ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID01546
Compound Name 9alpha, 10beta-Diacetyltaxicin I
Chemical ClassTerpenoids
Molecular Weight478.581
logP2.312
H-Bond Donor3.00
H-Bond Acceptor10
Caco-2 Permeability73.343
logSwat-4.712
Number of Primary Metabolites7
Polar Surface Area146.349
Rotatable Bonds7
logKhsa0.248
Number of Reactive Functional Groups2
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-4.114
Blood Brain Barrier (logBB)-1.949
CNS Permeability-2
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations1
Following Veber's ruleNo
Cross Reference
CancerHSP   -
NPACT   -
TaxKB   109
Structure Download

 






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