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:71
Name:Acetone
Description:
Labels:
CAS:67-64-1
InChi Code:InChI=1S/C3H6O/c1-3(2)4/h1-2H3

Properties

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

ValueSource or prediction
2.59

experimental value

1.57

Table.8: Final model (Training set)

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