General
Preferred name
ADRENALONE
Synonyms
ADRENALONE HYDROCHLORIDE ()
3'4'-Dihydroxy-2-(methylamino)acetophenone hydrochloride ()
Adrenalone HCl ()
ADRENOLONE HYDROCHLORIDE ()
NSC-243611 ()
Adrenone ()
Adrenalona ()
P&D ID
PD013683
CAS
62-13-5
99-45-6
Tags
available
drug
Drug Status
experimental
approved
investigational
Max Phase
2.0
Drug indication
Adrenergic (ophthalmic)
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
10
ChEMBL Drugs
Drug Repurposing Hub
DrugBank
DrugCentral
DrugCentral Approved Drugs
NPC Screening Collection
ReFrame library
Selleckchem Bioactive Compound Library
TargetMol Bioactive Compound Library
The Spectrum Collection
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
44
Properties
(calculated by RDKit )
Molecular Weight
181.07
Hydrogen Bond Acceptors
4
Hydrogen Bond Donors
3
Rotatable Bonds
3
Ring Count
1
Aromatic Ring Count
1
cLogP
0.5
TPSA
69.56
Fraction CSP3
0.22
Chiral centers
0.0
Largest ring
6.0
QED
0.47
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Pathway
GPCR/G protein
Target
??1-adrenergic receptor
¦Á1-adrenergic receptor
ADRA1A
Adrenergic Receptor
Indication
hemorrhage
MOA
Adrenergic Receptor agonist
Source data
