ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID03186
Compound Name13-O-acetyl-4-deoxy-4alpha-phorbol-20-oleate
Chemical ClassTerpenoids
Molecular Weight654.926
logP8.463
H-Bond Donor2.00
H-Bond Acceptor8
Caco-2 Permeability185.554
logSwat-11.040
Number of Primary Metabolites11
Polar Surface Area132.031
Rotatable Bonds20
logKhsa2.096
Number of Reactive Functional Groups2
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-6.509
Blood Brain Barrier (logBB)-3.086
CNS Permeability-2
Lipinski's RO5 Violations2
Jorgensen's RO3 Violations2
Following Veber's ruleNo
Cross Reference
CancerHSP   Mol2276
NPACT   -
TaxKB   -
Structure Download

 






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