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: | t449 | |
|---|---|---|
| Name: | dimethoxyphosphoryloxybenzene | |
| Description: | ||
| Labels: | Training | |
| CAS: | 10113-28-7 | |
| InChi Code: | InChI=1S/C8H11O4P/c1-10-13(9,11-2)12-8-6-4-3-5-7-8/h3-7H,1-2H3 |
Properties
LogBCF: Fish bioconcentration factor as logBCF
| Value | Source or prediction |
|---|---|
| 2.76 |
experimental value |
| 0.3453 |
Tab2: Multilinear model for diverse chemicals (Training set) |