pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.9	AttenGpKa training set	1	0	Cc1[nH]c2ccc([N+](=O)[O-])c(O)c2[nH+]1	Cc1nc2c(O)c([N+](=O)[O-])ccc2[nH]1,Cc1[nH]c2ccc([N+](=O)[O-])c([O-])c2[nH+]1	mol26489	Cc1nc2c(O)c([N+](=O)[O-])ccc2[nH]1