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:16
Name:methyl methacrylate
Description:
Labels:
CAS:80-62-6
InChi Code:InChI=1S/C5H8O2/c1-4(2)5(6)7-3/h1H2,2-3H3

Properties

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

ValueSource or prediction
-2.24

experimental value

-2.319

QSAR: Model for algal toxicity (Training set)