General
Preferred name
LORECLEZOLE
Synonyms
Loreclezole hydrochloride ()
R 72063 ()
R-72063 ()
P&D ID
PD050619
CAS
117857-45-1
2227372-56-5
Tags
available
drug candidate
Drug indication
Epileptic seizures
Anti-Epileptic
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 Potent, selective P2X1 antagonist (Tocris Bioactive Compound Library)
DESCRIPTION Subtype-selective GABAA receptor modulator (Tocriscreen Total)
DESCRIPTION Loreclezole hydrochloride is a subtype-selective GABAA receptor modulator. It acts as a positive allosteric modulator of β2 or β3-subunit containing receptors. (BOC Sciences Bioactive Compounds)
Compound Sets
10
BOC Sciences Bioactive Compounds
loreclezole-hydrochloride-cas-117857-45-1-item-161567
ChEMBL Drugs
CHEMBL1397886
Drug Repurposing Hub
DrugMAP
DMCZI62
Guide to Pharmacology
5466
MedChem Express Bioactive Compound Library
HY-105272
ReFrame library
TargetMol Bioactive Compound Library
T5375
Tocris Bioactive Compound Library
1295
Tocriscreen Total
External IDs
26
Properties
(calculated by RDKit )
Molecular Weight
272.96
Hydrogen Bond Acceptors
3
Hydrogen Bond Donors
0
Rotatable Bonds
2
Ring Count
2
Aromatic Ring Count
2
cLogP
3.78
TPSA
30.71
Fraction CSP3
0.0
Chiral centers
0.0
Largest ring
6.0
QED
0.83
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Pathway
Membrane Transporter/Ion Channel
Neuroscience
Neuronal Signaling
Target
GABAA
GABRB2, GABRB3
Primary Target
GABAA Receptors
MOA
Modulator
GABA Receptor
benzodiazepine receptor agonist
Source data