pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
4.0349998	OCHEM	1	0	O[C@@H]1[C@H](O)[C@H]([OH2+])CO[C@H]1n1cnc2ccccc21,O[C@H]1[C@@H]([OH2+])[C@H](n2cnc3ccccc32)OC[C@H]1O,O[C@@H]1[C@H](O)[C@H](O)CO[C@H]1n1c[nH+]c2ccccc21	O[C@@H]1[C@H](O)[C@H](O)CO[C@H]1n1cnc2ccccc21	mol32605	OC1COC(n2cnc3ccccc32)C(O)C1O