Ellison, C.M.; Cronin, M.T.D.; Madden, J.C.; Schultz, T.W. Definition of the structural domain of the baseline non-polar narcosis model for Tetrahymena pyriformis. SAR QSAR Environ. Res. 2008, 19, 7-8, 751–783.
Compound
| ID: | 52 | |
|---|---|---|
| Name: | Isoborneol | |
| Description: | InChI code was generated with Jchem for Excel | |
| Labels: | ||
| CAS: | 124-76-5 | |
| InChi Code: | InChI=1S/C10H18O/c1-9(2)7-4-5-10(9,3)8(11)6-7/h7-8,11H,4-6H2,1-3H3/t7-,8+,10-/m1/s1 |
Properties
pIGC50: 40-h Tetrahymena toxicity as log(1/IGC50) [log(L/mmol)]
| Value | Source or prediction |
|---|---|
| 0.15 |
experimental value |
| 0.21 |
Eq2: Saturated alcohols and ketones (Training set) |
| 0.28 |
QMRF: Saturated alcohols and ketones (Training set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID2042060 | US EPA CompTox Dashboard |