pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.38	IUPAC digitized pKa	0	-1	C[C@@H]([NH3+])C(=O)N1CCC[C@H]1C(=O)[O-]	C[C@@H](N)C(=O)N1CCC[C@H]1C(=O)[O-]	mol5467	C[C@@H](N)C(=O)N1CCC[C@H]1C(=O)O
3.04	IUPAC digitized pKa	1	0	C[C@@H]([NH3+])C(=O)N1CCC[C@H]1C(=O)O	C[C@@H]([NH3+])C(=O)N1CCC[C@H]1C(=O)[O-]	mol5467	C[C@@H](N)C(=O)N1CCC[C@H]1C(=O)O
3.03999996185303	QSARToolbox	1	0	C[C@@H]([NH3+])C(=O)N1CCC[C@H]1C(=O)O	C[C@@H]([NH3+])C(=O)N1CCC[C@H]1C(=O)[O-]	mol5467	C[C@@H](N)C(=O)N1CCC[C@H]1C(=O)O