pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.77	AttenGpKa training set	0	-1	Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(F)(F)F	Cc1ccc([N+](=O)[O-])c(C)c1[N-]C(=O)C(F)(F)F	mol24085	Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(F)(F)F