ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID03439
Compound NameDL-Amygdalin
Chemical ClassCarbohydrates
Molecular Weight457.433
logP-2.971
H-Bond Donor7.00
H-Bond Acceptor20
Caco-2 Permeability4.096
logSwat-2.654
Number of Primary Metabolites9
Polar Surface Area208.913
Rotatable Bonds15
logKhsa-1.715
Number of Reactive Functional Groups2
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-5.871
Blood Brain Barrier (logBB)-4.152
CNS Permeability-2
Lipinski's RO5 Violations2
Jorgensen's RO3 Violations2
Following Veber's ruleNo
Cross Reference
CancerHSP   Mol2704
NPACT   -
TaxKB   -
Structure Download

 






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