ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID03891
Compound Nameschiprolactone B
Chemical ClassSteroids
Molecular Weight466.659
logP5.166
H-Bond Donor0.00
H-Bond Acceptor6
Caco-2 Permeability829.504
logSwat-6.662
Number of Primary Metabolites2
Polar Surface Area75.207
Rotatable Bonds2
logKhsa1.168
Number of Reactive Functional Groups2
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-4.201
Blood Brain Barrier (logBB)-0.610
CNS Permeability0
Lipinski's RO5 Violations1
Jorgensen's RO3 Violations1
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol3564
NPACT   -
TaxKB   -
Structure Download

 






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