ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID00564
Compound NameDemethylmoracin I
Chemical ClassBenzofuranoids
Molecular Weight310.349
logP3.110
H-Bond Donor3.00
H-Bond Acceptor3
Caco-2 Permeability363.050
logSwat-4.143
Number of Primary Metabolites7
Polar Surface Area72.945
Rotatable Bonds5
logKhsa0.350
Number of Reactive Functional Groups0
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-4.931
Blood Brain Barrier (logBB)-1.095
CNS Permeability-2
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations0
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol1913
NPACT   -
TaxKB   -
Structure Download

 






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