Moosus, M.; Maran, U. Quantitative structure-activity relationship analysis of acute toxicity of diverse chemicals to Daphnia magna with whole molecule descriptors. SAR QSAR Environ. Res. 2011, 22, 7-8, 757–774.
Compound
| ID: | 42 | |
|---|---|---|
| Name: | Pentanoic acid | |
| Description: | ||
| Labels: | Training | |
| CAS: | 109-52-4 | |
| InChi Code: | InChI=1S/C5H10O2/c1-2-3-4-5(6)7/h2-4H2,1H3,(H,6,7) |
Properties
logLC50: 48-h Daphnia toxicity as log(LC50) [log(mol/L)]
| Value | Source or prediction |
|---|---|
| -3.356 |
experimental value |
| -2.3262 |
Tab2: Model for diverse chemicals (Training set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID7021655 | US EPA CompTox Dashboard |