pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.59999990463257	QSARToolbox	1	0	C[C]1CN([C@H]2C[C@H](O)[C@@H](C[OH2+])O2)C(=O)NC1=O,C[C]1CN([C@H]2C[C@H](O)[C@@H](CO)O2)C(=O)NC1=[OH+],C[C]1CN([C@H]2C[C@H](O)[C@@H](CO)O2)C(=[OH+])NC1=O	C[C]1CN([C@H]2C[C@H](O)[C@@H](CO)O2)C(=O)NC1=O	mol35121	C[C]1CN([C@H]2C[C@H](O)[C@@H](CO)O2)C(=O)NC1=O