General
Preferred name
(±)-5'-Chloro-5'-deoxy-ENBA
Synonyms
(+/-)-5'-Chloro-5'-deoxy-ENBA ()
P&D ID
PD021675
CAS
103626-26-2
Tags
available
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()] ]]
Description
(extracted from source data)
DESCRIPTION
Highly selective A1 agonist
(Tocriscreen Plus)
DESCRIPTION
Potent and selective GPER agonist
(Tocris Bioactive Compound Library)
DESCRIPTION
Highly selective A1 agonist
(Tocriscreen Total)
DESCRIPTION
(±)-5'-Chloro-5'-deoxy-ENBA is a selective adenosine A1 receptor agonist (Ki = 0.51, 1290, 1340 and 2740 nM at A1, A3, A2A and A2B receptors respectively). It is used as an antinociceptive.
(BOC Sciences Bioactive Compounds)
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Compound Sets
4
BOC Sciences Bioactive Compounds
Tocris Bioactive Compound Library
Tocriscreen Plus
Tocriscreen Total
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
10
Molecular Weight
379.14
Hydrogen Bond Acceptors
8
Hydrogen Bond Donors
3
Rotatable Bonds
4
Ring Count
5
Aromatic Ring Count
2
cLogP
1.28
TPSA
105.32
Fraction CSP3
0.71
Chiral centers
7.0
Largest ring
6.0
QED
0.69
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Target Type
7-TM Receptors
Primary Target
Adenosine A1 Receptors
MOA
Agonist
Source data
