pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.0	IUPAC digitized pKa	0	-1	Cn1c(S)nc2c[nH]c(=O)nc21	Cn1c([S-])nc2c[nH]c(=O)nc21,Cn1c(S)nc2c[n-]c(=O)nc21	mol9890	Cn1c(S)nc2c[nH]c(=O)nc21
11.21	IUPAC digitized pKa	-1	-2	Cn1c([S-])nc2c[nH]c(=O)nc21,Cn1c(S)nc2c[n-]c(=O)nc21	Cn1c([S-])nc2c[n-]c(=O)nc21	mol9890	Cn1c(S)nc2c[nH]c(=O)nc21