pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
5.31	IUPAC digitized pKa	1	0	Cc1nc(N)[nH+]c2ccccc12,Cc1nc([NH3+])nc2ccccc12,Cc1[nH+]c(N)nc2ccccc12	Cc1nc(N)nc2ccccc12	mol7841	Cc1nc(N)nc2ccccc12
5.30999994277954	QSARToolbox	1	0	Cc1nc(N)[nH+]c2ccccc12,Cc1nc([NH3+])nc2ccccc12,Cc1[nH+]c(N)nc2ccccc12	Cc1nc(N)nc2ccccc12	mol7841	Cc1nc(N)nc2ccccc12