pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.76	OCHEM	1	0	C1CCC([C@@H]2CCC[NH2+]2)CC1	C1CCC([C@@H]2CCCN2)CC1	mol2445	C1CCC([C@@H]2CCCN2)CC1
