pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.97	IUPAC digitized pKa	0	-1	Nc1ncc(Cl)c(O)n1	Nc1ncc(Cl)c([O-])n1	mol7017	Nc1ncc(Cl)c(O)n1
2.53	IUPAC digitized pKa	1	0	[NH3+]c1ncc(Cl)c(O)n1,Nc1nc(O)c(Cl)c[nH+]1,Nc1ncc(Cl)c(O)[nH+]1	Nc1ncc(Cl)c(O)n1	mol7017	Nc1ncc(Cl)c(O)n1