General
Preferred name
Diapocynin
Synonyms
Diapocynin ()
P&D ID
PD057159
CAS
29799-22-2
Tags
natural product
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 Diapocynin is the dimeric form of the NADPH oxidase inhibitor apocynin that has anti-inflammatory and antioxidant activities. Diapocynin inhibits NADPH oxidase complex assembly and activation, gp91phox mRNA expression, and production of the pro-inflammatory cytokines. Diapocynin also reverses motor coordination deficits in the LRRK2R1441G mouse model of early Parkinson's disease. (BOC Sciences Bioactive Compounds)
Cell lines
1
Organisms
0
Compound Sets
2
BOC Sciences Bioactive Compounds
diapocynin-cas-29799-22-2-292086
Cayman Chemical Bioactives
14052
External IDs
13
Properties
(calculated by RDKit )
Molecular Weight
330.11
Hydrogen Bond Acceptors
6
Hydrogen Bond Donors
2
Rotatable Bonds
5
Ring Count
2
Aromatic Ring Count
2
cLogP
3.19
TPSA
93.06
Fraction CSP3
0.22
Chiral centers
0.0
Largest ring
6.0
QED
0.82
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Source data