pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
5.5	Baltruschat ChEMBL	1	0	CCCCCCCCCCCC[NH2+]CC(F)(F)F	CCCCCCCCCCCCNCC(F)(F)F	mol21642	CCCCCCCCCCCCNCC(F)(F)F