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:151
Name:N-(1,3-benzothiazol-2-ylsulfanyl)cyclohexanamine
Description:
Labels:tested_1996, Training
CAS:95-33-0
InChi Code:InChI=1S/C13H16N2S2/c1-2-6-10(7-3-1)15-17-13-14-11-8-4-5-9-12(11)16-13/h4-5,8-10,15H,1-3,6-7H2

Properties

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

ValueSource or prediction
3.34316233

experimental value

2.990895

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

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