ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID00757
Compound Name3-oxo-24,25,26,27-tetranortirucall-7-ene-23(21)-lactone
Chemical ClassOrganic Chemicals
Molecular Weight398.584
logP4.153
H-Bond Donor0.00
H-Bond Acceptor5
Caco-2 Permeability923.899
logSwat-5.447
Number of Primary Metabolites4
Polar Surface Area67.502
Rotatable Bonds0
logKhsa0.854
Number of Reactive Functional Groups1
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-3.398
Blood Brain Barrier (logBB)-0.354
CNS Permeability0
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations0
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol2427
NPACT   -
TaxKB   -
Structure Download

 






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