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([O-])c1ccccc1C(=O)N[N-]C(=O)c1cc2ccccc2o1 ZINC000000507177 956862882 /nfs/dbraw/zinc/86/28/82/956862882.db2.gz RYZKNHCCYHTTMZ-UHFFFAOYSA-N -2 0 324.292 2.206 50 50 DEGARL