ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID02772
Compound Namecis-Annoreticuin
Chemical ClassPolyketides
Molecular Weight596.886
logP6.716
H-Bond Donor4.00
H-Bond Acceptor12
Caco-2 Permeability91.860
logSwat-9.872
Number of Primary Metabolites7
Polar Surface Area130.408
Rotatable Bonds30
logKhsa0.929
Number of Reactive Functional Groups0
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-7.266
Blood Brain Barrier (logBB)-4.611
CNS Permeability-2
Lipinski's RO5 Violations2
Jorgensen's RO3 Violations2
Following Veber's ruleNo
Cross Reference
CancerHSP   Mol1601
NPACT   -
TaxKB   -
Structure Download

 






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