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:78
Name:S-[(4-chlorophenyl)methyl] diethylaminomethanethioate
Description:
Labels:tested_1997, Training
CAS:28249-77-6
InChi Code:InChI=1S/C12H16ClNOS/c1-3-14(4-2)12(15)16-9-10-5-7-11(13)8-6-10/h5-8H,3-4,9H2,1-2H3

Properties

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

ValueSource or prediction
2.678906

experimental value

2.794183

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