pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.6	Datawarrior	0	-1	Cc1ccccc1NCCS	Cc1ccccc1NCC[S-]	mol14200	Cc1ccccc1NCCS
9.6000004	OCHEM	0	-1	Cc1ccccc1NCCS	Cc1ccccc1NCC[S-]	mol14200	Cc1ccccc1NCCS
9.60000038146973	QSARToolbox	0	-1	Cc1ccccc1NCCS	Cc1ccccc1NCC[S-]	mol14200	Cc1ccccc1NCCS