smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[N+](C)(C)CC(=O)NNC(=Cc1nc2c(ccc3c2C(=O)c2ccccc2C3=O)[nH]c1=O)C(=O)Nc1ccc(Cl)c(Cl)c1 ZINC000005723944 717101024 /nfs/dbraw/zinc/10/10/24/717101024.db2.gz PRHYTXKHDUGNDM-UHFFFAOYSA-O 1 0 620.473 3.777 1 50 KHGFRO