ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID03736
Compound Namecheliensisin A
Chemical ClassOrganic Chemicals
Molecular Weight274.273
logP1.255
H-Bond Donor0.00
H-Bond Acceptor7
Caco-2 Permeability879.076
logSwat-2.356
Number of Primary Metabolites3
Polar Surface Area87.885
Rotatable Bonds1
logKhsa-0.702
Number of Reactive Functional Groups3
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-5.149
Blood Brain Barrier (logBB)-0.513
CNS Permeability0
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations0
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol3223
NPACT   -
TaxKB   -
Structure Download

 






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