pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.6400003433228	QSARToolbox	1	0	CCC(CC)[NH+]1CCCCC1	CCC(CC)N1CCCCC1	mol24554	CCC(CC)N1CCCCC1
10.84	AttenGpKa training set	1	0	CCC(CC)[NH+]1CCCCC1	CCC(CC)N1CCCCC1	mol24554	CCC(CC)N1CCCCC1