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: | e103 | |
|---|---|---|
| Name: | dinoseb | |
| Description: | ||
| Labels: | Validation, 2 | |
| CAS: | 88-85-7 | |
| InChi Code: | InChI=1S/C10H12N2O5/c1-3-6(2)8-4-7(11(14)15)5-9(10(8)13)12(16)17/h4-6,13H,3H2,1-2H3 |
Properties
LogBCF: Fish bioconcentration factor as logBCF
| Value | Source or prediction |
|---|---|
| 0.38 |
experimental value |
| 1.1211 |
Tab2: Multilinear model for diverse chemicals (External validation set 2) |
| 1.1211 |
Tab3: Multilinear model for diverse chemicals (Tab3*, statistical outliers (Tab4) removed) (External validation set 2) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID3020207 | US EPA CompTox Dashboard |