ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID02165
Compound Name3beta-Hydroxylcycloart-24-one
Chemical ClassTerpenoids
Molecular Weight442.724
logP6.643
H-Bond Donor1.00
H-Bond Acceptor4
Caco-2 Permeability1998.831
logSwat-7.782
Number of Primary Metabolites3
Polar Surface Area45.703
Rotatable Bonds6
logKhsa1.735
Number of Reactive Functional Groups1
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-4.254
Blood Brain Barrier (logBB)-0.504
CNS Permeability0
Lipinski's RO5 Violations1
Jorgensen's RO3 Violations1
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol0849
NPACT   -
TaxKB   -
Structure Download

 






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