pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
6.28	AttenGpKa training set	1	0	[NH2+]=C(Nc1ccccc1)c1ccccc1O	[NH2+]=C(Nc1ccccc1)c1ccccc1[O-],N=C(Nc1ccccc1)c1ccccc1O	mol30666	N=C(Nc1ccccc1)c1ccccc1O