pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.05000019073486	QSARToolbox	6	5	[NH3+]CCC[NH2+]CCC[NH2+]CCCCCCCCCC[NH2+]CCC[NH2+]CCC[NH3+]	NCCC[NH2+]CCC[NH2+]CCCCCCCCCC[NH2+]CCC[NH2+]CCC[NH3+],[NH3+]CCC[NH2+]CCCNCCCCCCCCCC[NH2+]CCC[NH2+]CCC[NH3+],[NH3+]CCCNCCC[NH2+]CCCCCCCCCC[NH2+]CCC[NH2+]CCC[NH3+]	mol38459	NCCCNCCCNCCCCCCCCCCNCCCNCCCN