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370.427 1.481 20 10 FDCDRM CN(C)c1ccc(CNS(=O)(=O)N2CCC(C(=O)[O-])CC2)cc1F ZINC001604090975 972490361 /nfs/dbraw/zinc/49/03/61/972490361.db2.gz NDODBHRVTQVWEH-UHFFFAOYSA-N -1 0 359.423 1.023 20 10 FDCDRM O=C([O-])[C@H]1C[C@@H](C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 ZINC001347576648 962407205 /nfs/dbraw/zinc/40/72/05/962407205.db2.gz UOOJJRIRAJEGKL-BETUJISGSA-N -1 0 350.390 1.514 20 10 FDCDRM O=C(N[C@H]1CC12CCC2)[C@@H]1CC(=O)c2oc(=O)c3cc(O)c(O)c([O-])c3c21 ZINC001185557403 963976612 /nfs/dbraw/zinc/97/66/12/963976612.db2.gz CHZCTFLUJHYQMI-HQJQHLMTSA-N -1 0 371.345 1.639 20 10 FDCDRM Nc1n[nH]c(CC(=O)Nc2cc3c(cc2[O-])C(=O)c2ccccc2C3=O)n1 ZINC001180248002 965176056 /nfs/dbraw/zinc/17/60/56/965176056.db2.gz MGMIFNDOQFOGSK-UHFFFAOYSA-N -1 0 363.333 1.049 20 10 FDCDRM CCn1cc(S(=O)(=O)[N-]c2ccc(O)cc2C(=O)OC)c([N+](=O)[O-])n1 ZINC000775287230 967206044 /nfs/dbraw/zinc/20/60/44/967206044.db2.gz WFZOGGTUEDKDID-UHFFFAOYSA-N -1 0 370.343 1.104 20 10 FDCDRM CO[C@@](C)(C(=O)[O-])C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 ZINC000852942414 967722339 /nfs/dbraw/zinc/72/23/39/967722339.db2.gz IZEMDXTZIBZPSF-GOSISDBHSA-N -1 0 350.415 1.001 20 10 FDCDRM O=C([O-])C1(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CCC1 ZINC000852950997 967727226 /nfs/dbraw/zinc/72/72/26/967727226.db2.gz ANVFLJRWLRKCDO-UHFFFAOYSA-N -1 0 350.390 1.658 20 10 FDCDRM COc1ccc(N(CC(=O)[O-])CC(=O)NC[C@]2(C)CCCS2)cc1 ZINC000853006303 967769876 /nfs/dbraw/zinc/76/98/76/967769876.db2.gz RMCWYQGHRHNHSD-KRWDZBQOSA-N -1 0 352.456 1.988 20 10 FDCDRM COC[C@@H]1CN(C(=O)c2cc(O)c([O-])c(Cl)c2)Cc2cn(C)nc21 ZINC001193604336 969790148 /nfs/dbraw/zinc/79/01/48/969790148.db2.gz UPMVVUOWLXBVPI-NSHDSACASA-N -1 0 351.790 1.871 20 10 FDCDRM CO[C@](C)(C(=O)[O-])C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O ZINC001604464620 973338232 /nfs/dbraw/zinc/33/82/32/973338232.db2.gz XNFKEBHWBLEKDX-IBGZPJMESA-N -1 0 353.330 1.890 20 10 FDCDRM CO[C@H]1CN(C(=O)NCc2ccc(N(C)C)c(F)c2)[C@@](C)(C(=O)[O-])C1 ZINC000864521272 973602752 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LFTURIVAWGFLOU-UHFFFAOYSA-N -1 0 368.409 1.508 20 10 FDCDRM COc1cccc(CNC(=O)Cc2[nH]c(C(C)=O)c(C)c2C(=O)[O-])c1O ZINC000832554929 604369806 /nfs/dbraw/zinc/36/98/06/604369806.db2.gz ZZAUJJBMSHPWLT-UHFFFAOYSA-N -1 0 360.366 1.797 20 10 FDCDRM C[C@H](NC(=O)[O-])[C@@H]1CN(C(=O)NCc2ccc(N(C)C)cc2)CCO1 ZINC000825318854 604446680 /nfs/dbraw/zinc/44/66/80/604446680.db2.gz PWSVPHAAHFPGQQ-WFASDCNBSA-N -1 0 350.419 1.319 20 10 FDCDRM COc1ccc(O)c(CNC(=O)C(=O)Nc2cc(C(=O)[O-])cs2)c1 ZINC000832424967 604538774 /nfs/dbraw/zinc/53/87/74/604538774.db2.gz LXJAXSJKMCJGQB-UHFFFAOYSA-N -1 0 350.352 1.415 20 10 FDCDRM CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H](C(=O)[O-])c2ccccc2)c1 ZINC000833737152 604708282 /nfs/dbraw/zinc/70/82/82/604708282.db2.gz BGVNFOZCYPJRHC-CQSZACIVSA-N -1 0 364.379 1.319 20 10 FDCDRM C[C@H](NC(=O)[O-])[C@H]1CN(C(=O)NCCCSc2nccs2)CCO1 ZINC000825319433 604820529 /nfs/dbraw/zinc/82/05/29/604820529.db2.gz WIWRIRYEIYQNTJ-WDEREUQCSA-N -1 0 374.488 1.692 20 10 FDCDRM CN(C)c1ccc2c(c1)OCCN2C(=O)CO[C@@H]1CCCN(C(=O)[O-])C1 ZINC000828074608 605757241 /nfs/dbraw/zinc/75/72/41/605757241.db2.gz YHFZPASJBDLICA-CQSZACIVSA-N -1 0 363.414 1.637 20 10 FDCDRM O=C([O-])N(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)C1CC1 ZINC000833998213 605962459 /nfs/dbraw/zinc/96/24/59/605962459.db2.gz PLFNZGXEQXJQIR-UHFFFAOYSA-N -1 0 351.378 1.421 20 10 FDCDRM COC(=O)c1cc(O)ccc1[N-]S(=O)(=O)c1cnn([C@H]2CCOC2)c1 ZINC000274760060 674595992 /nfs/dbraw/zinc/59/59/92/674595992.db2.gz QSEOITAMVPOAJO-JTQLQIEISA-N -1 0 367.383 1.138 20 10 FDCDRM