smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Nc1ccc(Cc2nc([O-])cc(=O)[n-]2)cc1 ZINC000082535876 384237938 /nfs/dbraw/zinc/23/79/38/384237938.db2.gz UYWUJFYKXONDKI-UHFFFAOYSA-N -2 3 217.228 0.649 40 10 BCCBHL Nc1ccc(Cc2ncc(C(=O)[O-])c(=O)[n-]2)cc1 ZINC000225008159 386163566 /nfs/dbraw/zinc/16/35/66/386163566.db2.gz YYPAWPCBLFJFEL-UHFFFAOYSA-N -2 3 245.238 0.641 40 10 BCCBHL