pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.85	OCHEM	1	0	Cc1ccc(Cl)cc1[NH3+]	Cc1ccc(Cl)cc1N	mol1757	Cc1ccc(Cl)cc1N
3.34	AttenGpKa training set	1	0	Cc1ccc(Cl)cc1[NH3+]	Cc1ccc(Cl)cc1N	mol1757	Cc1ccc(Cl)cc1N