pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.7	IUPAC digitized pKa	0	-1	O=C([O-])[C@@H]1C[C@@H](O)C[NH2+]1	O=C([O-])[C@@H]1C[C@@H](O)CN1	mol9431	O=C(O)C1CC(O)CN1
9.6400003	OCHEM	0	-1	O=C([O-])[C@@H]1C[C@@H](O)C[NH2+]1	O=C([O-])[C@@H]1C[C@@H](O)CN1	mol9431	O=C(O)C1CC(O)CN1
9.72999954223633	QSARToolbox	0	-1	O=C([O-])[C@@H]1C[C@@H](O)C[NH2+]1	O=C([O-])[C@@H]1C[C@@H](O)CN1	mol9431	O=C(O)C1CC(O)CN1
1.92	OCHEM	1	0	O=C(O)[C@@H]1C[C@@H](O)C[NH2+]1	O=C([O-])[C@@H]1C[C@@H](O)C[NH2+]1	mol9431	O=C(O)C1CC(O)CN1
1.91999995708466	QSARToolbox	1	0	O=C(O)[C@@H]1C[C@@H](O)C[NH2+]1	O=C([O-])[C@@H]1C[C@@H](O)C[NH2+]1	mol9431	O=C(O)C1CC(O)CN1
1.82000005245209	QSARToolbox	1	0	O=C(O)[C@@H]1C[C@@H](O)C[NH2+]1	O=C([O-])[C@@H]1C[C@@H](O)C[NH2+]1	mol9431	O=C(O)C1CC(O)CN1