pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
4.54	AttenGpKa training set	0	-1	C[C@@H](CC(=O)O)c1cccc(C(F)(F)F)c1	C[C@@H](CC(=O)[O-])c1cccc(C(F)(F)F)c1	mol23556	CC(CC(=O)O)c1cccc(C(F)(F)F)c1