pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.2	OCHEM	0	-1	C[C@@H]1NC(NCC(F)(F)F)=Nc2ccccc21	C[C@@H]1NC([N-]CC(F)(F)F)=Nc2ccccc21,C[C@@H]1[N-]C(NCC(F)(F)F)=Nc2ccccc21	mol21296	CC1NC(NCC(F)(F)F)=Nc2ccccc21