pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.14	OCHEM	1	0	C[C@@H]([NH3+])CC1CCCCC1	C[C@@H](N)CC1CCCCC1	mol959	C[C@@H](N)CC1CCCCC1
