc(C)c([N+](=O)[O-])c1NCc1cc(Cl)cc(Cl)c1[O-] ZINC000808089385 1135616427 /nfs/dbraw/zinc/61/64/27/1135616427.db2.gz RDCIKAHRRBZEHF-UHFFFAOYSA-N -1 0 345.186 3.744 20 10 EHCDRM Cc1cc(C)c(S(=O)(=O)Nc2cc(Cl)c([O-])cc2F)c(C)c1 ZINC000808115883 1135619754 /nfs/dbraw/zinc/61/97/54/1135619754.db2.gz XERJPIAILRVKPM-UHFFFAOYSA-N -1 0 343.807 3.911 20 10 EHCDRM O=C(NCc1cc(Cl)cc(Cl)c1[O-])c1cc2ccccn2c1 ZINC000813682800 1136356324 /nfs/dbraw/zinc/35/63/24/1136356324.db2.gz KQKQPXYSVOSRLA-UHFFFAOYSA-N -1 0 335.190 3.882 20 10 EHCDRM C[C@@H](Cc1ccco1)C(=O)NCc1cc(Cl)cc(Cl)c1[O-] ZINC000854473651 1136619072 /nfs/dbraw/zinc/61/90/72/1136619072.db2.gz CORZKSUEGGTBRU-VIFPVBQESA-N -1 0 328.195 3.787 20 10 EHCDRM CC1(C)CN(Cc2cc(Cl)cc([N+](=O)[O-])c2[O-])[C@H]1c1ccncc1 ZINC000816621865 1136742408 /nfs/dbraw/zinc/74/24/08/1136742408.db2.gz QXFNJSAXAVEXIZ-INIZCTEOSA-N -1 0 347.802 3.932 20 10 EHCDRM CN(C)c1ccc(CNC(=O)c2cc(Cl)cc(Cl)c2[O-])cc1 ZINC001135825522 1136782426 /nfs/dbraw/zinc/78/24/26/1136782426.db2.gz XEADMMGFCDEYLC-UHFFFAOYSA-N -1 0 339.222 3.695 20 10 EHCDRM [O-]c1c(F)c(F)ccc1CNc1cc2c(cc1Cl)OCCO2 ZINC000864031264 1137212476 /nfs/dbraw/zinc/21/24/76/1137212476.db2.gz 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-1 0 347.292 3.925 20 10 EHCDRM O=C(NCc1cc(Cl)cc(Cl)c1[O-])N[C@H]1CCCC1(F)F ZINC000807597297 1135557789 /nfs/dbraw/zinc/55/77/89/1135557789.db2.gz YPUHZIRESXAYIT-JTQLQIEISA-N -1 0 339.169 3.686 20 10 EHCDRM C[C@H]1CC[C@@H](CCC(=O)NCc2cc(Cl)cc(Cl)c2[O-])O1 ZINC000807839201 1135581304 /nfs/dbraw/zinc/58/13/04/1135581304.db2.gz YWCVXXZEXMVFRD-CABZTGNLSA-N -1 0 332.227 3.663 20 10 EHCDRM Cc1csc(CCC(=O)NCc2cc(Cl)cc(Cl)c2[O-])n1 ZINC000807838462 1135581794 /nfs/dbraw/zinc/58/17/94/1135581794.db2.gz SCMZZDWBCJKLMZ-UHFFFAOYSA-N -1 0 345.251 3.713 20 10 EHCDRM CC1(C)CN(Cc2cc(Cl)cc([N+](=O)[O-])c2[O-])[C@H]1c1cccnc1 ZINC000814170731 1136414985 /nfs/dbraw/zinc/41/49/85/1136414985.db2.gz CQUJPIIWLKCCOC-INIZCTEOSA-N -1 0 347.802 3.932 20 10 EHCDRM C[C@H](Cc1ccco1)C(=O)NCc1cc(Cl)cc(Cl)c1[O-] ZINC000854473650 