pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.4	Baltruschat ChEMBL	1	0	O=c1sc2cc(CCCF)ccc2n1CC[NH+]1CCCCCC1	O=c1sc2cc(CCCF)ccc2n1CCN1CCCCCC1	mol16094	O=c1sc2cc(CCCF)ccc2n1CCN1CCCCCC1