Schultz, T.W.; Netzeva, T.I.; Cronin, M.T.D. Selection of data sets for qsars: analyses of tetrahymena toxicity from aromatic compounds. SAR QSAR Environ. Res. 2003, 14, 1, 59–81.
Compound
| ID: | 331 | |
|---|---|---|
| Name: | Phenyl isothiocyanate | |
| Description: | ||
| Labels: | ||
| CAS: | 103-72-0 | |
| InChi Code: |
Properties
pIGC50: 40-h Tetrahymena toxicity as log(1/IGC50) [log(L/mmol)]
| Value | Source or prediction |
|---|---|
| 1.41 |
experimental value |
| 1.58 |
2: All compounds (Training) |
| 1.75 |
4: Training compounds (n = 15) (Training) |
| 1.69 |
5: Training compounds (n = 20) (Training) |
| 1.59 |
6: Training compounds (n = 25) (Training) |
| 1.70 |
7: Training compounds (n = 30) (Training) |
| 1.66 |
8: Training compounds (n = 35) (Training) |
| 1.62 |
9: Training compounds (n = 40) (Training) |
| 1.62 |
10: Training compounds (n = 45) (Training) |
| 1.64 |
11: Training compounds (n = 50) (Training) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID0021129 | US EPA CompTox Dashboard |