1136619194 /nfs/dbraw/zinc/61/91/94/1136619194.db2.gz CORZKSUEGGTBRU-SECBINFHSA-N -1 0 328.195 3.787 20 10 EHCDRM C[C@@H]1C[NH+](Cc2cccc(Br)c2[O-])C[C@@H](C)C1(F)F ZINC000862442270 1137145060 /nfs/dbraw/zinc/14/50/60/1137145060.db2.gz HISZSEPWPFLSES-NXEZZACHSA-N -1 0 334.204 3.878 20 10 EHCDRM C[C@H]1CCN(Cc2cc(Br)c(F)cc2[O-])CC1(F)F ZINC001144298485 1137268657 /nfs/dbraw/zinc/26/86/57/1137268657.db2.gz DPJNGHDSSQOIJL-QMMMGPOBSA-N -1 0 338.167 3.771 20 10 EHCDRM CSc1cc2c(cc1NCc1ccc(F)c(F)c1[O-])OCCO2 ZINC000877160057 1137671872 /nfs/dbraw/zinc/67/18/72/1137671872.db2.gz QSEQHMCRRIHCMG-UHFFFAOYSA-N -1 0 339.363 3.776 20 10 EHCDRM CCN1C(=O)CCc2cc(NCc3ccc(F)c(F)c3[O-])ccc21 ZINC000877347676 1137674653 /nfs/dbraw/zinc/67/46/53/1137674653.db2.gz NSPRZXVLLFJXNO-UHFFFAOYSA-N -1 0 332.350 3.582 20 10 EHCDRM [O-]c1c(Cl)cc(Cl)cc1CNc1nnc([C@H]2CCCO2)o1 ZINC000181789548 1139930609 /nfs/dbraw/zinc/93/06/09/1139930609.db2.gz RPNQGXIZAVMFKR-SNVBAGLBSA-N -1 0 330.171 3.546 20 10 EHCDRM Cc1cc(C(=O)NC(C)(C)CCC(=O)[O-])c(C)n1-c1ccc(F)cc1 ZINC000237577619 600384321 /nfs/dbraw/zinc/38/43/21/600384321.db2.gz ZNCKGBCYXQYISW-UHFFFAOYSA-N -1 0 346.402 3.606 20 10 EHCDRM O=C([O-])/C=C/c1ccc(N(Cc2cccs2)C2CC2)c([N+](=O)[O-])c1 ZINC000324698982 600609889 /nfs/dbraw/zinc/60/98/89/600609889.db2.gz PBNMLUMRNFATAI-XBXARRHUSA-N -1 0 344.392 3.923 20 10 EHCDRM CC(=O)c1cc(Cl)cc(C[N@H+](C)Cc2ccc(C(=O)[O-])cc2)c1O ZINC000825946917 601411940 /nfs/dbraw/zinc/41/19/40/601411940.db2.gz WUYNXYQBQBOXJR-UHFFFAOYSA-N -1 0 347.798 3.578 20 10 EHCDRM O=C([O-])CCC1CC[NH+](Cc2cc(Cl)cc(Cl)c2[O-])CC1 ZINC000086756151 957981209 /nfs/dbraw/zinc/98/12/09/957981209.db2.gz WMLHXHRDSPNDJQ-UHFFFAOYSA-N -1 0 332.227 3.776 20 10 EHCDRM Cc1ccc(C)n1-c1ccc(C)cc1C(=O)NCCC(C)(C)C(=O)[O-] ZINC001605241035 973000185 /nfs/dbraw/zinc/00/01/85/973000185.db2.gz VVXSQJRIKGYKMQ-UHFFFAOYSA-N -1 0 342.439 3.633 20 10 EHCDRM CCCN(Cc1ccccc1O)C(=O)Nc1ccccc1C(=O)[O-] ZINC001603672360 974048481 /nfs/dbraw/zinc/04/84/81/974048481.db2.gz FPVXEZZUQLWTBB-UHFFFAOYSA-N -1 0 328.368 3.535 