pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.01	IUPAC digitized pKa	1	0	C1C[NH2+]1	C1CN1	mol170	C1CN1
8.04	IUPAC digitized pKa	1	0	C1C[NH2+]1	C1CN1	mol170	C1CN1
7.79	IUPAC digitized pKa	1	0	C1C[NH2+]1	C1CN1	mol170	C1CN1
7.98	IUPAC digitized pKa	1	0	C1C[NH2+]1	C1CN1	mol170	C1CN1
7.9	IUPAC digitized pKa	1	0	C1C[NH2+]1	C1CN1	mol170	C1CN1
7.88	IUPAC digitized pKa	1	0	C1C[NH2+]1	C1CN1	mol170	C1CN1
6.05	Datawarrior	1	0	C1C[NH2+]1	C1CN1	mol170	C1CN1
8.0	OCHEM	1	0	C1C[NH2+]1	C1CN1	mol170	C1CN1
6.0500002	OCHEM	1	0	C1C[NH2+]1	C1CN1	mol170	C1CN1
8.10000038146973	QSARToolbox	1	0	C1C[NH2+]1	C1CN1	mol170	C1CN1
7.78999996185303	QSARToolbox	1	0	C1C[NH2+]1	C1CN1	mol170	C1CN1
7.90000009536743	QSARToolbox	1	0	C1C[NH2+]1	C1CN1	mol170	C1CN1
6.1100001335144	QSARToolbox	1	0	C1C[NH2+]1	C1CN1	mol170	C1CN1
5.98999977111816	QSARToolbox	1	0	C1C[NH2+]1	C1CN1	mol170	C1CN1
8.03999996185303	QSARToolbox	1	0	C1C[NH2+]1	C1CN1	mol170	C1CN1