pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.10999965667725	QSARToolbox	1	0	FC(F)(F)[C@H](Br)C[NH+]1CCCC1	FC(F)(F)[C@H](Br)CN1CCCC1	mol38492	FC(F)(F)C(Br)CN1CCCC1
