10967/115 - QDB Compounds

QsarDB Repository

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:e23
Name:dichlorvos
Description:
Labels:Validation, 2
CAS:62-73-7
InChi Code:InChI=1S/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3

Properties

LogBCF: Fish bioconcentration factor as logBCF

ValueSource or prediction
-0.20

experimental value

0.3626

Tab2: Multilinear model for diverse chemicals (External validation set 2)

0.3626

Tab3: Multilinear model for diverse chemicals (Tab3*, statistical outliers (Tab4) removed) (External validation set 2)

Links to External Resources