pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
14.3	AttenGpKa training set	0	-1	Cc1cc(-c2ccccc2)[nH]n1	Cc1cc(-c2ccccc2)[n-]n1	mol6916	Cc1cc(-c2ccccc2)[nH]n1
2.92	IUPAC digitized pKa	1	0	Cc1cc(-c2ccccc2)[nH][nH+]1	Cc1cc(-c2ccccc2)[nH]n1	mol6916	Cc1cc(-c2ccccc2)[nH]n1