pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.21	Baltruschat ChEMBL	0	-1	FC(F)(F)c1cnc(-c2cccnc2)[nH]1	FC(F)(F)c1cnc(-c2cccnc2)[n-]1	mol16611	FC(F)(F)c1cnc(-c2cccnc2)[nH]1
3.5	Baltruschat ChEMBL	1	0	FC(F)(F)c1cnc(-c2ccc[nH+]c2)[nH]1,FC(F)(F)c1c[nH+]c(-c2cccnc2)[nH]1	FC(F)(F)c1cnc(-c2cccnc2)[nH]1	mol16611	FC(F)(F)c1cnc(-c2cccnc2)[nH]1