pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.01	IUPAC digitized pKa	0	-1	[NH3+][C@@H](Cc1ccccc1F)C(=O)[O-]	N[C@@H](Cc1ccccc1F)C(=O)[O-]	mol5432	N[C@@H](Cc1ccccc1F)C(=O)O
2.12	IUPAC digitized pKa	1	0	[NH3+][C@@H](Cc1ccccc1F)C(=O)O	[NH3+][C@@H](Cc1ccccc1F)C(=O)[O-]	mol5432	N[C@@H](Cc1ccccc1F)C(=O)O