ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID01453
Compound Name 1-acetoxy-5-deacetylbaccatin I
Chemical ClassTerpenoids
Molecular Weight736.852
logP3.672
H-Bond Donor1.00
H-Bond Acceptor16
Caco-2 Permeability7.381
logSwat-6.319
Number of Primary Metabolites4
Polar Surface Area239.247
Rotatable Bonds13
logKhsa0.545
Number of Reactive Functional Groups7
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-4.977
Blood Brain Barrier (logBB)-3.770
CNS Permeability-2
Lipinski's RO5 Violations2
Jorgensen's RO3 Violations2
Following Veber's ruleNo
Cross Reference
CancerHSP   -
NPACT   -
TaxKB   11
Structure Download

 






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