pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.35	IUPAC digitized pKa	2	1	C[N+]1(CC[NH+](c2ccc(F)cc2)C2CCCCC2)CCCCC1	C[N+]1(CCN(c2ccc(F)cc2)C2CCCCC2)CCCCC1	mol6016	C[N+]1(CCN(c2ccc(F)cc2)C2CCCCC2)CCCCC1