General
Preferred name
CHEBULAGIC ACID
Synonyms
P&D ID
PD100424
CAS
23094-71-5
Tags
available
Probe control
Probe control not defined
Orthogonal probes
0
No orthogonal probes found
Similar probes
0
No structurally similar probes found
Structure
P&D probe-likeness score
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Description
(extracted from source data)
DESCRIPTION
Chebulagic acid is a COX-LOX dual inhibitor isolated from the fruits of Terminalia chebula Retz, on angiogenesis. Chebulagic acid is a M2 serine to asparagine 31 mutation (S31N) inhibitor and influenza antiviral. Chebulagic acid also against SARS-CoV-2 viral replication with an EC50 of 9.76 ¦ÌM.
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[[ compound.targets[tid].gene_name ]]
Compound Sets
1
MedChem Express Bioactive Compound Library
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
10
Molecular Weight
954.1
Hydrogen Bond Acceptors
26
Hydrogen Bond Donors
13
Rotatable Bonds
4
Ring Count
8
Aromatic Ring Count
4
cLogP
0.0
TPSA
447.09
Fraction CSP3
0.24
Chiral centers
8.0
Largest ring
12.0
QED
0.06
Structural alerts
1
Saponin/tannin
Detergent-like effects
Nuisance compounds
Related compounds
Custom attributes
(extracted from source data)
Target
COX
Influenza Virus
Lipoxygenase
SARS-CoV
Pathway
Anti-infection
Immunology/Inflammation
Metabolic Enzyme/Protease
Source data
