ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID02881
Compound NameMangostanin
Chemical ClassSimple aromatic natural products
Molecular Weight440.492
logP4.936
H-Bond Donor2.00
H-Bond Acceptor5
Caco-2 Permeability694.306
logSwat-6.509
Number of Primary Metabolites8
Polar Surface Area104.306
Rotatable Bonds9
logKhsa0.918
Number of Reactive Functional Groups0
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-5.433
Blood Brain Barrier (logBB)-1.260
CNS Permeability-2
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations2
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol1763
NPACT   -
TaxKB   -
Structure Download

 






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