smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name NNC(=O)C=P(O)(c1ccccc1)c1ccccc1 ZINC000000001489 871372728 /nfs/dbraw/zinc/37/27/28/871372728.db2.gz PMHFLBQRALFMRT-UHFFFAOYSA-N 0 0 274.260 0.990 50 50 in-man CCGARN