10967/167 - QDB Compounds

QsarDB Repository

Mombelli, E.; Pery, A. R. R. A Linear Model to Predict Chronic Effects of Chemicals on Daphnia magna. Bull. Environ. Contam. Toxicol. 2011, 87, 494–498.

Compound

ID:211
Name:1,4-dimethyl-2-(1-phenylethyl)benzene
Description:
Labels:tested_1999, Test
CAS:6165-51-1
InChi Code:InChI=1S/C16H18/c1-12-9-10-13(2)16(11-12)14(3)15-7-5-4-6-8-15/h4-11,14H,1-3H3

Properties

pEC50_chronic: 21-day chronic Daphnia toxicity as log(1/EC50) [log(L/mmol)] i

ValueSource or prediction
3.43643114

experimental value

3.337204

Tab1: QAAR with acute toxicity to Daphnia (Validation set)