General
Preferred name
IDAZOXAN
Synonyms
IDAZOXAN HYDROCHLORIDE ()
RX 781094 ()
Idazoxan (hydrochloride) ()
RX 781094 (hydrochloride) ()
Idazoxan HCl ()
NSC-759867 ()
Racemic idazoxan ()
Dl-idazoxan ()
RX-781094 ()
P&D ID
PD013324
CAS
79944-58-4
79944-56-2
90755-83-2
Tags
drug candidate
natural product
available
Drug indication
Neurological disorder
Drug Status
investigational
Max Phase
Phase 3
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 Idazoxan has α2-adrenoceptor antagonist activity. (GtoPdb)
DESCRIPTION I2-imidazoline agonist; I1-imidazoline antagonist; alpha2-Adrenergic antagonist (LOPAC library)
DESCRIPTION Selective and irreversible kappa antagonist (Tocris Bioactive Compound Library)
DESCRIPTION α2 antagonist. Also I2 ligand (Tocriscreen Total)
Cell lines
0
Organisms
3
Compound Sets
16
ChEMBL Drugs
CHEMBL10316
Concise Guide to Pharmacology 2023/24
12575
DrugBank
DB12551
DrugMAP
DMSP0X8
DrugMatrix
Guide to Pharmacology
12575
Ki Database
IDAZOXAN
LOPAC library
LSP-MoA library (Laboratory of Systems Pharmacology)
CHEMBL10316
MedChem Express Bioactive Compound Library
HY-14561A
NPC Screening Collection
Prestwick Chemical Library
TargetMol Bioactive Compound Library
T0115
The Spectrum Collection
Tocris Bioactive Compound Library
0793
Tocriscreen Total
External IDs
37
Properties
(calculated by RDKit )
Molecular Weight
204.09
Hydrogen Bond Acceptors
4
Hydrogen Bond Donors
1
Rotatable Bonds
1
Ring Count
3
Aromatic Ring Count
1
cLogP
0.83
TPSA
42.85
Fraction CSP3
0.36
Chiral centers
1.0
Largest ring
6.0
QED
0.74
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Selectivity
I1 / I2
Pathway
Neuroscience
GPCR/G protein
Neuronal Signaling
Target
Adrenergic Receptor
Imidazoline Receptor
Primary Target
Adrenergic ?2 Receptors
MOA
Antagonist
Source data