ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID00482
Compound NamePectinolide C
Chemical ClassOxygen heterocycles
Molecular Weight268.309
logP1.501
H-Bond Donor1.00
H-Bond Acceptor7
Caco-2 Permeability341.957
logSwat-2.846
Number of Primary Metabolites3
Polar Surface Area96.317
Rotatable Bonds7
logKhsa-0.372
Number of Reactive Functional Groups2
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-4.428
Blood Brain Barrier (logBB)-1.294
CNS Permeability-2
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations0
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol1679
NPACT   -
TaxKB   -
Structure Download

 






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