smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=C1[N-]C(=O)NC(c2ccc(O)c([O-])c2O)N1 ZINC000006668374 349640520 /nfs/dbraw/zinc/64/05/20/349640520.db2.gz HJFDHRYSNLYFJC-UHFFFAOYSA-N -2 3 239.187 -0.176 50 10 BBCAHL O=C([O-])Cn1nnc(-c2ccc([O-])c(O)c2)n1 ZINC000020120455 384578697 /nfs/dbraw/zinc/57/86/97/384578697.db2.gz OPINCROJMZXJCY-UHFFFAOYSA-N -2 3 236.187 -0.164 50 10 BBCAHL