pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.42	OCHEM	1	0	[NH3+][C@@H]1C=CCCC1	N[C@@H]1C=CCCC1	mol968	N[C@@H]1C=CCCC1
