pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
4.21000003814697	QSARToolbox	1	0	C[C@H](CS)c1cccc[nH+]1	C[C@H](CS)c1ccccn1	mol34780	CC(CS)c1ccccn1