General
Preferred name
PD015273
Synonyms
5-Hydroxyindolacetic acid ()
5-hydroxy-1H-indole-3-acetic acid ()
5-Hydroxyindole-3-acetic acid ()
5-hydroxyindoleacetic acid ()
5-hydroxy Indole-3-acetic Acid ()
5-hydroxy Indole-3-acetic Acid-d6 ()
P&D ID
PD015273
CAS
113303-91-6
55362-47-5
66866-39-5
1321-73-9
54-16-0
2748469-82-9
Tags
drug candidate
natural product
available
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 5-hydroxyindoleacetic acid (5-HIAA; a serotonin metabolite produced by platelets and mast cells) is reported to act via GPR35 as a neutrophil chemoattractant that recruits neutrophils to sites of inflammation . (GtoPdb)
DESCRIPTION Serotonin metabolite (LOPAC library)
Compound Sets
5
Cayman Chemical Bioactives
DrugMAP
Guide to Pharmacology
LOPAC library
MedChem Express Bioactive Compound Library
External IDs
41
Properties
(calculated by RDKit )
Molecular Weight
191.06
Hydrogen Bond Acceptors
2
Hydrogen Bond Donors
3
Rotatable Bonds
2
Ring Count
2
Aromatic Ring Count
2
cLogP
1.5
TPSA
73.32
Fraction CSP3
0.1
Chiral centers
0.0
Largest ring
6.0
QED
0.67
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Pathway
Metabolic Enzyme/Protease
Target
Endogenous Metabolite
Source data