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:383
Name:Methiocarb
Description:
Labels:training, Phenylcarbamates
CAS:2032-65-7
InChi Code:InChI=1S/C11H15NO2S/c1-7-5-9(14-11(13)12-3)6-8(2)10(7)15-4/h5-6H,1-4H3,(H,12,13)

Properties

logKoc: Logarithm of soil sorption coefficient i

ValueSource or prediction
2.32

experimental value

2.54

Eq1: Linear correlation with logP (Training set)

2.44

Eq2: Non-linear regression model (Training set)

2.44

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

Links to External Resources