pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.6800003051758	QSARToolbox	1	0	CC[NH+]1[C@H](C)CCC[C@@H]1C	CCN1[C@H](C)CCC[C@@H]1C	mol24525	CCN1[C@H](C)CCC[C@@H]1C
10.88	AttenGpKa training set	1	0	CC[NH+]1[C@H](C)CCC[C@@H]1C	CCN1[C@H](C)CCC[C@@H]1C	mol24525	CCN1[C@H](C)CCC[C@@H]1C