Piir, G.; Sild, S.; Roncaglioni, A.; Benfenati, E.; Maran, U. QSAR model for the prediction of bio-concentration factor using aqueous solubility and descriptors considering various electronic effects. SAR QSAR Environ. Res. 2010, 21, 7-8, 711-729.

Compound

	ID:	e288
	Name:	thiram
	Description:
	Labels:	Validation, 2
	CAS:	137-26-8
	InChi Code:	InChI=1S/C6H12N2S4/c1-7(2)5(9)11-12-6(10)8(3)4/h1-4H3

Properties

LogBCF: Fish bioconcentration factor as logBCF

Value	Source or prediction
0.53	experimental value
0.8738	Tab2: Multilinear model for diverse chemicals (External validation set 2)
0.8738	Tab3: Multilinear model for diverse chemicals (Tab3*, statistical outliers (Tab4) removed) (External validation set 2)

Links to External Resources

Link	Resource description
DTXSID5021332	US EPA CompTox Dashboard