pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
6.35	Datawarrior	0	-1	Cc1c(C(=O)[O-])sc2cc(Cn3cc[nH+]c3)ccc12	Cc1c(C(=O)[O-])sc2cc(Cn3ccnc3)ccc12	mol15533	Cc1c(C(=O)O)sc2cc(Cn3ccnc3)ccc12
6.3499999	OCHEM	0	-1	Cc1c(C(=O)[O-])sc2cc(Cn3cc[nH+]c3)ccc12	Cc1c(C(=O)[O-])sc2cc(Cn3ccnc3)ccc12	mol15533	Cc1c(C(=O)O)sc2cc(Cn3ccnc3)ccc12
6.34999990463257	QSARToolbox	0	-1	Cc1c(C(=O)[O-])sc2cc(Cn3cc[nH+]c3)ccc12	Cc1c(C(=O)[O-])sc2cc(Cn3ccnc3)ccc12	mol15533	Cc1c(C(=O)O)sc2cc(Cn3ccnc3)ccc12