ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID03179
Compound Name12-O-tiglylphorbol-13-(2-methyl)butyrate
Chemical ClassTerpenoids
Molecular Weight530.657
logP3.958
H-Bond Donor3.00
H-Bond Acceptor9
Caco-2 Permeability223.365
logSwat-5.609
Number of Primary Metabolites10
Polar Surface Area137.928
Rotatable Bonds9
logKhsa0.688
Number of Reactive Functional Groups2
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-4.313
Blood Brain Barrier (logBB)-1.630
CNS Permeability-2
Lipinski's RO5 Violations1
Jorgensen's RO3 Violations1
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol2266
NPACT   -
TaxKB   -
Structure Download

 






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