pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.57	IUPAC digitized pKa	0	-1	Cc1nc2nc(S)ncc2[nH]1	Cc1nc2nc(S)ncc2[n-]1,Cc1nc2nc([S-])ncc2[nH]1	mol8315	Cc1nc2nc(S)ncc2[nH]1
11.23	IUPAC digitized pKa	-1	-2	Cc1nc2nc(S)ncc2[n-]1,Cc1nc2nc([S-])ncc2[nH]1	Cc1nc2nc([S-])ncc2[n-]1	mol8315	Cc1nc2nc(S)ncc2[nH]1