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:198
Name:Dicamba
Description:
Labels:training, Organic_acids
CAS:1918-00-9
InChi Code:InChI=1S/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)

Properties

logKoc: Logarithm of soil sorption coefficient i

ValueSource or prediction
1.5

experimental value

2.2

Eq1: Linear correlation with logP (Training set)

2.15

Eq2: Non-linear regression model (Training set)

1.75

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

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