pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
0.33	IUPAC digitized pKa	1	0	Cc1cccc([NH2+][C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1	Cc1cccc(N[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1	mol8630	Cc1cccc(NC2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1