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:345
Name:Metoxuron
Description:
Labels:training, Phenylureas_and_methylureas
CAS:19937-59-8
InChi Code:InChI=1S/C10H13ClN2O2/c1-13(2)10(14)12-7-4-5-9(15-3)8(11)6-7/h4-6H,1-3H3,(H,12,14)

Properties

logKoc: Logarithm of soil sorption coefficient i

ValueSource or prediction
1.72

experimental value

2.05

Eq1: Linear correlation with logP (Training set)

2.03

Eq2: Non-linear regression model (Training set)

2.03

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

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