ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID04661
Compound NameSquamocin
Chemical ClassPolyketides
Molecular Weight618.979
logP10.178
H-Bond Donor1.00
H-Bond Acceptor8
Caco-2 Permeability1558.792
logSwat-12.435
Number of Primary Metabolites5
Polar Surface Area76.337
Rotatable Bonds25
logKhsa2.329
Number of Reactive Functional Groups0
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-7.056
Blood Brain Barrier (logBB)-2.207
CNS Permeability-2
Lipinski's RO5 Violations2
Jorgensen's RO3 Violations1
Following Veber's ruleNo
Cross Reference
CancerHSP   -
NPACT   NPACT00955
TaxKB   -
Structure Download

 






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