General
Preferred name
Fraxinellone
Synonyms
P&D ID
PD087933
CAS
28808-62-0
Tags
available
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 Fraxinellone is isolated from the root bark of the Rutaceae plant, Dictamnus dasycarpus. Fraxinellone is a PD-L1 inhibitor and inhibits HIF-1¦Á protein synthesis without affecting HIF-1¦Á protein degradation. Fraxinellone has the potential to be a valuable candidate for cancer treatment by targeting PD-L1[1].
PRICE 47
DESCRIPTION 1. Fraxinellone significantly reduced weight loss and diarrhea in mice and alleviated the macroscopic and microscopic signs of the disease. 2. Fraxinellone exhibited a variety of insecticidal activities including feeding-deterrent activity, inhibition of growth, and larvicidal activity. 3. Fraxinellone has effect in the midgut metabolism of Mythimna separata (M. separata), via protease (especially the weak alkaline trypsin-like enzyme), carboxylesterase and glutathione S-transferase. (TargetMol Bioactive Compound Library)
Compound Sets
5
AdooQ Bioactive Compound Library
A13918
Cayman Chemical Bioactives
34672
MedChem Express Bioactive Compound Library
HY-N0242
Selleckchem Bioactive Compound Library
fraxinellone
TargetMol Bioactive Compound Library
T6S0071
External IDs
18
Properties
(calculated by RDKit )
Molecular Weight
232.11
Hydrogen Bond Acceptors
3
Hydrogen Bond Donors
0
Rotatable Bonds
1
Ring Count
3
Aromatic Ring Count
1
cLogP
3.38
TPSA
39.44
Fraction CSP3
0.5
Chiral centers
2.0
Largest ring
6.0
QED
0.7
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Target
HIF/HIF Prolyl-Hydroxylase
PD-1/PD-L1
STAT
Immunology & Inflammation related
Pathway
Apoptosis
Cell Cycle/Checkpoint
Chromatin/Epigenetic
Immunology/Inflammation
JAK/STAT Signaling
Metabolism
Stem Cells
Metabolic Enzyme/Protease
Stem Cell/Wnt
Source data