ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID02962
Compound NameDiospyrin
Chemical ClassPolycyclic aromatic natural products
Molecular Weight374.349
logP1.288
H-Bond Donor0.00
H-Bond Acceptor8
Caco-2 Permeability37.403
logSwat-3.524
Number of Primary Metabolites4
Polar Surface Area149.984
Rotatable Bonds3
logKhsa-0.326
Number of Reactive Functional Groups0
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-5.245
Blood Brain Barrier (logBB)-2.076
CNS Permeability-2
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations0
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol1864
NPACT   -
TaxKB   -
Structure Download

 






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