pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.69	AttenGpKa training set	1	0	Cc1ccc(-c2nc(CC[NH3+])cs2)cc1	Cc1ccc(-c2nc(CCN)cs2)cc1	mol25529	Cc1ccc(-c2nc(CCN)cs2)cc1