CS(=O)(=O)Nc1ccc([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])cc1 ZINC000023397981 670706022 /nfs/dbraw/zinc/70/60/22/670706022.db2.gz BBMSWTGESMFIOG-UHFFFAOYSA-N -1 0 371.396 1.767 20 10 FDCDRM CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC[C@H]2c2cc[nH]n2)c1 ZINC000286986059 675910659 /nfs/dbraw/zinc/91/06/59/675910659.db2.gz HRSOQJIBFLDLOX-ZDUSSCGKSA-N -1 0 350.400 1.464 20 10 FDCDRM C[S@@](=O)Cc1cccc([N-]S(=O)(=O)c2cccc3nonc32)c1 ZINC000163638301 672024828 /nfs/dbraw/zinc/02/48/28/672024828.db2.gz SXSCSCAXPILXGF-QFIPXVFZSA-N -1 0 351.409 1.902 20 10 FDCDRM O=S(=O)(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)N1CCC1 ZINC000370572185 677593294 /nfs/dbraw/zinc/59/32/94/677593294.db2.gz MXHAIGRVFCNOLI-CQSZACIVSA-N -1 0 359.879 1.550 20 10 FDCDRM NC(=O)[C@@H]1CN(Cc2c(O)ccc(C(=O)c3ccccc3)c2[O-])CCO1 ZINC000728197554 769979768 /nfs/dbraw/zinc/97/97/68/769979768.db2.gz DWDUFSGWEXULGH-INIZCTEOSA-N -1 0 356.378 1.015 20 10 FDCDRM O=C([O-])Cn1c(/C=C/c2cn(C3CCC3)nn2)nc2ccccc2c1=O ZINC000656612739 776985682 /nfs/dbraw/zinc/98/56/82/776985682.db2.gz LFQPLRPBUJOSHD-CMDGGOBGSA-N -1 0 351.366 1.968 20 10 FDCDRM O=C1CN(C2CN(Cc3cc(Cl)cc(Br)c3[O-])C2)CCN1 ZINC001141373125 806675153 /nfs/dbraw/zinc/67/51/53/806675153.db2.gz OEGCOADBHCYPEH-UHFFFAOYSA-N -1 0 374.666 1.424 20 10 FDCDRM [O-]c1c(Br)cc(Cl)cc1CN1CCn2c(CO)nnc2C1 ZINC000894070443 809893803 /nfs/dbraw/zinc/89/38/03/809893803.db2.gz HIPBFWAIRUVMPP-UHFFFAOYSA-N -1 0 373.638 1.908 20 10 FDCDRM [O-]c1c(Br)cc(Cl)cc1CN1CC[C@H](O)[C@H](CO)C1 ZINC000895014843 819464262 /nfs/dbraw/zinc/46/42/62/819464262.db2.gz PBEMCOJNKAZJHS-CABZTGNLSA-N -1 0 350.640 1.983 20 10 FDCDRM COc1ccc(N(CC(=O)[O-])CC(=O)NC[C@@H]2C[C@H]2C(F)(F)F)cc1 ZINC000899841994 846764533 /nfs/dbraw/zinc/76/45/33/846764533.db2.gz URWJMENAOYRRHA-GXFFZTMASA-N -1 0 360.332 1.901 20 10 FDCDRM O=C([O-])c1cnn(CC(=O)NCc2ccc(N3CCSCC3)cc2)c1 ZINC000911228925 858375839 /nfs/dbraw/zinc/37/58/39/858375839.db2.gz VBHCOSCOMKQZGQ-UHFFFAOYSA-N -1 0 360.439 1.451 20 10 FDCDRM C[N@H+](CCc1ccccc1)CC(=O)N(CC(=O)[O-])Cc1ccccc1O ZINC000911488697 858677318 /nfs/dbraw/zinc/67/73/18/858677318.db2.gz MSAXKPNHVVVIPN-UHFFFAOYSA-N -1 0 356.422 1.980 20 10 FDCDRM CC[C@H](C(=O)N(CC(=O)[O-])Cc1ccccc1O)N1CCO[C@H](CC)C1 ZINC000911489160 858678207 /nfs/dbraw/zinc/67/82/07/858678207.db2.gz QEBPSDHBXVWGNG-HZPDHXFCSA-N -1 0 364.442 1.695 20 10 FDCDRM O=C([O-])CN(Cc1ccccc1O)C(=O)[C@@H]1CCN(CC(F)(F)F)C1 ZINC000911494208 858687008 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NS(=O)(=O)c1cc(C(=O)NCc2cc(Cl)cc(Cl)c2[O-])co1 ZINC000807840744 940482338 /nfs/dbraw/zinc/48/23/38/940482338.db2.gz ITTFYJKAEAKGGT-UHFFFAOYSA-N -1 0 365.194 1.869 20 10 FDCDRM O=C([O-])c1cc(S(=O)(=O)NCc2ccc(O)cc2O)c(F)cc1F ZINC001195253732 970794827 /nfs/dbraw/zinc/79/48/27/970794827.db2.gz BMKWDUNXAUQHKZ-UHFFFAOYSA-N -1 0 359.306 1.553 20 10 FDCDRM CC(C)[C@H](NS(C)(=O)=O)C(=O)NCc1cc(Cl)cc(Cl)c1[O-] ZINC000813685348 941441300 /nfs/dbraw/zinc/44/13/00/941441300.db2.gz GOMQTDASTDOSLZ-NSHDSACASA-N -1 0 369.270 1.889 20 10 FDCDRM O=C(NCc1cc(Cl)cc(Cl)c1[O-])N[C@@H]1CCc2nnnn2CC1 ZINC000817810409 942963503 /nfs/dbraw/zinc/96/35/03/942963503.db2.gz XPCPXMGQFONJJS-SNVBAGLBSA-N -1 0 371.228 1.890 20 10 FDCDRM CC(C)C[C@H](CNC(=O)C(=O)NCc1ccc(N(C)C)c(F)c1)C(=O)[O-] ZINC000818657087 943320751 /nfs/dbraw/zinc/32/07/51/943320751.db2.gz PFKMZOFYQGAMBT-CYBMUJFWSA-N -1 0 367.421 1.371 20 10 FDCDRM CC1CCC(O)(CNC(=O)c2cc(NS(C)(=O)=O)ccc2O)CC1 ZINC000856473855 971176596 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361.442 1.775 20 10 FDCDRM O=C([O-])c1cc(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)[nH]n1 ZINC001605793431 972508467 /nfs/dbraw/zinc/50/84/67/972508467.db2.gz