ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID03396
Compound NameBarbatin B
Chemical ClassTerpenoids
Molecular Weight574.669
logP4.091
H-Bond Donor1.00
H-Bond Acceptor9
Caco-2 Permeability440.308
logSwat-4.376
Number of Primary Metabolites4
Polar Surface Area115.888
Rotatable Bonds5
logKhsa0.653
Number of Reactive Functional Groups3
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-3.801
Blood Brain Barrier (logBB)-0.840
CNS Permeability-1
Lipinski's RO5 Violations1
Jorgensen's RO3 Violations0
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol2619
NPACT   -
TaxKB   -
Structure Download

 






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