Gramatica, P.; Chirico, N.; Papa, E.; Cassani, S.; Kovarich, S. QSARINS: A new software for the development, analysis, and validation of QSAR MLR models. Journal of Computational Chemistry 2013, 34, 2121–2132.

Compound

	ID:	168
	Name:	2-methoxytetrachlorophenol
	Description:
	Labels:	Validation
	CAS:	2539-17-5
	InChi Code:	InChI=1S/C7H4Cl4O2/c1-13-7-5(11)3(9)2(8)4(10)6(7)12/h12H,1H3

Properties

PBT_Index: PBT Index i

Value	Source or prediction
1.76	experimental value
1.826	Eq1: Full model (Training set)
1.784	Eq2: Split model (Validation set)

Links to External Resources

Link	Resource description
DTXSID0044155	US EPA CompTox Dashboard