10967/200 - QDB Compounds

QsarDB Repository

Katritzky, A. R.; Kasemets, K.; Slavov, S.; Radzvilovits, M.; Tämm, K.; Karelson, M. Estimating the toxicities of organic chemicals in activated sludge process. Water Res. 2010, 44, 2451–2460.

Compound

ID:27
Name:Cyclohexane
Description:
Labels:
CAS:110-82-7
InChi Code:InChI=1S/C6H12/c1-2-4-6-5-3-1/h1-6H2

Properties

logEC50: Bioluminescent Shk1 aquatic toxicity as logEC50 [log(mmol/L)] i

ValueSource or prediction
0.05

experimental value

0.37

Table.8: Final model (Training set)

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