ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID00549
Compound NameAnthragallol
Chemical ClassTerpenoids
Molecular Weight256.214
logP0.488
H-Bond Donor2.00
H-Bond Acceptor5
Caco-2 Permeability80.231
logSwat-2.298
Number of Primary Metabolites3
Polar Surface Area116.347
Rotatable Bonds3
logKhsa-0.393
Number of Reactive Functional Groups0
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-4.356
Blood Brain Barrier (logBB)-1.465
CNS Permeability-2
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations1
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol1882
NPACT   -
TaxKB   -
Structure Download

 






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