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/nfs/dbraw/zinc/36/78/05/582367805.db2.gz NQZINBSREZSPJA-UHFFFAOYSA-N -1 3 250.320 -0.010 20 30 CBEDHM Cc1nn(-c2ccncc2)cc1C=NNC1=NC(=O)C(=O)[N-]1 ZINC000783864664 582373086 /nfs/dbraw/zinc/37/30/86/582373086.db2.gz SUZMRQNQCNUURY-UHFFFAOYSA-N -1 3 297.278 -0.488 20 30 CBEDHM C[C@H](OC(=O)c1ccc(C#N)[n-]1)C(=O)N1CCNC1=O ZINC000786071778 582377762 /nfs/dbraw/zinc/37/77/62/582377762.db2.gz SHFYBEZYSVDZIZ-ZETCQYMHSA-N -1 3 276.252 -0.017 20 30 CBEDHM Cn1c(COC(=O)c2ccc(C#N)[n-]2)cc(=O)n(C)c1=O ZINC000786091908 582377903 /nfs/dbraw/zinc/37/79/03/582377903.db2.gz KSJODYJEJKJZBG-UHFFFAOYSA-N -1 3 288.263 -0.359 20 30 CBEDHM CN(CCC#N)S(=O)(=O)[N-]CC1OCCCO1 ZINC000788416134 582386009 /nfs/dbraw/zinc/38/60/09/582386009.db2.gz LFLZEEGKBLLAOS-UHFFFAOYSA-N -1 3 263.319 -0.571 20 30 CBEDHM CC(C)(C)n1cc(C=NN2CC(=O)[N-]C2=O)nn1 ZINC000790153733 582390359 /nfs/dbraw/zinc/39/03/59/582390359.db2.gz LQNIMTJQKDATPK-UHFFFAOYSA-N -1 3 250.262 -0.081 20 30 CBEDHM COC(=O)c1cc(C=NN2CC(=O)[N-]C2=O)cn1C 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251.246 -0.278 20 30 CBEDHM CN(C(=O)COC(=O)c1c[n-]nn1)C(C)(C)C#N ZINC000805608032 582434729 /nfs/dbraw/zinc/43/47/29/582434729.db2.gz WODYTZWGZMOKTA-UHFFFAOYSA-N -1 3 251.246 -0.278 20 30 CBEDHM C#CCCS(=O)(=O)[N-][C@@]1(CC(=O)OC)CCOC1 ZINC000808307540 582442896 /nfs/dbraw/zinc/44/28/96/582442896.db2.gz WSQKLACVOUZGMJ-LLVKDONJSA-N -1 3 275.326 -0.349 20 30 CBEDHM C#CCCS(=O)(=O)[N-]C(=O)C1CCCCS1(=O)=O ZINC000810784320 582449583 /nfs/dbraw/zinc/44/95/83/582449583.db2.gz ABDAXDODRQXAKR-VIFPVBQESA-N -1 3 293.366 -0.577 20 30 CBEDHM C#CCO[N-]C(=O)Cc1ccc(-n2cnnn2)cc1 ZINC000812783807 582452869 /nfs/dbraw/zinc/45/28/69/582452869.db2.gz HCOVNMPFWZNRPZ-UHFFFAOYSA-N -1 3 257.253 -0.114 20 30 CBEDHM Cn1cc(C=NNc2nc3c(cnn3C)c(=O)[nH]2)c(=O)[n-]1 ZINC000814223497 582456022 /nfs/dbraw/zinc/45/60/22/582456022.db2.gz VWNKNNGZSTZXLA-UHFFFAOYSA-N -1 3 288.271 -0.046 20 30 CBEDHM Cn1cc(C=NN[C@@H]2CCS(=O)(=O)C2)c(=O)[n-]1 ZINC000814211981 582456083 /nfs/dbraw/zinc/45/60/83/582456083.db2.gz AEPCEEDZEQBBKW-MRVPVSSYSA-N -1 3 258.303 -0.764 20 30 CBEDHM Cn1cc(C=NNc2ccc(S(N)(=O)=O)cn2)c(=O)[n-]1 ZINC000814217807 582456106 /nfs/dbraw/zinc/45/61/06/582456106.db2.gz OBHQTJGGTGFMOO-UHFFFAOYSA-N -1 3 296.312 -0.386 20 30 CBEDHM Cn1cc(C=[NH+][N-]c2ccc(S(N)(=O)=O)cn2)c(=O)[n-]1 ZINC000814217807 582456107 /nfs/dbraw/zinc/45/61/07/582456107.db2.gz OBHQTJGGTGFMOO-UHFFFAOYSA-N -1 3 296.312 -0.386 20 30 CBEDHM COC(=O)c1cc(C(=O)OCC(=O)NCC#N)c[n-]1 ZINC000814532715 582456930 /nfs/dbraw/zinc/45/69/30/582456930.db2.gz ARLVRQTXHPYLPW-UHFFFAOYSA-N -1 3 265.225 -0.402 20 30 CBEDHM COC(=O)c1cc(C(=O)OCC(=O)NCCC#N)c[n-]1 ZINC000814532452 582456971 /nfs/dbraw/zinc/45/69/71/582456971.db2.gz SVENRKWRNYLGRK-UHFFFAOYSA-N -1 3 279.252 -0.012 20 30 CBEDHM CC(=NNC1=NC(=O)C(=O)[N-]1)c1cccc(-n2cnnc2)c1 ZINC000814889703 582459072 /nfs/dbraw/zinc/45/90/72/582459072.db2.gz MSMODVLPCLXICR-UHFFFAOYSA-N -1 3 297.278 -0.407 20 30 CBEDHM COc1ccc(F)c(C=NNC2=NC(=O)C(=O)[N-]2)c1 ZINC000814890595 582459203 /nfs/dbraw/zinc/45/92/03/582459203.db2.gz YOBAPVKQZBETNJ-UHFFFAOYSA-N -1 3 264.216 -0.230 20 30 CBEDHM CC(=O)Nc1nc(C(=O)N[C@@H]2CCN([O-])C2=O)cs1 ZINC000816690272 582479546 /nfs/dbraw/zinc/47/95/46/582479546.db2.gz MVKOUFWVCRZTIQ-ZCFIWIBFSA-N -1 3 284.297 -0.179 20 30 CBEDHM O=C(N[C@@H]1CCN([O-])C1=O)c1nccn2ccnc12 ZINC000816690163 582479603 /nfs/dbraw/zinc/47/96/03/582479603.db2.gz JXEYKOWSRLAXCT-SSDOTTSWSA-N -1 3 261.241 -0.551 20 30 CBEDHM CC(C)[C@@H](C(=O)N[C@H]1CCN([O-])C1=O)N1CCCC1=O ZINC000816691123 582479838 /nfs/dbraw/zinc/47/98/38/582479838.db2.gz LKWOOOIPSRCHLR-ONGXEEELSA-N -1 3 283.328 -0.260 20 30 CBEDHM Cn1ncc(C(=O)N[C@@H]2CCN([O-])C2=O)c1-n1cccc1 ZINC000816691698 582479897 /nfs/dbraw/zinc/47/98/97/582479897.db2.gz XCXUUEJVEMPWLD-SNVBAGLBSA-N -1 3 289.295 -0.069 20 30 CBEDHM CCOC(=O)N1CCC[C@H](C(=O)N[C@H]2CCN([O-])C2=O)C1 ZINC000816693071 582480127 /nfs/dbraw/zinc/48/01/27/582480127.db2.gz BMJBSZPQWBMNKO-UWVGGRQHSA-N -1 3 299.327 -0.039 20 30 CBEDHM CC(C)(C)n1cc(C(=O)C(=O)N[C@H]2CCN([O-])C2=O)cn1 ZINC000816693197 582480209 /nfs/dbraw/zinc/48/02/09/582480209.db2.gz FDNXDEHDDKTYMB-VIFPVBQESA-N -1 3 294.311 -0.073 20 30 CBEDHM O=C(CNC(=O)c1cccc(F)c1)N[C@H]1CCN([O-])C1=O ZINC000816693106 582480212 /nfs/dbraw/zinc/48/02/12/582480212.db2.gz CAFKKUCEJKEGGA-JTQLQIEISA-N -1 3 295.270 -0.338 20 30 CBEDHM CNC(=O)c1ccc(C(=O)N[C@@H]2CCN([O-])C2=O)cn1 ZINC000816694084 582480252 /nfs/dbraw/zinc/48/02/52/582480252.db2.gz YFXRTGRCFDFDAJ-SECBINFHSA-N -1 3 278.268 -0.839 20 30 CBEDHM C[C@@H](NC(=O)C(C)(C)C)C(=O)N[C@@H]1CCN([O-])C1=O ZINC000816695080 582480529 /nfs/dbraw/zinc/48/05/29/582480529.db2.gz VBEAPFDRCIIUCH-HTQZYQBOSA-N -1 3 271.317 -0.357 20 30 CBEDHM CC(C)(C)S(=O)(=O)CC(=O)N[C@@H]1CCN([O-])C1=O ZINC000816694668 582480572 /nfs/dbraw/zinc/48/05/72/582480572.db2.gz KWGLHHQDZSLVAO-SSDOTTSWSA-N -1 3 278.330 -0.694 20 30 CBEDHM C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H]1CCN([O-])C1=O ZINC000816695081 582480630 /nfs/dbraw/zinc/48/06/30/582480630.db2.gz 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