smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1cc(Cl)ccc1NC(=O)C(=Cc1nc2ccccc2[nH]c1=O)NNC(=O)C[N+](C)(C)C ZINC000005399886 717099170 /nfs/dbraw/zinc/09/91/70/717099170.db2.gz KFWSDVQNHAQPAG-UHFFFAOYSA-O 1 0 469.953 2.245 50 50 JEGARO