10967/177 - QDB Compounds

QsarDB Repository

Gramatica, P.; Cassani, S.; Chirico, N. QSARINS-chem: Insubria datasets and new QSAR/QSPR models for environmental pollutants in QSARINS. J. Comput. Chem. 2014, 35, 1036–1044.

Compound

ID:564
Name:cyclooctane
Description:IUPAC names and InChI codes were generated with InstantJChem Original name was: cyclo-octane
Labels:
CAS:292-64-8
InChi Code:InChI=1S/C8H16/c1-2-4-6-8-7-5-3-1/h1-8H2

Properties

M3.GHLI: Global half-life index i

ValueSource or prediction
-0.47674

experimental value

-0.3898

Tab2.Model_3: Global half-life index (Training set)

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