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:	11
	Name:	1-naphthyl N-methylcarbamate
	Description:	Original non-IUPAC name was: 1-naphthalenol, methylcarbamate
	Labels:	Validation
	CAS:	63-25-2
	InChi Code:	InChI=1S/C12H11NO2/c1-13-12(14)15-11-8-4-6-9-5-2-3-7-10(9)11/h2-8H,1H3,(H,13,14)

Properties

PBT_Index: PBT Index i

Value	Source or prediction
-0.05	experimental value
0.545	Eq1: Full model (Training set)
0.442	Eq2: Split model (Validation set)

Links to External Resources

Link	Resource description
DTXSID9020247	US EPA CompTox Dashboard