OZNUWLVHLPVRPQ-UHFFFAOYSA-N -1 0 366.324 1.153 20 10 FDCDRM Cc1ccc(C(=O)N2C[C@H](C(=O)[O-])C[C@H](c3cnn(C)c3)C2)c(O)c1O ZINC001574351262 960989770 /nfs/dbraw/zinc/98/97/70/960989770.db2.gz JGXZQMUTLLQKGZ-NWDGAFQWSA-N -1 0 359.382 1.470 20 10 FDCDRM C[C@H]1C(=O)OC[C@H]1C(=O)Nc1cc2c(cc1[O-])C(=O)c1ccccc1C2=O ZINC001182084307 961418855 /nfs/dbraw/zinc/41/88/55/961418855.db2.gz GDRJIJRPNKDLSU-YMTOWFKASA-N -1 0 365.341 1.915 20 10 FDCDRM CC(C)(C)OC(=O)N[C@H](CC(=O)NCS(=O)(=O)[O-])c1ccccc1O ZINC001184075162 963414242 /nfs/dbraw/zinc/41/42/42/963414242.db2.gz IVRAMNGRDVLZMP-LLVKDONJSA-N -1 0 374.415 1.310 20 10 FDCDRM CCOC(=O)c1sc(S(=O)(=O)[N-]c2cccc(O)c2O)nc1C ZINC001184956819 963760719 /nfs/dbraw/zinc/76/07/19/963760719.db2.gz HTWVOLCHUQYVBB-UHFFFAOYSA-N -1 0 358.397 1.840 20 10 FDCDRM O=C(N[C@H]1CC=CCC1)[C@@H]1CC(=O)c2oc(=O)c3cc(O)c(O)c([O-])c3c21 ZINC001185558386 963976317 /nfs/dbraw/zinc/97/63/17/963976317.db2.gz KIFFSMNPRIXFQH-DTWKUNHWSA-N -1 0 371.345 1.805 20 10 FDCDRM O=C(Nc1ncccn1)[C@@H]1CC(=O)c2oc(=O)c3cc(O)c(O)c([O-])c3c21 ZINC001185541298 963987783 /nfs/dbraw/zinc/98/77/83/963987783.db2.gz IUGOCHHXVPBYGB-ZCFIWIBFSA-N -1 0 369.289 1.009 20 10 FDCDRM O=[N+]([O-])c1cc(NS(=O)(=O)c2ccc(-n3cnnn3)cc2)ccc1[O-] ZINC000775285947 967149315 /nfs/dbraw/zinc/14/93/15/967149315.db2.gz GABWRWHVRXEYAQ-UHFFFAOYSA-N -1 0 362.327 1.077 20 10 FDCDRM COC(=O)Cc1ccc(S(=O)(=O)Nc2ccc([O-])c([N+](=O)[O-])c2)cc1 ZINC000775285746 967151603 /nfs/dbraw/zinc/15/16/03/967151603.db2.gz AINAUOPLHCOWJQ-UHFFFAOYSA-N -1 0 366.351 1.817 20 10 FDCDRM Cc1cc([N-]S(=O)(=O)c2ccccc2S(N)(=O)=O)c(C)c(C)c1O ZINC000775294506 967196916 /nfs/dbraw/zinc/19/69/16/967196916.db2.gz PCVQLIHLWUCLNN-UHFFFAOYSA-N -1 0 370.452 1.766 20 10 FDCDRM COCC1(CNC(=O)CN(CC(=O)[O-])c2ccc(OC)cc2)CCC1 ZINC000853008651 967771087 /nfs/dbraw/zinc/77/10/87/967771087.db2.gz WCKGCHGYGOBYFA-UHFFFAOYSA-N -1 0 350.415 1.519 20 10 FDCDRM COc1ccc(N(CC(=O)[O-])CC(=O)NCCc2cnccc2C)cc1 ZINC000853010477 967771954 /nfs/dbraw/zinc/77/19/54/967771954.db2.gz CPWJOKKMTZAVLJ-UHFFFAOYSA-N -1 0 357.410 1.649 20 10 FDCDRM CCO[C@@H](CS(=O)(=O)[N-]c1cc(F)c(O)cc1C(=O)OC)C1CC1 ZINC000863410396 972885175 /nfs/dbraw/zinc/88/51/75/972885175.db2.gz CSQYNXJDIXYILI-AWEZNQCLSA-N -1 0 361.391 1.875 20 10 FDCDRM NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@H]3CC[C@H]3C(=O)[O-])cc2)C1 ZINC001605628031 973973751 /nfs/dbraw/zinc/97/37/51/973973751.db2.gz SFNDFGUIKQQPQH-CWRNSKLLSA-N -1 0 359.426 1.115 20 10 FDCDRM O=C([O-])[C@]12COC[C@H]1CN(C(=O)NCCCSc1nccs1)C2 ZINC000851651997 978984824 /nfs/dbraw/zinc/98/48/24/978984824.db2.gz ROLNBGZRNIBLLQ-QMTHXVAHSA-N -1 0 357.457 1.368 20 10 FDCDRM O=C([O-])C1CCN(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)CC1 ZINC000851653223 978985255 /nfs/dbraw/zinc/98/52/55/978985255.db2.gz CSONXFYVOMCOQQ-UHFFFAOYSA-N -1 0 361.442 1.654 20 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352.456 1.743 20 10 FDCDRM C[C@@H]1CN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C[C@H]1C(=O)[O-] ZINC000828363422 601651628 /nfs/dbraw/zinc/65/16/28/601651628.db2.gz VUHZGIXEDJFDGH-TZMCWYRMSA-N -1 0 365.405 1.524 20 10 FDCDRM Cc1c(C(=O)NCc2ccccc2O)nnn1C1CCN(C(=O)[O-])CC1 ZINC000740038809 602126702 /nfs/dbraw/zinc/12/67/02/602126702.db2.gz UZWBQHQXOVBXJW-UHFFFAOYSA-N -1 0 359.386 1.537 20 10 FDCDRM C[C@H]1CN(C(=O)[O-])CCN1C(=O)NCc1ccc(N2CCOCC2)cc1 ZINC000739155243 602747514 /nfs/dbraw/zinc/74/75/14/602747514.db2.gz RWTVFRZFKUUEBH-AWEZNQCLSA-N -1 0 362.430 1.417 20 10 FDCDRM CN(C)c1ccc([C@@H](CNC(=O)CN2CCCCC2=O)NC(=O)[O-])cc1 ZINC000828064386 603030886 /nfs/dbraw/zinc/03/08/86/603030886.db2.gz QQUNBDPUBLSDHR-OAHLLOKOSA-N -1 0 362.430 1.190 20 10 FDCDRM CN(C)c1ccc([C@@H](CNC(=O)CCn2ccccc2=O)NC(=O)[O-])cc1 