pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
6.7	IUPAC digitized pKa	1	0	Nc1cc(-c2ccccc2)[nH+]c(N)n1,Nc1cc(-c2ccccc2)nc([NH3+])n1,Nc1cc(-c2ccccc2)nc(N)[nH+]1,Nc1nc([NH3+])cc(-c2ccccc2)n1	Nc1cc(-c2ccccc2)nc(N)n1	mol7315	Nc1cc(-c2ccccc2)nc(N)n1
6.69999980926514	QSARToolbox	1	0	Nc1cc(-c2ccccc2)[nH+]c(N)n1,Nc1cc(-c2ccccc2)nc([NH3+])n1,Nc1cc(-c2ccccc2)nc(N)[nH+]1,Nc1nc([NH3+])cc(-c2ccccc2)n1	Nc1cc(-c2ccccc2)nc(N)n1	mol7315	Nc1cc(-c2ccccc2)nc(N)n1