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:43
Name:2-methyl-5-nitrobenzenesulfonic acid
Description:
Labels:tested_1997, Training
CAS:121-03-9
InChi Code:InChI=1S/C7H7NO5S/c1-5-2-3-6(8(9)10)4-7(5)14(11,12)13/h2-4H,1H3,(H,11,12,13)

Properties

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

ValueSource or prediction
0.58871178

experimental value

0.999412

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

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