ZINC000828063142 603030891 /nfs/dbraw/zinc/03/08/91/603030891.db2.gz ARBDAPMUADEGCQ-MRXNPFEDSA-N -1 0 372.425 1.430 20 10 FDCDRM CCN1C[C@@H](C(=O)NC[C@@H](NC(=O)[O-])c2ccc(N(C)C)cc2)CC1=O ZINC000827199123 603034190 /nfs/dbraw/zinc/03/41/90/603034190.db2.gz NIYSGRKQQNLMQS-DZGCQCFKSA-N -1 0 362.430 1.046 20 10 FDCDRM CCN(CC)c1ccc(CNC(=O)[C@H]2C[C@H](O)CN2C(=O)[O-])cc1F ZINC000739411443 603097099 /nfs/dbraw/zinc/09/70/99/603097099.db2.gz LCRGARVNCBHKDK-SWLSCSKDSA-N -1 0 353.394 1.401 20 10 FDCDRM O=C([O-])N1CC(OCC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)C1 ZINC000831852789 603753668 /nfs/dbraw/zinc/75/36/68/603753668.db2.gz UZJXIGJKRSJWLC-CQSZACIVSA-N -1 0 364.398 1.279 20 10 FDCDRM O=C([O-])N1CCO[C@H](C(=O)NCc2ccc(N3CCSCC3)cc2)C1 ZINC000831715048 604722545 /nfs/dbraw/zinc/72/25/45/604722545.db2.gz LOCNYGGULLWSGM-HNNXBMFYSA-N -1 0 365.455 1.235 20 10 FDCDRM COc1ccc(O)c(CNC(=O)NC[C@H]2[C@@H](C)OC(C)(C)N2C(=O)[O-])c1 ZINC000829483789 604882208 /nfs/dbraw/zinc/88/22/08/604882208.db2.gz KXIQROIUFSHIMY-MFKMUULPSA-N -1 0 367.402 1.703 20 10 FDCDRM Cn1cc(NC(=O)C(=O)NCc2ccc3c(c2)CCCN3C)cc1C(=O)[O-] ZINC000833697691 605027396 /nfs/dbraw/zinc/02/73/96/605027396.db2.gz 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ZINC000785408434 826247856 /nfs/dbraw/zinc/24/78/56/826247856.db2.gz SHWLOEMCJMSEDF-UHFFFAOYSA-N -1 0 370.408 1.157 20 10 FDCDRM COc1ccc(N(CC(=O)[O-])CC(=O)NC[C@@H]2CC[C@H](C3CC3)O2)cc1 ZINC000899848520 846777496 /nfs/dbraw/zinc/77/74/96/846777496.db2.gz DEPWAJBVKYIYLO-DLBZAZTESA-N -1 0 362.426 1.660 20 10 FDCDRM O=C([O-])C12CC(C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)(C1)C2 ZINC000911228984 858375854 /nfs/dbraw/zinc/37/58/54/858375854.db2.gz WXFBGAZZQZTSBM-UHFFFAOYSA-N -1 0 362.401 1.658 20 10 FDCDRM CCCC(=O)N1CCC[C@H](C(=O)N(CC(=O)[O-])Cc2ccccc2O)C1 ZINC000911485937 858673437 /nfs/dbraw/zinc/67/34/37/858673437.db2.gz LRQGBKJHNCEKTQ-HNNXBMFYSA-N -1 0 362.426 1.844 20 10 FDCDRM CC(=O)c1cc(O)ccc1[N-]S(=O)(=O)c1ccccc1S(N)(=O)=O ZINC000766048777 882143900 /nfs/dbraw/zinc/14/39/00/882143900.db2.gz VYSIFBQAURFOEL-UHFFFAOYSA-N -1 0 370.408 1.043 20 10 FDCDRM O=C1OCCN1c1cccc([N-]S(=O)(=O)c2cccc3nonc32)c1 ZINC000765039331 906294390 /nfs/dbraw/zinc/29/43/90/906294390.db2.gz SNAIFVPLZUACDR-UHFFFAOYSA-N -1 0 360.351 1.980 20 10 FDCDRM COC(=O)COc1cccc([N-]S(=O)(=O)c2cccc3nonc32)c1 ZINC000765048903 906311918 /nfs/dbraw/zinc/31/19/18/906311918.db2.gz MVTCKQFBFYLSDB-UHFFFAOYSA-N -1 0 363.351 1.575 20 10 FDCDRM Cn1c2ccc([N-]S(=O)(=O)c3cccc4nonc43)cc2n(C)c1=O ZINC000765066923 906312951 /nfs/dbraw/zinc/31/29/51/906312951.db2.gz IPUKUIPZDNLQIT-UHFFFAOYSA-N -1 0 359.367 1.214 20 10 FDCDRM CN(C)S(=O)(=O)CCNC(=O)NCc1cc(Cl)cc(Cl)c1[O-] ZINC000811976687 941175773 /nfs/dbraw/zinc/17/57/73/941175773.db2.gz FFDMPOQINFLWBN-UHFFFAOYSA-N -1 0 370.258 1.390 20 10 FDCDRM CC1CCN(c2ccc(CNC(=O)C(=O)N(C)CCC(=O)[O-])cc2)CC1 ZINC000817110494 942548269 /nfs/dbraw/zinc/54/82/69/942548269.db2.gz GHPCXIALOGBLHI-UHFFFAOYSA-N -1 0 361.442 1.472 20 10 FDCDRM C[C@H](NC(=O)C(=O)NC1CCC(C(=O)[O-])CC1)c1ccc(N(C)C)cc1 ZINC000817115979 942554726 /nfs/dbraw/zinc/55/47/26/942554726.db2.gz OVNXWIGZQKTYAX-GRTSSRMGSA-N -1 0 361.442 1.689 20 10 FDCDRM CN(C)c1ccc(CN(C)C(=O)C(=O)N2CCC[C@@H](CC(=O)[O-])C2)cc1 ZINC000817888745 943044056 /nfs/dbraw/zinc/04/40/56/943044056.db2.gz KAFDUQXXBRFBNR-HNNXBMFYSA-N -1 0 361.442 1.424 20 10 FDCDRM CCCN(Cc1ccccc1O)C(=O)C(=O)N1C[C@H](C)C[C@H](C(=O)[O-])C1 ZINC000817897489 943069573 /nfs/dbraw/zinc/06/95/73/943069573.db2.gz QVQXRGWLCJOMHU-HIFRSBDPSA-N -1 0 362.426 1.700 20 10 FDCDRM COc1ccc(N2CC[C@@H](NC(=O)Cc3cc(=O)n(CC(C)C)[n-]3)C2)cc1 ZINC000824729554 946730735 /nfs/dbraw/zinc/73/07/35/946730735.db2.gz