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: | 46 | |
|---|---|---|
| Name: | Phenyl thiourea | |
| Description: | ||
| Labels: | Training | |
| CAS: | 103-85-5 | |
| InChi Code: | InChI=1S/C7H8N2S/c8-7(10)9-6-4-2-1-3-5-6/h1-5H,(H3,8,9,10) |
Properties
logLC50: 48-h Daphnia toxicity as log(LC50) [log(mol/L)]
| Value | Source or prediction |
|---|---|
| -3.412 |
experimental value |
| -4.1753 |
Tab2: Model for diverse chemicals (Training set) |