20 10 EHCDRM CC(C)(C)c1ncc(/C=C\C(=O)N(CC(=O)[O-])c2ccccc2)s1 ZINC000752814591 978692820 /nfs/dbraw/zinc/69/28/20/978692820.db2.gz KTVYCVOBVSAPOD-KTKRTIGZSA-N -1 0 344.436 3.572 20 10 EHCDRM C[C@H](Cc1ccsc1)N(C)c1ccc(/C=C\C(=O)[O-])cc1[N+](=O)[O-] ZINC001592906146 979843181 /nfs/dbraw/zinc/84/31/81/979843181.db2.gz LOYKSOJICYHPCO-TXNVCOODSA-N -1 0 346.408 3.822 20 10 EHCDRM CN(Cc1ccc(F)cc1F)c1ccc(/C=C/C(=O)[O-])cc1[N+](=O)[O-] ZINC000884002526 980207333 /nfs/dbraw/zinc/20/73/33/980207333.db2.gz LJDQKIPGUXOOSS-XVNBXDOJSA-N -1 0 348.305 3.607 20 10 EHCDRM CC[C@@](C)(CC(=O)[O-])NC(=O)c1cc(C)n(-c2cccc(C)c2)c1C ZINC001594821290 981969601 /nfs/dbraw/zinc/96/96/01/981969601.db2.gz UZVNCDGJVNJOCT-FQEVSTJZSA-N -1 0 342.439 3.776 20 10 EHCDRM CCCN(C(=O)c1cc(C)n(-c2ccc(F)cc2)c1C)[C@@H](C)C(=O)[O-] ZINC001595824433 982703460 /nfs/dbraw/zinc/70/34/60/982703460.db2.gz HZQJHUGJLXUMOI-AWEZNQCLSA-N -1 0 346.402 3.559 20 10 EHCDRM COc1ccc(N(Cc2ccccc2)Cc2cccc(C(=O)[O-])n2)cc1 ZINC001599584067 993589331 /nfs/dbraw/zinc/58/93/31/993589331.db2.gz FXKFFQDSHJHJKY-UHFFFAOYSA-N -1 0 348.402 3.995 20 10 EHCDRM C[C@H](N[C@@H](c1nccn1C)c1cccc(F)c1)c1ccc(F)cc1O ZINC000184959509 1032346657 /nfs/dbraw/zinc/34/66/57/1032346657.db2.gz INDUUJQCBVOZPF-KPZWWZAWSA-N -1 0 343.377 3.844 20 10 EHCDRM COc1ccccc1-c1csc([N-]S(=O)(=O)c2ccccc2)n1 ZINC000075731298 1032675163 /nfs/dbraw/zinc/67/51/63/1032675163.db2.gz SCUDFGGYVUHMIE-UHFFFAOYSA-N -1 0 346.433 3.620 20 10 EHCDRM O=C(/C=C\c1ccc(O)c(O)c1)Nc1cc(Cl)c([O-])c(Cl)c1 ZINC000588407876 1020782990 /nfs/dbraw/zinc/78/29/90/1020782990.db2.gz MCHYPRXVLQUTPS-RQOWECAXSA-N -1 0 340.162 3.762 20 10 EHCDRM [O-]c1c(F)cc(Br)cc1C[N@@H+]1CC[C@]2(CC2(F)F)C1 ZINC000895149438 1025128355 /nfs/dbraw/zinc/12/83/55/1025128355.db2.gz HBVIPBJMTZOWSR-LBPRGKRZSA-N -1 0 336.151 3.525 20 10 EHCDRM C[C@@H](Nc1cccc(N2CCCC2=O)c1)c1cc([N+](=O)[O-])ccc1[O-] ZINC000273353015 1027390275 /nfs/dbraw/zinc/39/02/75/1027390275.db2.gz CCUFLTRUTBVBOB-GFCCVEGCSA-N -1 0 341.367 3.600 20 10 EHCDRM COc1cc(OC)c(N[C@@H](C)c2cc([N+](=O)[O-])ccc2[O-])cc1F