General
Preferred name
CHALCONE
Synonyms
benzylideneacetophenone, phenyl styryl ketone, benzalacetophenone, β-phenylacrylophenone ()
benzylideneacetophenone, phenyl styryl ketone, benzalacetophenone, ??phenylacrylophenone ()
trans-Chalcone ()
benzylideneacetophenone, phenyl styryl ketone, benzalacetophenone, ¦Â-phenylacrylophenone ()
(2E)-1,3-diphenylprop-2-en-1-one ()
P&D ID
PD087238
CAS
94-41-7
614-47-1
Tags
available
drug candidate
nuisance
Drug indication
Discovery agent
Structure
Probe scores
P&D probe-likeness score
[[ v.score ]]%
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Description
(extracted from source data)
DESCRIPTION Chalcone is isolated from Glycyrrhiza uralensis and used to synthesize chalcone derivatives. Chalcone derivatives possess varied biological and pharmacological activity, including anti-inflammatory, antioxidative, antibacterial, anticancer, and anti-parasitic activities[1].
PRICE 29
DESCRIPTION trans-Chalcone (Chalkone) is an aromatic ketone that forms the central core for a variety of important biological compounds, which are known collectively as chalcones.
DESCRIPTION trans-Chalcone, isolated from Aronia melanocarpa skin, is a biphenolic core structure of flavonoids precursor. trans-Chalcone is a potent fatty acid synthase (FAS) and ¦Á-amylase inhibitor. trans-Chalcone causes cellcycle arrest and induces apoptosis in the breastcancer cell line MCF-7. trans-Chalcone has antifungal and anticancer activity[1][2][3].
DESCRIPTION Inhibition of human recombinant MAO-B assessed as hydrogen peroxide production (TargetMol Bioactive Compound Library)
Cell lines
23
Organisms
7
Compound Sets
5
DrugMAP
DM16QTM
MedChem Express Bioactive Compound Library
HY-121054
HY-Y0598
Nuisance compounds in cellular assays
Selleckchem Bioactive Compound Library
chalcone
trans-chalcone
TargetMol Bioactive Compound Library
0074-0052
External IDs
35
Properties
(calculated by RDKit )
Molecular Weight
208.09
Hydrogen Bond Acceptors
1
Hydrogen Bond Donors
0
Rotatable Bonds
3
Ring Count
2
Aromatic Ring Count
2
cLogP
3.58
TPSA
17.07
Fraction CSP3
0.0
Chiral centers
0.0
Largest ring
6.0
QED
0.56
Structural alerts
1
Nonspecific/NOS
Chalcone
Nuisance compounds
Related compounds
Custom attributes
(extracted from source data)
Target
Bacterial
Parasite
Apoptosis
Fatty Acid Synthase (FASN)
Fungal
Fatty acid synthase
Pathway
Anti-infection
Metabolic Enzyme/Protease
Source data