10967/223 - 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 abiotic degradation in air. Q13-22a-0034. Molcode Ltd., 2010.

Compound

ID:157
Name:anthracene
Description:
Labels:
CAS:120-12-7
InChi Code:InChI=1S/C14H10/c1-2-6-12-10-14-8-4-3-7-13(14)9-11(12)5-1/h1-10H

Properties

logT(0.5): Degradation half-life in air [log(h)]

ValueSource or prediction
1.74

experimental value

1.53

QSAR: Model for degradation half-life (Training set)