ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID00836
Compound NameInonotusin A
Chemical ClassOxygen heterocycles
Molecular Weight290.272
logP0.620
H-Bond Donor3.00
H-Bond Acceptor7
Caco-2 Permeability88.880
logSwat-2.723
Number of Primary Metabolites4
Polar Surface Area123.509
Rotatable Bonds5
logKhsa-0.372
Number of Reactive Functional Groups1
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-4.288
Blood Brain Barrier (logBB)-1.643
CNS Permeability-2
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations0
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol2839
NPACT   -
TaxKB   -
Structure Download

 






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