pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.47	IUPAC digitized pKa	1	0	CC(C)C[C@@H]([NH3+])c1ccc(Cl)cc1	CC(C)C[C@@H](N)c1ccc(Cl)cc1	mol6111	CC(C)CC(N)c1ccc(Cl)cc1