ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID01549
Compound Name 9-Deacetylbaccatin VI
Chemical ClassTerpenoids
Molecular Weight672.725
logP2.705
H-Bond Donor2.00
H-Bond Acceptor14
Caco-2 Permeability68.702
logSwat-4.144
Number of Primary Metabolites5
Polar Surface Area199.678
Rotatable Bonds8
logKhsa0.187
Number of Reactive Functional Groups5
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-4.236
Blood Brain Barrier (logBB)-1.881
CNS Permeability-2
Lipinski's RO5 Violations2
Jorgensen's RO3 Violations0
Following Veber's ruleNo
Cross Reference
CancerHSP   -
NPACT   -
TaxKB   113
Structure Download

 






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