pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.39999961853027	QSARToolbox	0	-1	OC[C@]12NC(=S)O[C@H]1[C@H](O)[C@H](O)CO2	OC[C@]12[N-]C(=S)O[C@H]1[C@H](O)[C@H](O)CO2	mol37623	OC[C@]12NC(=S)O[C@H]1[C@H](O)[C@H](O)CO2