General
Preferred name
HIPPURIC ACID
Synonyms
Benzoylglycine ()
OSM-S-15 ()
hippuric-acid ()
2-Benzamidoacetic acid, Benzoylglycine ()
P&D ID
PD014558
CAS
495-69-2
140480-84-8
Tags
natural product
drug candidate
available
Drug Status
investigational
Probe control
Probe control not defined
Orthogonal probes
0
No orthogonal probes found
Similar probes
0
No structurally similar probes found
Structure
P&D probe-likeness score
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Compound Sets
8
Drug Repurposing Hub
DrugBank
Enamine BioReference Compounds
MedChem Express Bioactive Compound Library
NPC Screening Collection
Open Source Malaria
ReFrame library
Selleckchem Bioactive Compound Library
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
41
Properties
(calculated by RDKit )
Molecular Weight
179.06
Hydrogen Bond Acceptors
2
Hydrogen Bond Donors
2
Rotatable Bonds
3
Ring Count
1
Aromatic Ring Count
1
cLogP
0.5
TPSA
66.4
Fraction CSP3
0.11
Chiral centers
0.0
Largest ring
6.0
QED
0.71
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Pathway
Metabolic Enzyme/Protease
Target
Endogenous Metabolite
Source data
