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:	t31
	Name:	phenanthrene
	Description:
	Labels:	Training
	CAS:	85-01-8
	InChi Code:	InChI=1S/C14H10/c1-3-7-13-11(5-1)9-10-12-6-2-4-8-14(12)13/h1-10H

Properties

LogBCF: Fish bioconcentration factor as logBCF

Value	Source or prediction
3.01	experimental value
2.9801	Tab2: Multilinear model for diverse chemicals (Training set)
2.9801	Tab3: Multilinear model for diverse chemicals (Tab3*, statistical outliers (Tab4) removed) (Training set)

Links to External Resources

Link	Resource description
DTXSID6024254	US EPA CompTox Dashboard