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: | e8 | |
|---|---|---|
| Name: | fenthion | |
| Description: | ||
| Labels: | Validation, 2 | |
| CAS: | 55-38-9 | |
| InChi Code: | InChI=1S/C10H15O3PS2/c1-8-7-9(5-6-10(8)16-4)13-14(15,11-2)12-3/h5-7H,1-4H3 |
Properties
LogBCF: Fish bioconcentration factor as logBCF
| Value | Source or prediction |
|---|---|
| 2.07 |
experimental value |
| 1.6600 |
Tab2: Multilinear model for diverse chemicals (External validation set 2) |
| 1.6600 |
Tab3: Multilinear model for diverse chemicals (Tab3*, statistical outliers (Tab4) removed) (External validation set 2) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID8020620 | US EPA CompTox Dashboard |