pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.79	Datawarrior	1	0	NCCCCCCCCCCCC[NH3+]	NCCCCCCCCCCCCN	mol13328	NCCCCCCCCCCCCN
8.5600004196167	QSARToolbox	1	0	NCCCCCCCCCCCC[NH3+]	NCCCCCCCCCCCCN	mol13328	NCCCCCCCCCCCCN