10967/228 - QDB Compounds

QsarDB Repository

Tulp, I.; Tamm, T.; Dobchev, D.; Martin, D.; Karelson, G.; Jänes, J.; Tämm, K.; Härk, E.; Savchenko, D.; Kreegipuu, A.; Karelson, M. QSAR for the soil adsorption coefficient Koc. Q13-26-0009. 2009.

Compound

ID:78
Name:N-(3,5-Dimethylphenyl)-N',N'-dimethylurea
Description:
Labels:
CAS:36627-56-2
InChi Code:InChI=1S/C11H16N2O/c1-8-5-9(2)7-10(6-8)12-11(14)13(3)4/h5-7H,1-4H3,(H,12,14)

Properties

logKoc: Logarithm of soil sorption coefficient

ValueSource or prediction
1.73

experimental value

1.41

QSAR: Model for soil sorption (Training set)