ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID04084
Compound Name4-deoxyannoreticuin
Chemical ClassPolyketides
Molecular Weight580.887
logP7.552
H-Bond Donor3.00
H-Bond Acceptor10
Caco-2 Permeability290.778
logSwat-9.736
Number of Primary Metabolites6
Polar Surface Area110.972
Rotatable Bonds29
logKhsa1.217
Number of Reactive Functional Groups0
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-7.035
Blood Brain Barrier (logBB)-3.586
CNS Permeability-2
Lipinski's RO5 Violations2
Jorgensen's RO3 Violations1
Following Veber's ruleNo
Cross Reference
CancerHSP   -
NPACT   NPACT00157
TaxKB   -
Structure Download

 






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