ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID00281
Compound Nameisodonoiol
Chemical ClassTerpenoids
Molecular Weight406.475
logP1.195
H-Bond Donor2.00
H-Bond Acceptor10
Caco-2 Permeability161.597
logSwat-2.814
Number of Primary Metabolites3
Polar Surface Area131.868
Rotatable Bonds6
logKhsa-0.278
Number of Reactive Functional Groups1
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-3.240
Blood Brain Barrier (logBB)-1.337
CNS Permeability-2
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations0
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol0614
NPACT   -
TaxKB   -
Structure Download

 






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