pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
6.4	Baltruschat ChEMBL	1	0	NC1(Cc2[nH]cc(-c3ccc(OC(F)(F)F)cc3)[nH+]2)COC1,[NH3+]C1(Cc2nc(-c3ccc(OC(F)(F)F)cc3)c[nH]2)COC1	NC1(Cc2nc(-c3ccc(OC(F)(F)F)cc3)c[nH]2)COC1	mol21268	NC1(Cc2nc(-c3ccc(OC(F)(F)F)cc3)c[nH]2)COC1