pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
6.14	OCHEM	1	0	FC(F)(F)C/N=C/Nc1ccc(-c2c[nH]c[nH+]2)cc1,FC(F)(F)C/[NH+]=C/Nc1ccc(-c2c[nH]cn2)cc1	FC(F)(F)C/N=C/Nc1ccc(-c2c[nH]cn2)cc1	mol32064	FC(F)(F)C/N=C/Nc1ccc(-c2c[nH]cn2)cc1
4.45	OCHEM	2	1	FC(F)(F)C/[NH+]=C/Nc1ccc(-c2c[nH]c[nH+]2)cc1	FC(F)(F)C/N=C/Nc1ccc(-c2c[nH]c[nH+]2)cc1,FC(F)(F)C/[NH+]=C/Nc1ccc(-c2c[nH]cn2)cc1	mol32064	FC(F)(F)C/N=C/Nc1ccc(-c2c[nH]cn2)cc1