pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
5.13	IUPAC digitized pKa	1	0	Cc1ccc2cc[nH]c2[nH+]1	Cc1ccc2cc[nH]c2n1	mol7805	Cc1ccc2cc[nH]c2n1
5.18	AttenGpKa training set	1	0	Cc1ccc2cc[nH]c2[nH+]1	Cc1ccc2cc[nH]c2n1	mol7805	Cc1ccc2cc[nH]c2n1