smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name COc1ccc(NC(=O)/C(C#N)=C/c2ccc([O-])c(OC)c2)cc1 ZINC000000047999 264002343 /nfs/dbraw/zinc/00/23/43/264002343.db2.gz TZZLZNRHOVAVGN-UKTHLTGXSA-N -1 3 324.336 2.955 30 50 DFGCHM