pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.19999980926514	QSARToolbox	1	0	Cc1ccc(NC(=[NH2+])c2ccccc2)cc1	Cc1ccc(NC(=N)c2ccccc2)cc1	mol28077	Cc1ccc(NC(=N)c2ccccc2)cc1
9.4	AttenGpKa training set	1	0	Cc1ccc(NC(=[NH2+])c2ccccc2)cc1	Cc1ccc(NC(=N)c2ccccc2)cc1	mol28077	Cc1ccc(NC(=N)c2ccccc2)cc1