ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID00434
Compound NameDesacetylcinobufagin
Chemical ClassCarbohydrates
Molecular Weight400.514
logP2.307
H-Bond Donor2.00
H-Bond Acceptor8
Caco-2 Permeability293.193
logSwat-4.372
Number of Primary Metabolites3
Polar Surface Area93.025
Rotatable Bonds2
logKhsa0.256
Number of Reactive Functional Groups2
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-3.851
Blood Brain Barrier (logBB)-0.943
CNS Permeability-1
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations0
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol1383
NPACT   -
TaxKB   -
Structure Download

 






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