ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID00735
Compound Name20S)-5-ergostene-3beta,7alpha,16beta,20-tetrol
Chemical ClassSteroids
Molecular Weight448.685
logP4.559
H-Bond Donor4.00
H-Bond Acceptor6
Caco-2 Permeability467.763
logSwat-5.991
Number of Primary Metabolites5
Polar Surface Area78.056
Rotatable Bonds9
logKhsa0.858
Number of Reactive Functional Groups0
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-4.505
Blood Brain Barrier (logBB)-1.354
CNS Permeability-2
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations0
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol2337
NPACT   -
TaxKB   -
Structure Download

 






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