pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
11.04	OCHEM	1	0	C[NH2+]C1CCCCC1	CNC1CCCCC1	mol2056	CNC1CCCCC1
11.3999996185303	QSARToolbox	1	0	C[NH2+]C1CCCCC1	CNC1CCCCC1	mol2056	CNC1CCCCC1
