Gramatica, P.; Giani, E.; Papa, E. Statistical external validation and consensus modeling: A QSPR case study for Koc prediction. J. Mol. Graph. Model. 2007, 25, 6, 755–766.

Compound

	ID:	510
	Name:	Phosphamidon
	Description:
	Labels:	Training
	CAS:	13171-21-6
	InChi Code:	InChI=1/C10H19ClNO5P/c1-6-12(7-2)10(13)9(11)8(3)17-18(14,15-4)16-5/h6-7H2,1-5H3/b9-8-

Properties

logKoc: logarithm of soil sorption coefficient i

Value	Source or prediction
0.9	experimental value
1.97	Eq1: Best externally predictive model (Training set)
2.06	Eq2: Full model, including all data (Training set)
1.31	Tab2-9: Correlation with logKow (Training set)
0.45	Tab2-10: Correlation with logSw (Training set)
1.06	Tab2-11: logKow and aromaticity (Training set)
0.31	Tab2-12: logSw and aromaticity (Training set)

Links to External Resources

Link	Resource description
DTXSID7021156	US EPA CompTox Dashboard