pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.58	IUPAC digitized pKa	0	-1	Nc1nc(N)c2nn[nH]c2n1	Nc1nc(N)c2nn[n-]c2n1	mol8346	Nc1nc(N)c2nn[nH]c2n1
3.68	IUPAC digitized pKa	1	0	Nc1nc(N)c2[nH+]n[nH]c2n1,Nc1nc([NH3+])c2nn[nH]c2n1,Nc1nc2[nH]nnc2c(N)[nH+]1,Nc1nc([NH3+])nc2[nH]nnc12,Nc1nc(N)c2nn[nH]c2[nH+]1,Nc1nc(N)c2n[nH+][nH]c2n1	Nc1nc(N)c2nn[nH]c2n1	mol8346	Nc1nc(N)c2nn[nH]c2n1