ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID00562
Compound NameDemethylracemosol
Chemical ClassSimple aromatic natural products
Molecular Weight326.391
logP3.202
H-Bond Donor3.00
H-Bond Acceptor3
Caco-2 Permeability527.752
logSwat-4.542
Number of Primary Metabolites7
Polar Surface Area69.026
Rotatable Bonds3
logKhsa0.487
Number of Reactive Functional Groups0
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-4.265
Blood Brain Barrier (logBB)-0.803
CNS Permeability-1
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations0
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol1904
NPACT   -
TaxKB   -
Structure Download

 






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