ZINC000273371579 1027398792 /nfs/dbraw/zinc/39/87/92/1027398792.db2.gz AQWFSBHLDLZLHI-VIFPVBQESA-N -1 0 336.319 3.630 20 10 EHCDRM CCCNC(=O)c1cccc(N[C@@H](C)c2cc([N+](=O)[O-])ccc2[O-])c1 ZINC000273464295 1027441205 /nfs/dbraw/zinc/44/12/05/1027441205.db2.gz QVZQWUUTYBAJMO-LBPRGKRZSA-N -1 0 343.383 3.613 20 10 EHCDRM Cc1cc(C(=O)N[C@@H](C)CCC(=O)[O-])c(C)n1-c1cc(C)cc(C)c1 ZINC000237530135 1030900969 /nfs/dbraw/zinc/90/09/69/1030900969.db2.gz VDUMLWQTDAUBGZ-AWEZNQCLSA-N -1 0 342.439 3.694 20 10 EHCDRM Cc1cnn(-c2ccc(C)cc2NCc2cc([N+](=O)[O-])ccc2[O-])c1 ZINC000761321880 1033742256 /nfs/dbraw/zinc/74/22/56/1033742256.db2.gz RFOCBFDGWLFTSO-UHFFFAOYSA-N -1 0 338.367 3.715 20 10 EHCDRM CCOc1ccc(N(CC)Cc2nc(=O)c3sccc3[n-]2)cc1 ZINC000728917958 1039393794 /nfs/dbraw/zinc/39/37/94/1039393794.db2.gz OMMGNLWSXDCUOG-UHFFFAOYSA-N -1 0 329.425 3.822 20 10 EHCDRM O=c1cc(-c2nc(-c3ccc(-c4ccccc4)cc3)no2)cc([O-])[nH]1 ZINC001212565572 1130399615 /nfs/dbraw/zinc/39/96/15/1130399615.db2.gz YWWCCHNAGZEVBH-UHFFFAOYSA-N -1 0 331.331 3.877 20 10 EHCDRM O=C([O-])Cc1cccc(C(=O)c2ccccc2)c1Nc1cccc(O)c1 ZINC001174893576 1132496555 /nfs/dbraw/zinc/49/65/55/1132496555.db2.gz HGDDKZCNAZWKIA-UHFFFAOYSA-N -1 0 347.370 3.994 20 10 EHCDRM Cc1cc([C@@H]2CCCN2Cc2cc(Cl)cc([N+](=O)[O-])c2[O-])on1 ZINC000768879614 1133195763 /nfs/dbraw/zinc/19/57/63/1133195763.db2.gz WBXHYIBLDZIPEC-LBPRGKRZSA-N -1 0 337.763 3.587 20 10 EHCDRM CCc1ccc([C@@H]2CN(Cc3cc(F)cc(F)c3[O-])CCO2)cc1 ZINC001180885398 1133419923 /nfs/dbraw/zinc/41/99/23/1133419923.db2.gz PQINNWYVBQHZEE-SFHVURJKSA-N -1 0 333.378 3.806 20 10 EHCDRM COc1c(F)cc(F)cc1NCc1cc(Cl)cc([N+](=O)[O-])c1[O-] ZINC000770562422 1133450456 /nfs/dbraw/zinc/45/04/56/1133450456.db2.gz DBZGUZHQLBSRAN-UHFFFAOYSA-N -1 0 344.701 3.853 20 10 EHCDRM CC(=O)c1cc([N-]S(=O)(=O)c2cc3ccccc3s2)ccc1O ZINC001185459153 1134091010 /nfs/dbraw/zinc/09/10/10/1134091010.db2.gz FONSISRWNOSQMP-UHFFFAOYSA-N -1 0 347.417 3.610 20 10 EHCDRM O=C([O-])C[C@H]([NH2+]Cc1c([O-])ccc(Cl)c1F)c1cccs1 ZINC000789897929 1134347290 /nfs/dbraw/zinc/34/72/90/1134347290.db2.gz PRYBQJGZXIYGLH-JTQLQIEISA-N -1 0 329.780 3.552 20 10 EHCDRM Cc1cc([N-]S(=O)(=O)c2cc(Cl)ccc2F)c(C)c(C)c1O ZINC000790069139 1134362738 /nfs/dbraw/zinc/36/27/38/1134362738.db2.gz ULHOISAWBSHWRK-UHFFFAOYSA-N -1 0 343.807 3.911 20 10 EHCDRM Cn1ccnc1[C@H](NCc1c([O-])ccc(Cl)c1F)c1ccccc1 ZINC000790949646 1134484062 /nfs/dbraw/zinc/48/40/62/1134484062.db2.gz GRPGHABLWLTATJ-QGZVFWFLSA-N -1 0 345.805 3.797 20 10 EHCDRM CCc1nc([C@@H]2CCCCN2Cc2c([O-])ccc(Cl)c2F)no1 ZINC000792167366 1134661705 /nfs/dbraw/zinc/66/17/05/1134661705.db2.gz PRSNUTXOQLFIER-LBPRGKRZSA-N -1 0 339.798 3.857 20 10 EHCDRM [O-]c1ccc(Cl)c(F)c1CN1CCO[C@]2(CCc3ccccc32)C1 ZINC000792165583 1134661785 /nfs/dbraw/zinc/66/17/85/1134661785.db2.gz IZILQZHNMWRPJW-LJQANCHMSA-N -1 0 347.817 3.859 20 10 EHCDRM Nc1cccc2cccc(NC(=O)c3cc(O)c([O-])c(Cl)c3)c12 ZINC001193626422 1135161155 /nfs/dbraw/zinc/16/11/55/1135161155.db2.gz ZTJRQVSIFXECPF-UHFFFAOYSA-N -1 0 328.755 3.739 20 10 EHCDRM CCCC[C@@H](COC)NC(=O)NCc1cc(Cl)cc(Cl)c1[O-] ZINC000805134532 1135237213 /nfs/dbraw/zinc/23/72/13/1135237213.db2.gz BUSHBCBNCVQETF-LBPRGKRZSA-N -1 0 349.258 3.703 20 10 EHCDRM COc1cccc(CC(=O)NCc2cc(Cl)cc(Cl)c2[O-])c1 ZINC000807837713 1135580148 /nfs/dbraw/zinc/58/01/48/1135580148.db2.gz BJCAUOQCQVYHLI-UHFFFAOYSA-N -1 0 340.206 3.567 20 10 EHCDRM CCC1(C(=O)NCc2cc(Cl)cc(Cl)c2[O-])CCOCC1 ZINC000807836578 1135580607 /nfs/dbraw/zinc/58/06/07/1135580607.db2.gz GHAKKQOYKCBORR-UHFFFAOYSA-N -1 0 332.227 3.522 20 10 EHCDRM Cc1cc(C(=O)NCc2cc(Cl)cc(Cl)c2[O-])c(C)n1C ZINC000807838808 1135581702 /nfs/dbraw/zinc/58/17/02/1135581702.db2.gz RBWBFWPDDZKKES-UHFFFAOYSA-N -1 0 327.211 3.584 20 10 EHCDRM Nc1c(F)c(NCc2cc(Cl)cc(Cl)c2[O-])ccc1[N+](=O)[O-] ZINC000808089814 1135616203 /nfs/dbraw/zinc/61/62/03/1135616203.db2.gz ZSJPSZOINYYTTC-UHFFFAOYSA-N -1 0 346.145 3.941 20 10 EHCDRM CO[C@H](C)c1nsc(NCc2cc(Cl)cc(Cl)c2[O-])n1 ZINC000808089827 1135616252 /nfs/dbraw/zinc/61/62/52/1135616252.db2.gz KWUDTTIPXMWRQM-ZCFIWIBFSA-N -1 0 334.228 3.870 20 10 EHCDRM