pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
2.71000003814697	QSARToolbox	-1	-2	O=[N+]([O-])OC[C@H](CCCC(P(=O)([O-])O)P(=O)(O)O)O[N+](=O)[O-]	O=[N+]([O-])OC[C@H](CCCC(P(=O)([O-])[O-])P(=O)(O)O)O[N+](=O)[O-],O=[N+]([O-])OC[C@H](CCCC(P(=O)([O-])O)P(=O)([O-])O)O[N+](=O)[O-]	mol37133	O=[N+]([O-])OCC(CCCC(P(=O)(O)O)P(=O)(O)O)O[N+](=O)[O-]