pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
5.9	Baltruschat ChEMBL	1	0	CCCCCCCC[NH2+]CC(F)(F)F	CCCCCCCCNCC(F)(F)F	mol21641	CCCCCCCCNCC(F)(F)F
