smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=C([O-])C[C@@H](NC(=O)C(F)(F)F)C(=O)Nc1cccc([N+](=O)[O-])c1[N+](=O)[O-] ZINC000029405510 207362654 /nfs/dbraw/zinc/36/26/54/207362654.db2.gz VPAAVSOEUZBKJK-ZCFIWIBFSA-N -1 2 394.218 0.963 1 5 GCBFLM