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:119
Name:Propyl-N-phenylcarbamate
Description:
Labels:
CAS:5532-90-1
InChi Code:InChI=1S/C10H13NO2/c1-2-8-13-10(12)11-9-6-4-3-5-7-9/h3-7H,2,8H2,1H3,(H,11,12)

Properties

logKoc: Logarithm of soil sorption coefficient

ValueSource or prediction
2.06

experimental value

1.84

QSAR: Model for soil sorption (Test set)