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-])CCN1C[C@]2([N+](=O)[O-])CC=C(C(=O)[O-])[C@]([N+](=O)[O-])(C1)C2 ZINC000036033916 304053405 /nfs/dbraw/zinc/05/34/05/304053405.db2.gz KCONSEYJHJEESG-NWDGAFQWSA-N -2 0 329.265 -0.388 40 5 EBBBRL