smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Nc1ccc(CP(=O)([O-])[O-])cc1 1871203 169291219 /nfs/dbraw/zinc/29/12/19/169291219.db2.gz NEKHKXMBGWNTOO-UHFFFAOYSA-N -2 3 187.135 0.947 50 10 ACCAHL