OPERA Models: Henry's Law

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1,3,4-Oxadiazol-2-ol, 5-(4-pyridinyl)-
2845-82-1 | DTXSID10182649

Model Results

Predicted value: 7.02e-10 atm-m3/mole

Global applicability domain:  Inside

Local applicability domain index: 0.3

Confidence level: 0.4

Model Performance

QMRF

Weighted KNN model

5-fold CV (75%) Training (75%) Test (25%)
Q2 Q2 R2 R2 R2 R2
0.84 0.89 0.84 0.88 0.85 0.75

Nearest Neighbors from the Training Set

Pyruvic acid

Measured: 3.23e-09

Predicted: 6.65e-09

Tebuthiuron

Measured: 1.20e-10

Predicted: 1.38e-10

Methiocarb

Measured: 1.18e-09

Predicted: 1.37e-09

Benzamide

Measured: 2.45e-10

Predicted: 5.95e-10

Propamocarb

Measured: 1.48e-09

Predicted: 1.83e-09