pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
4.44	Hunt	0	-1	CC(C)c1ccc(Br)c(=O)c(O)c1Br	CC(C)c1ccc(Br)c(=O)c([O-])c1Br	mol1632	CC(C)c1ccc(Br)c(=O)c(O)c1Br
6.44000005722046	QSARToolbox	0	-1	CC(C)c1ccc(Br)c(=O)c(O)c1Br	CC(C)c1ccc(Br)c(=O)c([O-])c1Br	mol1632	CC(C)c1ccc(Br)c(=O)c(O)c1Br
6.44	AttenGpKa training set	0	-1	CC(C)c1ccc(Br)c(=O)c(O)c1Br	CC(C)c1ccc(Br)c(=O)c([O-])c1Br	mol1632	CC(C)c1ccc(Br)c(=O)c(O)c1Br