ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID01061
Compound Name9-beta-hydroxyparthenolide
Chemical ClassTerpenoids
Molecular Weight280.320
logP0.343
H-Bond Donor1.00
H-Bond Acceptor9
Caco-2 Permeability1102.044
logSwat-1.155
Number of Primary Metabolites2
Polar Surface Area87.368
Rotatable Bonds2
logKhsa-0.726
Number of Reactive Functional Groups2
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-2.037
Blood Brain Barrier (logBB)-0.258
CNS Permeability-1
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations1
Following Veber's ruleYes
Cross Reference
CancerHSP   -
NPACT   NPACT00209
TaxKB   -
Structure Download

 






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