pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.46	IUPAC digitized pKa	1	0	Cc1ccc[nH+]n1,Cc1cccn[nH+]1	Cc1cccnn1	mol4041	Cc1cccnn1
3.46000003814697	QSARToolbox	1	0	Cc1ccc[nH+]n1,Cc1cccn[nH+]1	Cc1cccnn1	mol4041	Cc1cccnn1
