smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=[N+]([O-])c1ccc([P@@](=O)([O-])O[C@@H]2[C@H](O)[C@H](O)[C@@H](O)[C@H](O)[C@H]2O)cc1 ZINC000100103085 209209385 /nfs/dbraw/zinc/20/93/85/209209385.db2.gz IFFNCWRBVVEFRC-KCUSNBPKSA-N -1 0 365.231 -2.391 10 5 FABERM