ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID02982
Compound NameAnticancer Phenylphenalone PMV70-P691-130
Chemical ClassPolycyclic aromatic natural products
Molecular Weight288.302
logP2.758
H-Bond Donor2.00
H-Bond Acceptor4
Caco-2 Permeability517.700
logSwat-3.880
Number of Primary Metabolites2
Polar Surface Area69.951
Rotatable Bonds3
logKhsa0.193
Number of Reactive Functional Groups0
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-5.552
Blood Brain Barrier (logBB)-0.823
CNS Permeability-1
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations0
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol1903
NPACT   -
TaxKB   -
Structure Download

 






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