ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID00433
Compound NameDesacetylbufotalin
Chemical ClassCarbohydrates
Molecular Weight402.530
logP2.664
H-Bond Donor3.00
H-Bond Acceptor7
Caco-2 Permeability249.442
logSwat-4.599
Number of Primary Metabolites4
Polar Surface Area96.172
Rotatable Bonds3
logKhsa0.417
Number of Reactive Functional Groups1
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-3.859
Blood Brain Barrier (logBB)-1.070
CNS Permeability-2
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations0
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol1382
NPACT   -
TaxKB   -
Structure Download

 






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