pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.96	Datawarrior	1	0	CC(C)[NH+]1CCCCC1	CC(C)N1CCCCC1	mol13629	CC(C)N1CCCCC1
10.6899995803833	QSARToolbox	1	0	CC(C)[NH+]1CCCCC1	CC(C)N1CCCCC1	mol13629	CC(C)N1CCCCC1
10.84	AttenGpKa training set	1	0	CC(C)[NH+]1CCCCC1	CC(C)N1CCCCC1	mol13629	CC(C)N1CCCCC1