pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.78	IUPAC digitized pKa	0	-1	CSc1nc(N(C)C)c2ncc(O)nc2n1	CSc1nc(N(C)C)c2ncc([O-])nc2n1	mol8179	CSc1nc(N(C)C)c2ncc(O)nc2n1
2.24	IUPAC digitized pKa	1	0	CSc1nc(N(C)C)c2ncc(O)nc2[nH+]1,CSc1nc([NH+](C)C)c2ncc(O)nc2n1,CSc1nc2nc(O)cnc2c(N(C)C)[nH+]1,CSc1nc(N(C)C)c2[nH+]cc(O)nc2n1	CSc1nc(N(C)C)c2ncc(O)nc2n1	mol8179	CSc1nc(N(C)C)c2ncc(O)nc2n1