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:69
Name:fenthion
Description:
Labels:
CAS:55-38-9
InChi Code:InChI=1S/C10H15O3PS2/c1-8-7-9(5-6-10(8)16-4)13-14(15,11-2)12-3/h5-7H,1-4H3

Properties

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

ValueSource or prediction
1.56

experimental value

1.302

QSAR: Model for algal toxicity (Training set)