smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Nc1nc2c(ncn2[C@H]2O[C@@H](CO[P@](=O)([O-])O)[C@@H](O)[C@H]2O)c(=S)[nH]1 ZINC000005743116 204150763 /nfs/dbraw/zinc/15/07/63/204150763.db2.gz BPZXYEUJBFHASJ-PXMDKTAGSA-N -1 2 379.291 -1.574 40 0 GAABLM Nc1nc2c(ncn2[C@H]2O[C@@H](CO[P@@](=O)([O-])O)[C@@H](O)[C@H]2O)c(=S)[nH]1 ZINC000005743116 204150760 /nfs/dbraw/zinc/15/07/60/204150760.db2.gz BPZXYEUJBFHASJ-PXMDKTAGSA-N -1 2 379.291 -1.574 40 0 GAABLM Nc1nc2c(ncn2[C@@H]2O[C@@H](CO[P@](=O)([O-])O)[C@@H](O)[C@H]2O)c(=S)[nH]1 ZINC000005743117 530072284 /nfs/dbraw/zinc/07/22/84/530072284.db2.gz BPZXYEUJBFHASJ-HAVMAKPUSA-N -1 2 379.291 -1.574 40 0 GAABLM Nc1nc2c(ncn2[C@@H]2O[C@@H](CO[P@@](=O)([O-])O)[C@@H](O)[C@H]2O)c(=S)[nH]1 ZINC000005743117 530072283 /nfs/dbraw/zinc/07/22/83/530072283.db2.gz BPZXYEUJBFHASJ-HAVMAKPUSA-N -1 2 379.291 -1.574 40 0 GAABLM Nc1nc2c(ncn2[C@H]2O[C@@H](CO[P@](=O)([O-])O)[C@@H](O)[C@@H]2O)c(=S)[nH]1 ZINC000005743118 530072322 /nfs/dbraw/zinc/07/23/22/530072322.db2.gz BPZXYEUJBFHASJ-HFXAWCPLSA-N -1 2 379.291 -1.574 40 0 GAABLM Nc1nc2c(ncn2[C@H]2O[C@@H](CO[P@@](=O)([O-])O)[C@@H](O)[C@@H]2O)c(=S)[nH]1 ZINC000005743118 530072320 /nfs/dbraw/zinc/07/23/20/530072320.db2.gz BPZXYEUJBFHASJ-HFXAWCPLSA-N -1 2 379.291 -1.574 40 0 GAABLM Nc1nc2c(ncn2[C@@H]2O[C@@H](CO[P@](=O)([O-])O)[C@@H](O)[C@@H]2O)c(=S)[nH]1 ZINC000005743119 530072273 /nfs/dbraw/zinc/07/22/73/530072273.db2.gz BPZXYEUJBFHASJ-FULWYAMNSA-N -1 2 379.291 -1.574 40 0 GAABLM Nc1nc2c(ncn2[C@@H]2O[C@@H](CO[P@@](=O)([O-])O)[C@@H](O)[C@@H]2O)c(=S)[nH]1 ZINC000005743119 530072272 /nfs/dbraw/zinc/07/22/72/530072272.db2.gz BPZXYEUJBFHASJ-FULWYAMNSA-N -1 2 379.291 -1.574 40 0 GAABLM [NH3+][C@H]1C=CN([C@@H]2C[C@@H](O)[C@H](CO[P@](=O)([O-])O[P@](=O)([O-])O)O2)C(=O)N1 ZINC000584578391 530109309 /nfs/dbraw/zinc/10/93/09/530109309.db2.gz KEIGXEFGDSBCEL-CWKFCGSDSA-N -1 2 389.194 -1.488 40 0 GAABLM [NH3+][C@H]1C=CN([C@@H]2C[C@@H](O)[C@H](CO[P@](=O)([O-])O[P@@](=O)([O-])O)O2)C(=O)N1 ZINC000584578391 530109307 /nfs/dbraw/zinc/10/93/07/530109307.db2.gz KEIGXEFGDSBCEL-CWKFCGSDSA-N -1 2 389.194 -1.488 40 0 GAABLM [NH3+][C@@H]1C=CN([C@@H]2C[C@@H](O)[C@H](CO[P@](=O)([O-])O[P@](=O)([O-])O)O2)C(=O)N1 ZINC000584578392 530109243 /nfs/dbraw/zinc/10/92/43/530109243.db2.gz KEIGXEFGDSBCEL-KVPKETBZSA-N -1 2 389.194 -1.488 40 0 GAABLM [NH3+][C@@H]1C=CN([C@@H]2C[C@@H](O)[C@H](CO[P@](=O)([O-])O[P@@](=O)([O-])O)O2)C(=O)N1 ZINC000584578392 530109241 /nfs/dbraw/zinc/10/92/41/530109241.db2.gz KEIGXEFGDSBCEL-KVPKETBZSA-N -1 2 389.194 -1.488 40 0 GAABLM