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:83
Name:3-methylsulfanylpropanal
Description:
Labels:tested_1998, Training
CAS:3268-49-3
InChi Code:InChI=1S/C4H8OS/c1-6-4-2-3-5/h3H,2,4H2,1H3

Properties

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

ValueSource or prediction
1.84173478

experimental value

1.810569

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