pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
1.85	IUPAC digitized pKa	1	0	CC(C)Nc1nc(Cl)nc(NC(C)C)[nH+]1,CC(C)Nc1nc(Cl)[nH+]c(NC(C)C)n1,CC(C)Nc1nc(Cl)nc([NH2+]C(C)C)n1	CC(C)Nc1nc(Cl)nc(NC(C)C)n1	mol7616	CC(C)Nc1nc(Cl)nc(NC(C)C)n1
