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:686
Name:Diphenamid
Description:
Labels:validation, Other_compounds
CAS:957-51-7
InChi Code:InChI=1S/C16H17NO/c1-17(2)16(18)15(13-9-5-3-6-10-13)14-11-7-4-8-12-14/h3-12,15H,1-2H3

Properties

logKoc: Logarithm of soil sorption coefficient i

ValueSource or prediction
2.32

experimental value

2.33

Eq1: Linear correlation with logP (Validation set)

2.25

Eq2: Non-linear regression model (Validation set)

2.25

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

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