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NS(=O)(=O)c1cccc([N-]S(=O)(=O)c2cccc(CC(=O)[O-])c2)c1 ZINC000562226712 491661129 /nfs/dbraw/zinc/66/11/29/491661129.db2.gz BTMBMLLAAGUCLU-UHFFFAOYSA-N -2 1 370.408 0.762 20 0 FCADML COC(=O)c1oc(S(=O)(=O)[N-][C@@H](Cc2ccncc2)C(=O)[O-])cc1C ZINC000596024883 491972172 /nfs/dbraw/zinc/97/21/72/491972172.db2.gz WHIYUGLCSRNFIP-NSHDSACASA-N -2 1 368.367 0.744 20 0 FCADML Cc1cc(C(=O)N2C[C@@H]3CCC[C@H]3[C@@H]2C(N)=O)[n-]c2nc(=O)[n-]c(=O)c1-2 ZINC000613872124 492003042 /nfs/dbraw/zinc/00/30/42/492003042.db2.gz NEEPZFZEPIQFSN-YGOYTEALSA-N -2 1 357.370 0.470 20 0 FCADML COC(=O)CC[C@H]([N-]S(=O)(=O)c1c(F)cc(OC)cc1F)C(=O)[O-] ZINC000614337933 492024599 /nfs/dbraw/zinc/02/45/99/492024599.db2.gz SFWUEYLBOCMUDE-JTQLQIEISA-N -2 1 367.326 0.658 20 0 FCADML NS(=O)(=O)c1ccccc1S(=O)(=O)[N-]c1cc(C(=O)[O-])ccc1F ZINC000607613368 492147895 /nfs/dbraw/zinc/14/78/95/492147895.db2.gz KJUBMEYKBJZECG-UHFFFAOYSA-N -2 1 374.371 0.972 20 0 FCADML Cc1cc(C(=O)NCCN2C[C@H](C)OC[C@H]2C)[n-]c2nc(=O)[n-]c(=O)c1-2 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1 369.370 0.643 20 0 FCADML O=S(=O)([N-]c1cnccc1-n1cccn1)c1ccc(-c2nn[n-]n2)nc1 ZINC000738340493 598417258 /nfs/dbraw/zinc/41/72/58/598417258.db2.gz VSUIYYQSJRSOEM-UHFFFAOYSA-N -2 1 369.370 0.643 20 0 FCADML O=C([O-])[C@H]1C[C@H]1C(=O)OCC(=O)[N-]C(=O)c1ccc(OC(F)F)cc1 ZINC000739320681 599702469 /nfs/dbraw/zinc/70/24/69/599702469.db2.gz NNHBOCJIDXJSCD-VHSXEESVSA-N -2 1 357.265 0.808 20 0 FCADML O=C([O-])NCCC(=O)Nc1cc(S(=O)(=O)N2CCCC2)ccc1[O-] ZINC000739947787 599783892 /nfs/dbraw/zinc/78/38/92/599783892.db2.gz LBLBYDGKSVNXCU-UHFFFAOYSA-N -2 1 357.388 0.773 20 0 FCADML COc1ccc(C(=O)[N-]C(=O)COC(=O)CCCN(C)C(=O)[O-])cc1 ZINC000737923231 599875514 /nfs/dbraw/zinc/87/55/14/599875514.db2.gz VXCOTOBXMCGWMR-UHFFFAOYSA-N -2 1 352.343 0.885 20 0 FCADML CC[C@@H]1C(=O)NCCN1C(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1 ZINC000736942002 600075440 /nfs/dbraw/zinc/07/54/40/600075440.db2.gz RQVCCKJSHMCTDQ-CQSZACIVSA-N -2 1 372.381 0.143 20 0 FCADML CN1C[C@H](NC(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)CCC1=O 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XOKKGCTWWMOPKS-JTQLQIEISA-N -2 1 355.416 0.847 20 0 FCADML Cc1nc(-c2cccnc2)[n-]c(=O)c1CC(=O)N1CCO[C@H](CC(=O)[O-])C1 ZINC000832992254 601738673 /nfs/dbraw/zinc/73/86/73/601738673.db2.gz FFFQXFHLMKMFLE-CYBMUJFWSA-N -2 1 372.381 0.797 20 0 FCADML Cc1nc(-c2ccncc2)[n-]c(=O)c1CC(=O)N1CCO[C@H](CC(=O)[O-])C1 ZINC000832993340 601741108 /nfs/dbraw/zinc/74/11/08/601741108.db2.gz TZBPISBOZQNGJV-CYBMUJFWSA-N -2 1 372.381 0.385 20 0 FCADML O=C([O-])CS(=O)(=O)Cc1ccc(CNC(=O)c2ncccc2[O-])cc1 ZINC000833263889 602051314 /nfs/dbraw/zinc/05/13/14/602051314.db2.gz XNRHSMNZLDGIHW-UHFFFAOYSA-N -2 1 364.379 0.717 20 0 FCADML O=S(=O)([N-]c1ncc(-c2nn[n-]n2)s1)c1cnn([C@@H]2CCOC2)c1 ZINC000826493017 607694369 /nfs/dbraw/zinc/69/43/69/607694369.db2.gz PAXDSRQHOPNDAO-SSDOTTSWSA-N -2 1 368.404 0.282 20 0 FCADML CC(=O)c1[nH]c(CC(=O)N2CCC[C@H](c3nn[n-]n3)C2)c(C(=O)[O-])c1C ZINC000833399653 605141850 /nfs/dbraw/zinc/14/18/50/605141850.db2.gz ADNKJUHAQXFJGO-JTQLQIEISA-N -2 1 360.374 0.686 20 0 FCADML COc1ccc(S(=O)(=O)[N-]c2nn(C)cc2-c2nn[n-]n2)cc1OC ZINC000821845079 606709622 /nfs/dbraw/zinc/70/96/22/606709622.db2.gz AFJFNPUTHJLVDQ-UHFFFAOYSA-N -2 1 365.375 0.418 20 0 FCADML Cn1cc(-c2nn[n-]n2)c([N-]S(=O)(=O)c2ccc(CC(=O)[O-])cc2)n1 ZINC000822623170 606710216 /nfs/dbraw/zinc/71/02/16/606710216.db2.gz PPJSOLPSQWIVGG-UHFFFAOYSA-N -3 1 363.359 0.028 20 0 FCADML CCc1nn(C)c(CC)c1S(=O)(=O)[N-]c1nn(C)cc1-c1nnn[n-]1 ZINC000825759955 608266916 /nfs/dbraw/zinc/26/69/16/608266916.db2.gz QGRFJLRTXUEGEA-UHFFFAOYSA-N -2 1 365.423 0.259 20 0 FCADML CCc1nn(C)c(CC)c1S(=O)(=O)[N-]c1nn(C)cc1-c1nn[n-]n1 ZINC000825759955 608266918 /nfs/dbraw/zinc/26/69/18/608266918.db2.gz QGRFJLRTXUEGEA-UHFFFAOYSA-N -2 1 365.423 0.259 20 0 FCADML O=S(=O)([N-]c1n[nH]cc1-c1nn[n-]n1)c1c(Cl)nc2ccccn21 ZINC000826492534 608306174 /nfs/dbraw/zinc/30/61/74/608306174.db2.gz PMCGVMNLUYHSIL-UHFFFAOYSA-N -2 1 365.766 0.692 20 0 FCADML COc1cc(F)c(S(=O)(=O)[N-]c2n[nH]cc2-c2nn[n-]n2)c(F)c1 ZINC000826180186 608307290 /nfs/dbraw/zinc/30/72/90/608307290.db2.gz WCZGIPUHQZKIDP-UHFFFAOYSA-N -2 1 357.302 0.677 20 0 FCADML CC[C@@H](C)N(CC(=O)[O-])S(=O)(=O)c1ccc(F)cc1-c1nn[n-]n1 ZINC000825066370 608473145 /nfs/dbraw/zinc/47/31/45/608473145.db2.gz CELNFNMXTLOYMH-MRVPVSSYSA-N -2 1 357.367 0.880 20 0 FCADML CC[C@@H](C)N(CC(=O)[O-])S(=O)(=O)c1cccc(F)c1-c1nnn[n-]1 ZINC000825068646 608473316 /nfs/dbraw/zinc/47/33/16/608473316.db2.gz UVYTVGMYDGFQIL-MRVPVSSYSA-N -2 1 357.367 0.880 20 0 FCADML CC[C@@H](C)N(CC(=O)[O-])S(=O)(=O)c1cccc(F)c1-c1nn[n-]n1 ZINC000825068646 608473318 /nfs/dbraw/zinc/47/33/18/608473318.db2.gz UVYTVGMYDGFQIL-MRVPVSSYSA-N -2 1 357.367 0.880 20 0 FCADML O=C([O-])c1cc(F)c(F)c(S(=O)(=O)[N-]C[C@@H]2CCS(=O)(=O)C2)c1 ZINC000322359050 665818332 /nfs/dbraw/zinc/81/83/32/665818332.db2.gz AXGVJNHYXQXCEU-ZETCQYMHSA-N -2 1 369.367 0.376 20 0 FCADML CC(C)C(=O)[N-][N-]S(=O)(=O)c1cccc(C(=O)NCC(F)(F)F)c1 ZINC000055564849 666543488 /nfs/dbraw/zinc/54/34/88/666543488.db2.gz YZAUFHGOEKISDY-UHFFFAOYSA-N -2 1 367.349 0.944 20 0 FCADML C[C@@H](CN(C)C(=O)c1ccc2c(c1)[n-]c(=S)n(C)c2=O)c1nn[n-]n1 ZINC000758798412 667784741 /nfs/dbraw/zinc/78/47/41/667784741.db2.gz WKQJVPHJFIHONW-QMMMGPOBSA-N -2 1 359.415 0.611 20 0 FCADML COC(=O)c1coc(S(=O)(=O)[N-][C@@H](C(=O)[O-])[C@H](O)c2ccccc2)c1 ZINC000776601412 668277015 /nfs/dbraw/zinc/27/70/15/668277015.db2.gz LVJCLXGFZDVXTN-CHWSQXEVSA-N -2 1 369.351 0.531 20 0 FCADML COC[C@@H]([N-]S(=O)(=O)c1cc(Br)cnc1Cl)C(=O)[O-] ZINC000776625922 668279940 /nfs/dbraw/zinc/27/99/40/668279940.db2.gz JONJIOAMJABYBN-ZCFIWIBFSA-N -2 1 373.612 0.875 20 0 FCADML O=C([O-])[C@@H]1[C@H]([N-]C(=O)C(F)(F)F)CCCN1C(=O)N1CCSCC1 ZINC000849231344 671323196 /nfs/dbraw/zinc/32/31/96/671323196.db2.gz BXNOAKDMQYILMJ-BDAKNGLRSA-N -2 1 369.365 0.751 20 0 FCADML COCCOCCC(=O)N1CCC[C@H]([N-]C(=O)C(F)(F)F)[C@@H]1C(=O)[O-] ZINC000851702204 671461157 /nfs/dbraw/zinc/46/11/57/671461157.db2.gz KQTAAQHFBHEJAT-GXSJLCMTSA-N -2 1 370.324 0.162 20 0 FCADML 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