ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID00256
Compound Name10alpha,13alpha-dihydroxy-9alpha-methyl-15-oxo-20-nor-kauran-19-oic acid gamma-lactone
Chemical ClassUnknown
Molecular Weight332.439
logP2.442
H-Bond Donor1.00
H-Bond Acceptor6
Caco-2 Permeability1008.239
logSwat-3.710
Number of Primary Metabolites2
Polar Surface Area72.576
Rotatable Bonds1
logKhsa0.213
Number of Reactive Functional Groups0
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-2.905
Blood Brain Barrier (logBB)-0.330
CNS Permeability0
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations1
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol0588
NPACT   -
TaxKB   -
Structure Download

 






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