pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.46	IUPAC digitized pKa	0	-1	CNc1ccc(S)nn1	CNc1ccc([S-])nn1	mol6968	CNc1ccc(S)nn1
-0.04	IUPAC digitized pKa	1	0	C[NH2+]c1ccc(S)nn1,CNc1ccc(S)n[nH+]1,CNc1ccc(S)[nH+]n1	CNc1ccc(S)nn1	mol6968	CNc1ccc(S)nn1