10967/222 - QDB Compounds

QsarDB Repository

Tulp, I.; Tamm, T.; Karelson, G.; Dobchev, D.; Martin, D.; Tämm, K.; Savchenko, D.; Jänes, J.; Härk, E.; Kreegipuu, A.; Karelson, M. QSAR for algae toxicity of benzene derivatives. Q13-32-0028. Molcode Ltd., 2009.

Compound

ID:46
Name:2,6-dichlorobenzaldehyde
Description:
Labels:
CAS:83-38-5
InChi Code:InChI=1S/C7H4Cl2O/c8-6-2-1-3-7(9)5(6)4-10/h1-4H

Properties

pEC50: Algal toxicity as log(1/EC50) [mM]

ValueSource or prediction
1.5

experimental value

0.728

QSAR: Model for algal toxicity (Training set)