ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID02340
Compound NameCelastrol
Chemical ClassTerpenoids
Molecular Weight450.617
logP5.047
H-Bond Donor2.00
H-Bond Acceptor5
Caco-2 Permeability73.551
logSwat-6.378
Number of Primary Metabolites2
Polar Surface Area89.289
Rotatable Bonds2
logKhsa1.058
Number of Reactive Functional Groups0
Number of Amides0
Number of Amines0
Number of Acids1
loghERG-2.098
Blood Brain Barrier (logBB)-0.974
CNS Permeability-1
Lipinski's RO5 Violations1
Jorgensen's RO3 Violations1
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol1062
NPACT   -
TaxKB   -
Structure Download

 






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