pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.5	Datawarrior	0	-1	Cc1cc(C)nc(S)n1	Cc1cc(C)nc([S-])n1	mol4203	Cc1cc(C)nc(S)n1
8.2	OCHEM	0	-1	Cc1cc(C)nc(S)n1	Cc1cc(C)nc([S-])n1	mol4203	Cc1cc(C)nc(S)n1
2.8	Datawarrior	1	0	Cc1cc(C)[nH+]c(S)n1	Cc1cc(C)nc(S)n1	mol4203	Cc1cc(C)nc(S)n1
3.65000009536743	QSARToolbox	1	0	Cc1cc(C)[nH+]c(S)n1	Cc1cc(C)nc(S)n1	mol4203	Cc1cc(C)nc(S)n1