Schultz, T.W.; Hewitt, M.; Netzeva, T.I.; Cronin, M.T.D. Assessing Applicability Domains of Toxicological QSARs: Definition, Confidence in Predicted Values, and the Role of Mechanisms of Action. QSAR Comb. Sci. 2007, 26, 2, 238–254.
Compound
| ID: | 404 | |
|---|---|---|
| Name: | Methyl-4-cyanobenzoate | |
| Description: | ||
| Labels: | validation | |
| CAS: | 1129-35-7 | |
| InChi Code: |
Properties
MOA: Mode of action
| Value | Source or prediction |
|---|---|
| Non-narcotic |
experimental value |
pIGC50: 40-h Tetrahymena toxicity as log(1/IGC50) [log(L/mmol)]
| Value | Source or prediction |
|---|---|
| -0.05 |
experimental value |
| 0.18 |
1: Aromatic compounds (Validation) |