ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID00652
Compound NameSesamin
Chemical ClassOxygen heterocycles
Molecular Weight354.359
logP1.751
H-Bond Donor0.00
H-Bond Acceptor6
Caco-2 Permeability9906.038
logSwat-2.369
Number of Primary Metabolites4
Polar Surface Area54.607
Rotatable Bonds0
logKhsa-0.291
Number of Reactive Functional Groups2
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-4.178
Blood Brain Barrier (logBB)-2.172
CNS Permeability-2
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations1
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol2080
NPACT   -
TaxKB   -
Structure Download

 






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