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-])c1ccccc1-c1ccccc1C(=O)Nc1cc([N+](=O)[O-])ccc1O ZINC000005065477 570409259 /nfs/dbraw/zinc/40/92/59/570409259.db2.gz REWWLEHJQSKSDP-UHFFFAOYSA-N -1 2 378.340 3.918 50 5 GHBALM