pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
0.65	Baltruschat ChEMBL	1	0	""	O=C(N[C@@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1)C(Cl)(Cl)Cl	mol17058	O=C(NC(CO)C(O)c1ccc([N+](=O)[O-])cc1)C(Cl)(Cl)Cl