pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.26	Datawarrior	1	0	C[C@@H]1CCCC[NH+]1C	C[C@@H]1CCCCN1C	mol12397	CC1CCCCN1C
10.22	OCHEM	1	0	C[C@@H]1CCCC[NH+]1C	C[C@@H]1CCCCN1C	mol12397	CC1CCCCN1C
10.845	AttenGpKa training set	1	0	C[C@@H]1CCCC[NH+]1C	C[C@@H]1CCCCN1C	mol12397	CC1CCCCN1C