pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
5.61	IUPAC digitized pKa	1	0	CSc1ccc([NH3+])nn1,CSc1ccc(N)[nH+]n1,CSc1ccc(N)n[nH+]1	CSc1ccc(N)nn1	mol6957	CSc1ccc(N)nn1
5.6100001335144	QSARToolbox	1	0	CSc1ccc([NH3+])nn1,CSc1ccc(N)[nH+]n1,CSc1ccc(N)n[nH+]1	CSc1ccc(N)nn1	mol6957	CSc1ccc(N)nn1