XAFNABFTDGPICJ-OAHLLOKOSA-N -1 0 372.469 1.779 20 10 FDCDRM C[C@H]1CN(c2ccc(/C=C\C(=O)[O-])cc2[N+](=O)[O-])CCN1S(C)(=O)=O ZINC000844214631 947884494 /nfs/dbraw/zinc/88/44/94/947884494.db2.gz SKCRMXRQELHTNB-QZPNVGJNSA-N -1 0 369.399 1.163 20 10 FDCDRM CCC[C@@H](CC)S(=O)(=O)Nc1ccc([O-])c(S(=O)(=O)NC)c1 ZINC000844665531 948291380 /nfs/dbraw/zinc/29/13/80/948291380.db2.gz HCHJFCPWTKRESL-LLVKDONJSA-N -1 0 350.462 1.621 20 10 FDCDRM O=C([O-])C1CN(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1 ZINC000857096854 971576017 /nfs/dbraw/zinc/57/60/17/971576017.db2.gz HYJZYLRUMZLCLF-UHFFFAOYSA-N -1 0 369.368 1.983 20 10 FDCDRM O=C([O-])[C@H]1CC[C@@H](C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 ZINC000846709313 951523832 /nfs/dbraw/zinc/52/38/32/951523832.db2.gz CNHJKYPXUJWPJK-KGLIPLIRSA-N -1 0 364.417 1.904 20 10 FDCDRM O=C(NCCC1CCS(=O)(=O)CC1)c1cc(=O)n(-c2ccccc2)[n-]1 ZINC001147889896 952559093 /nfs/dbraw/zinc/55/90/93/952559093.db2.gz VGXKIEZBSHQYIE-UHFFFAOYSA-N -1 0 363.439 1.110 20 10 FDCDRM O=C(CCCNC(=O)c1cc(=O)n(-c2ccccc2)[n-]1)c1cccnc1 ZINC001147892077 952559716 /nfs/dbraw/zinc/55/97/16/952559716.db2.gz AHQOQWRGSAXNFX-UHFFFAOYSA-N -1 0 350.378 1.954 20 10 FDCDRM O=C(Nc1cncc(N2CCOCC2)n1)c1cc(=O)n(-c2ccccc2)[n-]1 ZINC001147878916 952569223 /nfs/dbraw/zinc/56/92/23/952569223.db2.gz XIBMUYZGDDZQEJ-UHFFFAOYSA-N -1 0 366.381 1.045 20 10 FDCDRM CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1cccn(CC(=O)[O-])c1=O ZINC001593759935 954475332 /nfs/dbraw/zinc/47/53/32/954475332.db2.gz DKHNQZCVIZYTPF-UHFFFAOYSA-N -1 0 369.421 1.805 20 10 FDCDRM O=C([O-])[C@H]1CC(C(=O)NCc2ccc(O)cc2O)=NN1c1ccccc1 ZINC001574573740 962064755 /nfs/dbraw/zinc/06/47/55/962064755.db2.gz FNGWOZCBLWEOBE-OAHLLOKOSA-N -1 0 355.350 1.434 20 10 FDCDRM O=C([O-])CN(Cc1cc(Cl)ccc1O)C(=O)[C@@H]1OC[C@@H]2COCC[C@H]12 ZINC001345134595 962240852 /nfs/dbraw/zinc/24/08/52/962240852.db2.gz YEVCTUAIPFELKP-DETPVDSQSA-N -1 0 369.801 1.510 20 10 FDCDRM CCS(=O)(=O)c1ccccc1[N-]S(=O)(=O)c1cccc2nonc21 ZINC000774732816 963499064 /nfs/dbraw/zinc/49/90/64/963499064.db2.gz ZPWJJIMZWHILSA-UHFFFAOYSA-N -1 0 367.408 1.817 20 10 FDCDRM C[C@H](NC(=O)[C@H]1CC(=O)c2oc(=O)c3cc(O)c(O)c([O-])c3c21)C1CC1 ZINC001185552011 963973379 /nfs/dbraw/zinc/97/33/79/963973379.db2.gz ACVHEBOZXFHXMN-XPUUQOCRSA-N -1 0 359.334 1.495 20 10 FDCDRM COc1ccc(N(CC(=O)[O-])CC(=O)N[C@@H]2[C@@H](C)[C@@H](OC)C2(C)C)cc1 ZINC000853006204 967768885 /nfs/dbraw/zinc/76/88/85/967768885.db2.gz CIGSYDOYKRSRSF-NXOUGTEYSA-N -1 0 364.442 1.762 20 10 FDCDRM COc1ccc(N(CC(=O)[O-])CC(=O)NCc2cnccc2OC)cc1 ZINC000853008146 967771002 /nfs/dbraw/zinc/77/10/02/967771002.db2.gz KILRMBLDCWOXPX-UHFFFAOYSA-N -1 0 359.382 1.306 20 10 FDCDRM COc1ccc(N(CC(=O)[O-])CC(=O)NCCc2cnc(C)cn2)cc1 ZINC000853011127 967772149 /nfs/dbraw/zinc/77/21/49/967772149.db2.gz TTWRJTGMVJVITC-UHFFFAOYSA-N -1 0 358.398 1.044 20 10 FDCDRM COc1ccc(N(CC(=O)[O-])CC(=O)NCC2(CF)CCOCC2)cc1 ZINC000853011145 967772424 /nfs/dbraw/zinc/77/24/24/967772424.db2.gz ULWMSDBAWLKPSW-UHFFFAOYSA-N -1 0 368.405 1.469 20 10 FDCDRM CC(=O)c1cc(CN(C)Cc2cn(C)nn2)c([O-])c(CN2CCOCC2)c1 ZINC000853568242 968131570 /nfs/dbraw/zinc/13/15/70/968131570.db2.gz SQNGWEGQWMQKLJ-UHFFFAOYSA-N -1 0 373.457 1.188 20 10 FDCDRM O=[N+]([O-])c1cc2c(cc1S(=O)(=O)[N-]c1ccc(O)cc1)OCCO2 ZINC000776745471 968940282 /nfs/dbraw/zinc/94/02/82/968940282.db2.gz XENUECSHDLMPMX-UHFFFAOYSA-N -1 0 352.324 1.872 20 10 FDCDRM O=C(Nc1cc2c(cc1[O-])C(=O)c1ccccc1C2=O)c1ccn[nH]c1=O ZINC001192396585 969110179 /nfs/dbraw/zinc/11/01/79/969110179.db2.gz NRBIWRVKNKWIJI-UHFFFAOYSA-N -1 0 361.313 1.916 20 10 FDCDRM COC[C@@]1(C(=O)[O-])CN(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CCO1 ZINC001604551371 973572195 /nfs/dbraw/zinc/57/21/95/973572195.db2.gz QIWZZAWVPOEESN-FZKQIMNGSA-N -1 0 365.430 1.325 20 10 FDCDRM C[C@H]1CN(c2ccc(CNC(=O)CCc3nnn[n-]3)cc2F)C[C@H](C)O1 ZINC000864931910 973955571 /nfs/dbraw/zinc/95/55/71/973955571.db2.gz PRZBCKMKRUFTAE-RYUDHWBXSA-N -1 0 362.409 1.201 20 10 FDCDRM COC(=O)CCCS(=O)(=O)[N-]c1sc2c(c1C(N)=O)CC[C@H](C)C2 ZINC001201903570 975194152 /nfs/dbraw/zinc/19/41/52/975194152.db2.gz CLQOQRQYUKBARO-VIFPVBQESA-N -1 0 374.484 1.667 20 10 FDCDRM CN1C(=O)/C(=C\c2cn(CC(=O)[O-])nn2)c2cc(Br)cnc21 ZINC000794956655 976158033 /nfs/dbraw/zinc/15/80/33/976158033.db2.gz JDDLEHWFJFKJAO-KMKOMSMNSA-N -1 0 364.159 1.037 20 10 FDCDRM CC(=O)N1CCN(c2ccc(CNC(=O)CCCCC(=O)[O-])cc2)CC1 ZINC000848447269 976755160 /nfs/dbraw/zinc/75/51/60/976755160.db2.gz NGRPFNWSXODBIS-UHFFFAOYSA-N -1 0 361.442 1.616 20 10 FDCDRM NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)CCCCC(=O)[O-])cc2)C1 ZINC000848447778 976756445 /nfs/dbraw/zinc/75/64/45/976756445.db2.gz GBSBFIWKRINBAN-HNNXBMFYSA-N -1 0 361.442 1.650 20 10 FDCDRM COC(=O)Cc1ccc(S(=O)(=O)Nc2ccc(O)cc2C(=O)[O-])cc1 ZINC000776434797 977469188 /nfs/dbraw/zinc/46/91/88/977469188.db2.gz MUYIGRZQQLVJIP-UHFFFAOYSA-N -1 0 365.363 1.607 20 10 FDCDRM CN(C)c1ccc(CN(C(=O)C(=O)NCC2(C(=O)[O-])CCC2)C2CC2)cc1 ZINC000851686490 978997873 /nfs/dbraw/zinc/99/78/73/978997873.db2.gz BFQFVQCRKQMDPH-UHFFFAOYSA-N -1 0 373.453 1.615 20 10 FDCDRM CSc1[nH]c(=O)c(C(=O)NCc2ccc(O)c(O)c2)cc1-c1nnn[n-]1 ZINC000826229637 980220571 /nfs/dbraw/zinc/22/05/71/980220571.db2.gz LILMNWIXGQSQKK-UHFFFAOYSA-N -1 0 374.382 1.030 20 10 FDCDRM O=C(NCCc1ccc(O)c(O)c1)c1ccc(C[N-]C(=O)C(F)(F)F)o1 ZINC000860234176 983300472 /nfs/dbraw/zinc/30/04/72/983300472.db2.gz BPSKXWHZJKPYNX-UHFFFAOYSA-N -1 0 372.299 1.842 20 10 FDCDRM C[C@@H]1CN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CC[C@@H]1C(=O)[O-] ZINC000861714494 983860262 /nfs/dbraw/zinc/86/02/62/983860262.db2.gz JBFVLNVYKAMICA-CJNGLKHVSA-N -1 0 373.453 1.254 20 10 FDCDRM O=[N+]([O-])c1cc(Cl)cc(CN2CCN(c3nccnn3)CC2)c1[O-] ZINC000862437367 984391076 /nfs/dbraw/zinc/39/10/76/984391076.db2.gz QSNZMZUSLHHUOX-UHFFFAOYSA-N -1 0 350.766 1.461 20 10 FDCDRM CNC(=O)NC[C@H]1CN(Cc2cc(Cl)cc([N+](=O)[O-])c2[O-])CCO1 ZINC000862459183 984395650 /nfs/dbraw/zinc/39/56/50/984395650.db2.gz OJHSRHXAPSSKRG-NSHDSACASA-N -1 0 358.782 1.084 20 10 FDCDRM CCOC(=O)N1CCC(NC(=O)CSc2ncc(C(=O)[O-])s2)CC1 ZINC001596646106 984660013 /nfs/dbraw/zinc/66/00/13/984660013.db2.gz IRYNWAQALSCLMN-UHFFFAOYSA-N -1 0 373.456 1.671 20 10 FDCDRM C/C(=C/CNC(=O)NCc1ccc(N2CCOCC2)c(F)c1)C(=O)[O-] ZINC001588973794 984808025 /nfs/dbraw/zinc/80/80/25/984808025.db2.gz NKJOGSKVCNDORG-QCDXTXTGSA-N -1 0 351.378 1.492 20 10 FDCDRM O=S(=O)(NCc1ccc(N2CCC(O)CC2)cc1)c1ccns1 ZINC000885309811 985321557 /nfs/dbraw/zinc/32/15/57/985321557.db2.gz WLPXJIHBRXCGCB-UHFFFAOYSA-N -1 0 353.469 1.583 20 10 FDCDRM O=S(=O)([N-]c1ccccc1CN1CCOCC1)c1cccc2nonc21 ZINC000886420917 986196838 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357.457 1.438 20 10 FDCDRM COc1ccc(N(CC(=O)[O-])CC(=O)NC[C@@]2(C)CCCS2)cc1 ZINC000853006304 967770091 /nfs/dbraw/zinc/77/00/91/967770091.db2.gz RMCWYQGHRHNHSD-QGZVFWFLSA-N -1 0 352.456 1.988 20 10 FDCDRM C[C@@H]1CN(Cc2cc(=O)n3ncc(C(=O)[O-])c3[nH]2)C[C@@](C)(C(F)F)O1 ZINC000853085013 967819831 /nfs/dbraw/zinc/81/98/31/967819831.db2.gz QYYNCYICYGBWLW-GLEZIHRCSA-N -1 0 356.329 1.378 20 10 FDCDRM CCOC(=O)C(=CNC(=O)c1cc(O)c([O-])c(Cl)c1)C(=O)OCC ZINC001193625911 969773735 /nfs/dbraw/zinc/77/37/35/969773735.db2.gz OWELSTGFMAGTJC-UHFFFAOYSA-N -1 0 357.746 1.491 20 10 FDCDRM CC(C)Oc1cc(O)ccc1[N-]S(=O)(=O)c1nn(C)cc1[N+](=O)[O-] ZINC000863408231 972878809 /nfs/dbraw/zinc/87/88/09/972878809.db2.gz KOQHTOYMPBCVQB-UHFFFAOYSA-N -1 0 