pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.4	AttenGpKa training set	0	-1	C/C(=N\O)c1cc([N+](=O)[O-])ccc1O	C/C(=N\O)c1cc([N+](=O)[O-])ccc1[O-]	mol31612	C/C(=N\O)c1cc([N+](=O)[O-])ccc1O
11.31	AttenGpKa training set	-1	-2	C/C(=N\O)c1cc([N+](=O)[O-])ccc1[O-]	C/C(=N\[O-])c1cc([N+](=O)[O-])ccc1[O-]	mol31612	C/C(=N\O)c1cc([N+](=O)[O-])ccc1O