pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
4.7	Datawarrior	1	0	Cc1ccc(O)c2[n+]1CCS2	Cc1ccc([O-])c2[n+]1CCS2	mol14026	Cc1ccc(O)c2[n+]1CCS2
4.6999998	OCHEM	1	0	Cc1ccc(O)c2[n+]1CCS2	Cc1ccc([O-])c2[n+]1CCS2	mol14026	Cc1ccc(O)c2[n+]1CCS2
4.69999980926514	QSARToolbox	1	0	Cc1ccc(O)c2[n+]1CCS2	Cc1ccc([O-])c2[n+]1CCS2	mol14026	Cc1ccc(O)c2[n+]1CCS2