pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.56	IUPAC digitized pKa	1	0	CC[NH+]1CCC[C@@H]1C	CCN1CCC[C@@H]1C	mol3883	CCN1CCCC1C
10.6	Datawarrior	1	0	CC[NH+]1CCC[C@@H]1C	CCN1CCC[C@@H]1C	mol3883	CCN1CCCC1C
10.64	AttenGpKa training set	1	0	CC[NH+]1CCC[C@@H]1C	CCN1CCC[C@@H]1C	mol3883	CCN1CCCC1C