ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID04806
Compound NameChlorogenic acid
Chemical ClassOrganic Chemicals
Molecular Weight354.313
logP-0.265
H-Bond Donor6.00
H-Bond Acceptor10
Caco-2 Permeability1.524
logSwat-2.617
Number of Primary Metabolites5
Polar Surface Area187.769
Rotatable Bonds10
logKhsa-0.923
Number of Reactive Functional Groups1
Number of Amides0
Number of Amines0
Number of Acids1
loghERG-3.397
Blood Brain Barrier (logBB)-3.433
CNS Permeability-2
Lipinski's RO5 Violations1
Jorgensen's RO3 Violations1
Following Veber's ruleNo
Cross Reference
CancerHSP   -
NPACT   NPACT01168
TaxKB   -
Structure Download

 






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