356.360 1.622 20 10 FDCDRM COc1ccc(N2CC[C@H](CNC(=O)[C@@H]3C[C@H](C)[C@@H](C(=O)[O-])O3)C2)cc1 ZINC000864149337 973392108 /nfs/dbraw/zinc/39/21/08/973392108.db2.gz LALOZZVKJNLTRV-RMHZUWNSSA-N -1 0 362.426 1.516 20 10 FDCDRM CCCN(Cc1ccccc1O)C(=O)C(=O)NC[C@@H](C(=O)[O-])C(C)C ZINC000848610142 976954733 /nfs/dbraw/zinc/95/47/33/976954733.db2.gz RGJLRTXGBQCCDK-CQSZACIVSA-N -1 0 350.415 1.604 20 10 FDCDRM C[C@@H]1CN(C(=O)C(=O)NCc2ccc3c(c2)CCCN3C)CC[C@H]1C(=O)[O-] ZINC000861714496 983860047 /nfs/dbraw/zinc/86/00/47/983860047.db2.gz JBFVLNVYKAMICA-CZUORRHYSA-N -1 0 373.453 1.254 20 10 FDCDRM C[C@H]1CN(C(=O)C(=O)NCCCSc2nccs2)CC[C@H]1C(=O)[O-] ZINC000861719803 983870827 /nfs/dbraw/zinc/87/08/27/983870827.db2.gz OPXBOGAFDFDIQF-WDEREUQCSA-N -1 0 371.484 1.311 20 10 FDCDRM C[C@]12CN(c3ccc(/C=C/C(=O)[O-])cc3[N+](=O)[O-])C[C@H]1CS(=O)(=O)C2 ZINC001599939538 985437856 /nfs/dbraw/zinc/43/78/56/985437856.db2.gz RUMODPNPQBSTAC-KHTIXYADSA-N -1 0 366.395 1.564 20 10 FDCDRM CCc1nn(C)cc1S(=O)(=O)[N-]c1nc(-c2cnn(C)c2)cs1 ZINC000886395941 986151526 /nfs/dbraw/zinc/15/15/26/986151526.db2.gz TUABPNYIZATNBP-UHFFFAOYSA-N -1 0 352.445 1.640 20 10 FDCDRM C[C@H](C(=O)N(CC(=O)[O-])Cc1cc(Cl)ccc1O)c1cnn(C)c1 ZINC001589341670 986254706 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COc1ccc(N(CC(=O)[O-])CC(=O)NCCOC2CCCC2)cc1 ZINC000872946714 988321724 /nfs/dbraw/zinc/32/17/24/988321724.db2.gz COPPABNWUNRGFY-UHFFFAOYSA-N -1 0 350.415 1.662 20 10 FDCDRM COc1ccc(N(CC(=O)[O-])CC(=O)N[C@@H](C)[C@@H](OC)C2CC2)cc1 ZINC000872985785 988379548 /nfs/dbraw/zinc/37/95/48/988379548.db2.gz GGCAOJKYWBLQGQ-KPZWWZAWSA-N -1 0 350.415 1.516 20 10 FDCDRM CN(C)c1ccc(CNC(=O)CN(CCC(F)(F)F)CC(=O)[O-])cc1 ZINC001598317579 991305511 /nfs/dbraw/zinc/30/55/11/991305511.db2.gz IWOHSNWGFFHJCG-UHFFFAOYSA-N -1 0 361.364 1.708 20 10 FDCDRM CN(C)c1ccc(CNC(=O)N2CCSC[C@H](C(=O)[O-])C2)cc1F ZINC001598318006 991310716 /nfs/dbraw/zinc/31/07/16/991310716.db2.gz QADWUDKYKDFKOZ-GFCCVEGCSA-N -1 0 355.435 1.851 20 10 FDCDRM CN(C)c1ccc(CNS(=O)(=O)c2ccc(C(=O)[O-])nc2)cc1F ZINC001598320642 991317581 /nfs/dbraw/zinc/31/75/81/991317581.db2.gz KIPQBFFMAYIONG-UHFFFAOYSA-N -1 0 353.375 1.463 20 10 FDCDRM CN(Cc1ccc(S(N)(=O)=O)s1)c1ccc(OCC(=O)[O-])cc1 ZINC001598525692 992717406 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COc1cccc(CNS(=O)(=O)c2cc(C(=O)[O-])ccc2C)c1O ZINC001599674176 994867517 /nfs/dbraw/zinc/86/75/17/994867517.db2.gz LBQKIFTUQXAKTK-UHFFFAOYSA-N -1 0 351.380 1.886 20 10 FDCDRM COC(=O)[C@@H]1CCN(Cc2cc(F)c(N(C)C)cc2F)[C@@H](C(=O)[O-])C1 ZINC001598801746 996144239 /nfs/dbraw/zinc/14/42/39/996144239.db2.gz UKHPVZFVUINAAK-MEBBXXQBSA-N -1 0 356.369 1.869 20 10 FDCDRM COCc1cc(NC(=O)C(=O)N(C)Cc2ccccc2O)cc(C(=O)[O-])c1 ZINC001599282907 996922296 /nfs/dbraw/zinc/92/22/96/996922296.db2.gz KGTRIHTVCDIMLE-UHFFFAOYSA-N -1 0 372.377 1.834 20 10 FDCDRM COC(=O)c1cc(C(=O)[O-])cc(S(=O)(=O)NCc2ccccc2O)c1 ZINC001598924079 997622541 /nfs/dbraw/zinc/62/25/41/997622541.db2.gz VFCKBTLIGJBZMK-UHFFFAOYSA-N -1 0 365.363 1.356 20 10 FDCDRM COc1cc(NC(=O)C(=O)N(C)Cc2ccccc2O)ccc1C(=O)[O-] ZINC001599429000 997726084 /nfs/dbraw/zinc/72/60/84/997726084.db2.gz SONWNSFBVIETIA-UHFFFAOYSA-N -1 0 358.350 1.696 20 10 FDCDRM COc1cccc(CNC(=O)C(=O)Nc2ccc(C(=O)[O-])c(OC)c2)c1O ZINC001599429090 997727291 /nfs/dbraw/zinc/72/72/91/997727291.db2.gz HVFJNDSWPHOTHR-UHFFFAOYSA-N -1 0 374.349 1.363 20 10 FDCDRM C[C@@H](CCO)NC(=O)c1cc([N-]S(=O)(=O)c2cccs2)ccc1O ZINC000269732489 537021815 /nfs/dbraw/zinc/02/18/15/537021815.db2.gz WMCVVTFPZMZHOE-JTQLQIEISA-N -1 0 370.452 1.755 20 10 FDCDRM COc1ccc(N2CCC(N(C)C(=O)c3cnc([O-])n(C)c3=O)CC2)cc1 ZINC000378058309 538063440 /nfs/dbraw/zinc/06/34/40/538063440.db2.gz LTMQORJBBXQKGH-UHFFFAOYSA-N -1 0 