smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Nc1nc(N)c(CCNc2cc(F)c(F)cc2[N+](=O)[O-])c(=O)[nH]1 ZINC000029246271 202183725 /nfs/dbraw/zinc/18/37/25/202183725.db2.gz OQFZBIBWLZFXAQ-UHFFFAOYSA-N 0 1 326.263 0.775 1 5 ECBFMN CCCC(=O)OC[C@@H](O)CO[P@](=O)([O-])OCC[N+](C)(C)C ZINC000033822426 717121880 /nfs/dbraw/zinc/12/18/80/717121880.db2.gz YOLSCEBOFNSEKU-LLVKDONJSA-O 0 1 328.322 0.530 1 5 ECBFMN CCCC(=O)O[C@H](CO)CO[P@](=O)([O-])OCC[N+](C)(C)C ZINC000038791434 717126196 /nfs/dbraw/zinc/12/61/96/717126196.db2.gz AXIALKQETDKBNO-LLVKDONJSA-O 0 1 328.322 0.530 1 5 ECBFMN CCCCC(=O)O[C@H](CO)CO[P@](=O)([O-])OCC[N+](C)(C)C ZINC000038791436 717126105 /nfs/dbraw/zinc/12/61/05/717126105.db2.gz FUNVSMBQMVEBQX-GFCCVEGCSA-O 0 1 342.349 0.921 1 5 ECBFMN