pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
0.86	IUPAC digitized pKa	0	-1	CCO[P@@](=O)(O)COc1cc(Cl)c(Cl)cc1Cl	CCO[P@@](=O)([O-])COc1cc(Cl)c(Cl)cc1Cl	mol11121	CCOP(=O)(O)COc1cc(Cl)c(Cl)cc1Cl
0.860000014305115	QSARToolbox	0	-1	CCO[P@@](=O)(O)COc1cc(Cl)c(Cl)cc1Cl	CCO[P@@](=O)([O-])COc1cc(Cl)c(Cl)cc1Cl	mol11121	CCOP(=O)(O)COc1cc(Cl)c(Cl)cc1Cl