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:468
Name:Cyromazine
Description:
Labels:training, Symtriazines
CAS:66215-27-8
InChi Code:InChI=1S/C6H10N6/c7-4-10-5(8)12-6(11-4)9-3-1-2-3/h3H,1-2H2,(H5,7,8,9,10,11,12)

Properties

logKoc: Logarithm of soil sorption coefficient i

ValueSource or prediction
2.3

experimental value

1.25

Eq1: Linear correlation with logP (Training set)

1.47

Eq2: Non-linear regression model (Training set)

1.47

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

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