smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC(/C=C/C(=O)[O-])=C\c1ccc([N-]S(=O)(=O)c2ccc(Cl)cc2)cc1 ZINC000026501991 204845752 /nfs/dbraw/zinc/84/57/52/204845752.db2.gz HIUIHMARBRKSSO-HUYCJKDXSA-N -2 1 377.849 4.185 1 0 GIAFML CCCCCn1c(=O)c(C(=O)[O-])c([O-])c2cc(Cc3ccc(F)cc3)ccc21 ZINC000040867320 205074139 /nfs/dbraw/zinc/07/41/39/205074139.db2.gz OKEFQLWBQZIUAU-UHFFFAOYSA-N -2 1 383.419 4.325 1 0 GIAFML COC[P@](=O)([O-])[C@@H](CCCc1ccc(-c2ccccc2)cc1)[P@](=O)([O-])O ZINC000013742100 210087510 /nfs/dbraw/zinc/08/75/10/210087510.db2.gz NZPUAFQASWYNAS-GOSISDBHSA-N -2 1 398.332 4.054 1 0 GIAFML