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: | 222 | |
|---|---|---|
| Name: | Methylene thiocyanate | |
| Description: | ||
| Labels: | Training | |
| CAS: | 6317-18-6 | |
| InChi Code: | InChI=1S/C3H2N2S2/c4-1-6-3-7-2-5/h3H2 |
Properties
logLC50: 48-h Daphnia toxicity as log(LC50) [log(mol/L)]
| Value | Source or prediction |
|---|---|
| -6.251 |
experimental value |
| -4.0158 |
Tab2: Model for diverse chemicals (Training set) |