ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID01451
Compound Name 1,10beta-Dihydroxy-2alpha,9alpha-diacetoxy-5alpha-cinnamoyltaxa-4(20), 11 diene-13-one
Chemical ClassTerpenoids
Molecular Weight608.727
logP4.992
H-Bond Donor2.00
H-Bond Acceptor10
Caco-2 Permeability338.101
logSwat-6.198
Number of Primary Metabolites7
Polar Surface Area148.519
Rotatable Bonds10
logKhsa0.885
Number of Reactive Functional Groups3
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-5.218
Blood Brain Barrier (logBB)-1.548
CNS Permeability-2
Lipinski's RO5 Violations1
Jorgensen's RO3 Violations2
Following Veber's ruleYes
Cross Reference
CancerHSP   -
NPACT   -
TaxKB   9
Structure Download

 






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