10967/159 - QDB Compounds

QsarDB Repository

Wen, Y.; Su, L. M.; Qin, W. C.; Fu, L.; He, J.; Zhao, Y. H. Linear and non-linear relationships between soil sorption and hydrophobicity: Model, validation and influencing factors. Chemosphere 2012, 86, 634–640.

Compound

ID:488
Name:Terbufos
Description:
Labels:training, Organic_phosphides
CAS:13071-79-9
InChi Code:InChI=1S/C9H21O2PS3/c1-6-10-12(13,11-7-2)15-8-14-9(3,4)5/h6-8H2,1-5H3

Properties

logKoc: Logarithm of soil sorption coefficient i

ValueSource or prediction
2.82

experimental value

3.65

Eq1: Linear correlation with logP (Training set)

3.61

Eq2: Non-linear regression model (Training set)

3.61

Eq3: Non-linear regression model with correction factors (Training set)

Links to External Resources