General
Preferred name
(+)-Evodiamine
Synonyms
d-Evodiamine ()
isoevodiamine ()
d-Evodiamine(+)-Evodiamine ()
evodiamine ()
P&D ID
PD017889
CAS
518-17-2
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 Evodiamine is an alkaloid isolated from the fruit of Evodia rutaecarpa Bentham with diverse biological activities including anti-inflammatory, anti-obesity, and antitumor.
PRICE 29
DESCRIPTION Evodiamine (d-Evodiamine) is an alkaloid isolated from the fruit of daylily and has a variety of biological activities including anti-inflammatory, anti-obesity and anti-tumor. (TargetMol Bioactive Compound Library)
Cell lines
7
Organisms
0
Compound Sets
5
Cayman Chemical Bioactives
16885
CZ-OPENSCREEN Bioactive Library
Drug Repurposing Hub
MedChem Express Bioactive Compound Library
HY-N0114
TargetMol Bioactive Compound Library
T2868
External IDs
23
Properties
(calculated by RDKit )
Molecular Weight
303.14
Hydrogen Bond Acceptors
2
Hydrogen Bond Donors
1
Rotatable Bonds
0
Ring Count
5
Aromatic Ring Count
3
cLogP
3.31
TPSA
39.34
Fraction CSP3
0.21
Chiral centers
1.0
Largest ring
6.0
QED
0.69
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Target
PGE
TRPV1
MOA
Prostaglandin Receptor antagonist
ATPase inhibitor, TRPV agonist
Pathway
GPCR/G protein
Immunology/Inflammation
Source data