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:173
Name:1-(chloromethyl)-4-nitrobenzene
Description:
Labels:tested_2000, Test
CAS:100-14-1
InChi Code:InChI=1S/C7H6ClNO2/c8-5-6-1-3-7(4-2-6)9(10)11/h1-4H,5H2

Properties

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

ValueSource or prediction
2.5102161

experimental value

2.587438

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

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