pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
6.0	QSARToolbox	0	-1	CCCO/C(=N\CCN[N+](=O)[O-])N[N+](=O)[O-]	CCCO/C(=N\CCN[N+](=O)[O-])[N-][N+](=O)[O-],CCCO/C(=N\CC[N-][N+](=O)[O-])N[N+](=O)[O-]	mol35452	CCCO/C(=N\CCN[N+](=O)[O-])N[N+](=O)[O-]
