smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=C(Oc1nccc(O)c1[N+](=O)[O-])[C@H](O)COP(=O)([O-])[O-] ZINC001225664312 979600749 /nfs/dbraw/zinc/60/07/49/979600749.db2.gz MYNZVPVGMJNYRK-RXMQYKEDSA-N -2 2 324.138 -0.929 20 5 DBBDLL