pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
6.3	Baltruschat ChEMBL	1	0	O=S(=O)(c1ccc(F)cc1)C1(F)CC[NH+](CCc2ccc(F)cc2F)CC1	O=S(=O)(c1ccc(F)cc1)C1(F)CCN(CCc2ccc(F)cc2F)CC1	mol17642	O=S(=O)(c1ccc(F)cc1)C1(F)CCN(CCc2ccc(F)cc2F)CC1