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:140
Name:benzo[k]fluoranthene
Description:
Labels:
CAS:207-08-9
InChi Code:InChI=1S/C20H12/c1-2-6-15-12-19-17-10-4-8-13-7-3-9-16(20(13)17)18(19)11-14(15)5-1/h1-12H

Properties

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

ValueSource or prediction
2.23

experimental value

1.76

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