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:503
Name:cyclohexanamine
Description:IUPAC names and InChI codes were generated with InstantJChem Original name was: cyclohexanamine
Labels:
CAS:108-91-8
InChi Code:InChI=1S/C6H13N/c7-6-4-2-1-3-5-6/h6H,1-5,7H2

Properties

M3.GHLI: Global half-life index i

ValueSource or prediction
-2.79419

experimental value

-2.0606

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

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