smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCc1ccccc1N1C(=O)NC(=O)C(=Cc2ccc(-c3ccc(C)c(C(=O)[O-])c3)o2)C1=O ZINC000059104983 557814603 /nfs/dbraw/zinc/81/46/03/557814603.db2.gz FBPGFZXVSHHAST-CPNJWEJPSA-N -1 2 444.443 5.022 40 10 IKCBLM