ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID01489
Compound Name 2-deacetyltaxine A
Chemical ClassTerpenoids
Molecular Weight516.503
logP1.520
H-Bond Donor1.00
H-Bond Acceptor12
Caco-2 Permeability389.062
logSwat-2.947
Number of Primary Metabolites10
Polar Surface Area122.701
Rotatable Bonds2
logKhsa-0.316
Number of Reactive Functional Groups5
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-3.774
Blood Brain Barrier (logBB)-0.742
CNS Permeability-1
Lipinski's RO5 Violations1
Jorgensen's RO3 Violations1
Following Veber's ruleYes
Cross Reference
CancerHSP   -
NPACT   -
TaxKB   49
Structure Download

 






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