pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
5.4	AttenGpKa training set	1	0	C[C@@H](O)c1[nH]c2ccccc2[nH+]1	C[C@@H](O)c1nc2ccccc2[nH]1	mol26421	CC(O)c1nc2ccccc2[nH]1