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:91
Name:4-phenylazophenol
Description:
Labels:
CAS:1689-82-3
InChi Code:InChI=1S/C12H10N2O/c15-12-8-6-11(7-9-12)14-13-10-4-2-1-3-5-10/h1-9,15H

Properties

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

ValueSource or prediction
2.16

experimental value

1.581

QSAR: Model for algal toxicity (Test set)