pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.2799997329712	QSARToolbox	1	0	CC[C@H](C)C[NH+]1CCCCC1	CC[C@H](C)CN1CCCCC1	mol24555	CCC(C)CN1CCCCC1
10.48	AttenGpKa training set	1	0	CC[C@H](C)C[NH+]1CCCCC1	CC[C@H](C)CN1CCCCC1	mol24555	CCC(C)CN1CCCCC1