pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.0500001907349	QSARToolbox	0	-1	O=[N+]([O-])c1cc(C(F)(F)F)cc([N+](=O)[O-])c1N/N=C/c1ccc2c(c1)OCCOCCOCCOCCO2	O=[N+]([O-])c1cc(C(F)(F)F)cc([N+](=O)[O-])c1[N-]/N=C/c1ccc2c(c1)OCCOCCOCCOCCO2	mol36271	O=[N+]([O-])c1cc(C(F)(F)F)cc([N+](=O)[O-])c1N/N=C/c1ccc2c(c1)OCCOCCOCCOCCO2