ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID04493
Compound NameLinalool
Chemical ClassTerpenoids
Molecular Weight154.252
logP3.171
H-Bond Donor1.00
H-Bond Acceptor1
Caco-2 Permeability5538.013
logSwat-2.996
Number of Primary Metabolites4
Polar Surface Area18.641
Rotatable Bonds5
logKhsa0.140
Number of Reactive Functional Groups0
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-3.631
Blood Brain Barrier (logBB)0.035
CNS Permeability1
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations0
Following Veber's ruleYes
Cross Reference
CancerHSP   -
NPACT   NPACT00714
TaxKB   -
Structure Download

 






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