smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCCCC(P(=O)([O-])O)[P@@](=O)([O-])O ZINC000005819936 581097875 /nfs/dbraw/zinc/09/78/75/581097875.db2.gz IRYOZLKMXHUGKP-UHFFFAOYSA-N -2 2 232.109 0.858 1 0 BCAFLL CCCCC(P(=O)([O-])O)[P@](=O)([O-])O ZINC000005819936 581097876 /nfs/dbraw/zinc/09/78/76/581097876.db2.gz IRYOZLKMXHUGKP-UHFFFAOYSA-N -2 2 232.109 0.858 1 0 BCAFLL