ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID02350
Compound Name28-Nor-urs-12-ene-3beta,17beta-diol
Chemical ClassTerpenoids
Molecular Weight428.697
logP6.148
H-Bond Donor2.00
H-Bond Acceptor2
Caco-2 Permeability3082.154
logSwat-7.020
Number of Primary Metabolites4
Polar Surface Area36.617
Rotatable Bonds2
logKhsa1.637
Number of Reactive Functional Groups0
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-3.530
Blood Brain Barrier (logBB)-0.018
CNS Permeability0
Lipinski's RO5 Violations1
Jorgensen's RO3 Violations1
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol1076
NPACT   -
TaxKB   -
Structure Download

 






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