pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
2.8	IUPAC digitized pKa	1	0	Nc1c([NH3+])nc(C=Cc2ccccc2)nc1Cl,Nc1nc(C=Cc2ccccc2)nc(Cl)c1[NH3+],Nc1nc(C=Cc2ccccc2)[nH+]c(Cl)c1N,Nc1[nH+]c(C=Cc2ccccc2)nc(Cl)c1N	Nc1nc(C=Cc2ccccc2)nc(Cl)c1N	mol7274	Nc1nc(C=Cc2ccccc2)nc(Cl)c1N