10967/76 - QDB Compounds

QsarDB Repository

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:373
Name:4-Chlorophenethyl alcohol
Description:InChI code was generated with Jchem for Excel
Labels:Phenethyl, alcohol
CAS:1875-88-3
InChi Code:InChI=1S/C8H9ClO/c9-8-3-1-7(2-4-8)5-6-10/h1-4,10H,5-6H2

Properties

pIGC50: 40-h Tetrahymena toxicity as log(1/IGC50) [log(L/mmol)]

ValueSource or prediction
0.32

experimental value

-0.29

Eq2: Saturated alcohols and ketones (Test set)