pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.4	AttenGpKa training set	0	-1	Cc1cccc(C)c1NC(=O)C(F)(F)F	Cc1cccc(C)c1[N-]C(=O)C(F)(F)F	mol23932	Cc1cccc(C)c1NC(=O)C(F)(F)F
