pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
1.70000004768372	QSARToolbox	1	0	CC(C)C[C@](O)(C[C@H]([NH3+])C(=O)O)C(=O)O,CC(C)C[C@]([OH2+])(C[C@H](N)C(=O)O)C(=O)O	CC(C)C[C@](O)(C[C@H]([NH3+])C(=O)O)C(=O)[O-],CC(C)C[C@](O)(C[C@H]([NH3+])C(=O)[O-])C(=O)O	mol37239	CC(C)C[C@](O)(C[C@H](N)C(=O)O)C(=O)O