pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.5	OCHEM	1	0	COc1ccc([C@@]2(F)C[C@@H]2[NH3+])cc1	COc1ccc([C@@]2(F)C[C@@H]2N)cc1	mol21138	COc1ccc([C@@]2(F)C[C@@H]2N)cc1
