pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
1.89999997615814	QSARToolbox	1	0	Nc1cccc2c1n[nH+]n2[C@H]1C[C@H](O)[C@@H](CO)O1,Nc1cccc2c1[nH+]nn2[C@H]1C[C@H](O)[C@@H](CO)O1,[NH3+]c1cccc2c1nnn2[C@H]1C[C@H](O)[C@@H](CO)O1	Nc1cccc2c1nnn2[C@H]1C[C@H](O)[C@@H](CO)O1	mol38222	Nc1cccc2c1nnn2[C@H]1C[C@H](O)[C@@H](CO)O1