ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID02932
Compound NameAnticancer Diarylheptanoid PMV70-P691-010
Chemical ClassOrganic Chemicals
Molecular Weight324.376
logP3.459
H-Bond Donor2.00
H-Bond Acceptor4
Caco-2 Permeability904.981
logSwat-4.978
Number of Primary Metabolites7
Polar Surface Area60.493
Rotatable Bonds3
logKhsa0.463
Number of Reactive Functional Groups0
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-5.457
Blood Brain Barrier (logBB)-0.663
CNS Permeability0
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations1
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol1829
NPACT   -
TaxKB   -
Structure Download

 






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