ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID01680
Compound Name Yunnanxol
Chemical ClassTerpenoids
Molecular Weight750.795
logP2.427
H-Bond Donor3.00
H-Bond Acceptor17
Caco-2 Permeability41.844
logSwat-3.468
Number of Primary Metabolites8
Polar Surface Area220.159
Rotatable Bonds12
logKhsa-0.034
Number of Reactive Functional Groups4
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-4.630
Blood Brain Barrier (logBB)-2.309
CNS Permeability-2
Lipinski's RO5 Violations2
Jorgensen's RO3 Violations1
Following Veber's ruleNo
Cross Reference
CancerHSP   -
NPACT   -
TaxKB   254
Structure Download

 






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