372.425 1.236 20 10 FDCDRM O=C([O-])CSCCNC(=O)NCc1ccc(N2CCOCC2)c(F)c1 ZINC000739859590 599898479 /nfs/dbraw/zinc/89/84/79/599898479.db2.gz AKMDPGFCMPIISI-UHFFFAOYSA-N -1 0 371.434 1.279 20 10 FDCDRM CC[C@@H](C)[C@@H](NC(=O)CN1CCN(c2ccc(OC)cc2)CC1)C(=O)[O-] ZINC000736874492 600011988 /nfs/dbraw/zinc/01/19/88/600011988.db2.gz AEAKJRGOYQYNFU-RDTXWAMCSA-N -1 0 363.458 1.433 20 10 FDCDRM COCCc1noc(CN(CC(=O)[O-])Cc2cc(Cl)ccc2O)n1 ZINC000737824478 600144187 /nfs/dbraw/zinc/14/41/87/600144187.db2.gz WSJKEOQPCPLFHY-UHFFFAOYSA-N -1 0 355.778 1.704 20 10 FDCDRM CC[C@@H]1CN(c2ccc(/C=C/C(=O)[O-])cc2[N+](=O)[O-])CC[N@@H+]1C[C@@H](C)O ZINC000736942872 600213733 /nfs/dbraw/zinc/21/37/33/600213733.db2.gz FSVNZNXIIZJDPO-RLWBPUTGSA-N -1 0 363.414 1.974 20 10 FDCDRM COc1cccc(CNC(=O)C(=O)Nc2cccc(C(=O)[O-])c2C)c1O ZINC000738096244 600347722 /nfs/dbraw/zinc/34/77/22/600347722.db2.gz COJZIPMJJNCFNY-UHFFFAOYSA-N -1 0 358.350 1.662 20 10 FDCDRM COc1cccc(CNC(=O)C(=O)Nc2ccc(OCC(=O)[O-])cc2)c1O ZINC000738097756 600347961 /nfs/dbraw/zinc/34/79/61/600347961.db2.gz RBWQORPOAGVORU-UHFFFAOYSA-N -1 0 374.349 1.119 20 10 FDCDRM COc1ccc(O)c(CNC(=O)NCCOc2ccc(C(=O)[O-])cc2)c1 ZINC000738044825 600457697 /nfs/dbraw/zinc/45/76/97/600457697.db2.gz SXTYSLFMNQIKAF-UHFFFAOYSA-N -1 0 360.366 1.977 20 10 FDCDRM C[C@@H](NS(=O)(=O)CCCC(=O)[O-])c1ccc(N2CCOCC2)cc1 ZINC000736663959 600495777 /nfs/dbraw/zinc/49/57/77/600495777.db2.gz KCONWJGBHUUTGS-CYBMUJFWSA-N -1 0 356.444 1.368 20 10 FDCDRM O=C([O-])[C@H]1CCCN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 ZINC000739572262 600727341 /nfs/dbraw/zinc/72/73/41/600727341.db2.gz LBWBMEMJRVRAGH-AWEZNQCLSA-N -1 0 365.405 1.669 20 10 FDCDRM Cn1nc2c(cc1=O)CN(c1ccc(/C=C/C(=O)[O-])cc1[N+](=O)[O-])CC2 ZINC000833062454 600827193 /nfs/dbraw/zinc/82/71/93/600827193.db2.gz PXPYMRRFRAHCCN-HWKANZROSA-N -1 0 356.338 1.349 20 10 FDCDRM COc1cccc(CNC(=O)C(=O)Nc2ccc(C)c(C(=O)[O-])c2)c1O ZINC000832554292 601167233 /nfs/dbraw/zinc/16/72/33/601167233.db2.gz OFKKSCQXANGNTE-UHFFFAOYSA-N -1 0 358.350 1.662 20 10 FDCDRM Cc1cc(C(=O)CN2CCO[C@H](CO)C2)c(C)n1-c1ccc(C(=O)[O-])cc1 ZINC000832860127 601427239 /nfs/dbraw/zinc/42/72/39/601427239.db2.gz ZASWEJQDZMRKPO-KRWDZBQOSA-N -1 0 372.421 1.668 20 10 FDCDRM COc1ccc(N2CCCN(S(=O)(=O)C[C@H](C)C(=O)[O-])CC2)cc1 ZINC000832383318 601780257 /nfs/dbraw/zinc/78/02/57/601780257.db2.gz FJNGHMUZIOYDRI-ZDUSSCGKSA-N -1 0 356.444 1.258 20 10 FDCDRM CCC[C@@H](NC(=O)[O-])C(=O)NCc1ccc(N2CCOCC2)c(F)c1 ZINC000739315012 601870981 /nfs/dbraw/zinc/87/09/81/601870981.db2.gz IKIKYVVMICFMSG-CQSZACIVSA-N -1 0 353.394 1.715 20 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603938254 /nfs/dbraw/zinc/93/82/54/603938254.db2.gz YMCDVCYFIPVQSR-QWHCGFSZSA-N -1 0 365.405 1.919 20 10 FDCDRM COc1cccc(CNC(=O)N[C@@H](C)[C@H]2CCCN(C(=O)[O-])C2)c1O ZINC000829560441 604100777 /nfs/dbraw/zinc/10/07/77/604100777.db2.gz RKWDXCWSJVIAGJ-AAEUAGOBSA-N -1 0 351.403 1.979 20 10 FDCDRM CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2nc(CC(=O)[O-])cs2)c1 ZINC000832699349 604667101 /nfs/dbraw/zinc/66/71/01/604667101.db2.gz GJVSUFLOGUGALF-UHFFFAOYSA-N -1 0 371.396 1.100 20 10 FDCDRM CN(c1cc2c(cc1[N+](=O)[O-])OCC(=O)N2)C1CCC(NC(=O)[O-])CC1 ZINC000828434999 604830908 /nfs/dbraw/zinc/83/09/08/604830908.db2.gz UKOZUKIFMNYAFZ-UHFFFAOYSA-N -1 0 364.358 1.941 20 10 FDCDRM COc1ccc(O)c(CNS(=O)(=O)c2ccc(C(=O)[O-])c(C)c2)c1 ZINC000833734023 605036469 /nfs/dbraw/zinc/03/64/69/605036469.db2.gz ZPBGGTQMVAAERM-UHFFFAOYSA-N -1 0 351.380 1.886 20 10 FDCDRM C[C@H](C(=O)N1CCC(C(=O)[O-])CC1)N1CCOc2cc(N(C)C)ccc21 ZINC000833403989 605055583 /nfs/dbraw/zinc/05/55/83/605055583.db2.gz MIGNESWNCOXUKI-CYBMUJFWSA-N -1 0 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