O=S(=O)([N-]c1ccno1)c1ccc(/N=N/c2ccccc2)cc1 ZINC001197161976 1135655226 /nfs/dbraw/zinc/65/52/26/1135655226.db2.gz OWOJIISCJDKCOM-ISLYRVAYSA-N -1 0 328.353 3.891 20 10 EHCDRM C[C@@H](NCc1cccc(Cl)c1[O-])c1noc(Cc2ccccc2)n1 ZINC000809658863 1135861749 /nfs/dbraw/zinc/86/17/49/1135861749.db2.gz YHYFFSVJSSPPMD-GFCCVEGCSA-N -1 0 343.814 3.870 20 10 EHCDRM CSC1(CNC(=O)NCc2cc(Cl)cc(Cl)c2[O-])CCC1 ZINC000805388853 1136025431 /nfs/dbraw/zinc/02/54/31/1136025431.db2.gz VKIAJANCEVEPCC-UHFFFAOYSA-N -1 0 349.283 3.784 20 10 EHCDRM O=C(CCc1ccc(O)cc1)NCc1cc(Cl)cc(Cl)c1[O-] ZINC000813684071 1136356186 /nfs/dbraw/zinc/35/61/86/1136356186.db2.gz CUHVXBZGHRJJAR-UHFFFAOYSA-N -1 0 340.206 3.654 20 10 EHCDRM CCSC1(CNC(=O)NCc2cc(Cl)cc(Cl)c2[O-])CC1 ZINC000852629675 1136471914 /nfs/dbraw/zinc/47/19/14/1136471914.db2.gz XBFRDJXFACZIIS-UHFFFAOYSA-N -1 0 349.283 3.784 20 10 EHCDRM Cc1csc([C@@H](C)C(=O)NCc2cc(Cl)cc(Cl)c2[O-])n1 ZINC000854475410 1136619204 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COC[C@@H]([NH2+]Cc1cc(F)cc(F)c1[O-])c1cccc(Cl)c1 ZINC000883121223 1137845278 /nfs/dbraw/zinc/84/52/78/1137845278.db2.gz BHSXWHDLDJKUMS-OAHLLOKOSA-N -1 0 327.758 3.801 20 10 EHCDRM O=C([O-])Nc1ccccc1C(=O)Nc1cccc(N2CCCC2)c1 ZINC000740057541 600572113 /nfs/dbraw/zinc/57/21/13/600572113.db2.gz XXYVPNQLQVAKIA-UHFFFAOYSA-N -1 0 325.368 3.629 20 10 EHCDRM C[C@@H](c1cccc(O)c1)N(C)c1ccc(/C=C/C(=O)[O-])cc1[N+](=O)[O-] ZINC000827942010 600998905 /nfs/dbraw/zinc/99/89/05/600998905.db2.gz OPGHZDGCTZISGR-CRALRDPISA-N -1 0 342.351 3.596 20 10 EHCDRM C[C@H]([NH2+]Cc1cc(Cl)cc(Cl)c1[O-])[C@H]1CCCN(C(=O)[O-])C1 ZINC000739030953 602002075 /nfs/dbraw/zinc/00/20/75/602002075.db2.gz IERXNWNKMUMIBH-UWVGGRQHSA-N -1 0 347.242 3.567 20 10 EHCDRM CC[C@H](C)[C@H](NC(=O)c1cc(C)n(-c2cccc(C)c2)c1C)C(=O)[O-] ZINC001593613510 953475690 /nfs/dbraw/zinc/47/56/90/953475690.db2.gz LIUNSFAJNUGIME-UGSOOPFHSA-N -1 0 342.439 3.632 20 10 EHCDRM Cc1cc(C(=O)CSCCC(=O)[O-])c(C)n1-c1cccc(F)c1 ZINC001594274526 957711365 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