pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.12	IUPAC digitized pKa	0	-1	CC(C)(O)[C@H]([NH3+])C(=O)[O-]	CC(C)(O)[C@H](N)C(=O)[O-]	mol8595	CC(C)(O)[C@H](N)C(=O)O
9.1	IUPAC digitized pKa	0	-1	CC(C)(O)[C@H]([NH3+])C(=O)[O-]	CC(C)(O)[C@H](N)C(=O)[O-]	mol8595	CC(C)(O)[C@H](N)C(=O)O
2.14	IUPAC digitized pKa	1	0	CC(C)(O)[C@H]([NH3+])C(=O)O	CC(C)(O)[C@H]([NH3+])C(=O)[O-]	mol8595	CC(C)(O)[C@H](N)C(=O)O
2.1	IUPAC digitized pKa	1	0	CC(C)(O)[C@H]([NH3+])C(=O)O	CC(C)(O)[C@H]([NH3+])C(=O)[O-]	mol8595	CC(C)(O)[C@H](N)C(=O)O