General
Preferred name
PD-144418
Synonyms
PD 144418 oxalate ()
PD 144418 ()
PD 144418 (oxalate) ()
P&D ID
PD054907
CAS
1794760-28-3
154130-99-1
Tags
available
drug candidate
Drug indication
Coronavirus Disease 2019 (COVID-19)
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 PD 144418 oxalate is a highly affinity, potent and selective sigma 1 (¦Ò1) receptor ligand (Ki values of 0.08 nM and 1377 nM for ¦Ò1 and ¦Ò2 respectively). PD 144418 oxalate devoids of any significant affinity for other receptors, ion channels and enzymes. PD 144418 oxalate shows potential antipsychotic activity[1][2].
PRICE 164
DESCRIPTION PD 144418 oxalate is a highly potent and selective sigma 1 (??1) receptor ligand with a Ki value of 0.08 nM for ??1 and 1377 nM for ??2, exhibiting negligible affinity for other receptors, ion channels, and enzymes, and demonstrating potential antipsychotic activity.
DESCRIPTION PD-144418 is a σ1 receptor antagonist . It is selective for σ1 binding sites over σ2 binding sites in vitro. (GtoPdb)
DESCRIPTION PD 144418 is a highly affinity, potent and selective sigma 1 (¦Ò1) receptor ligand (Ki values of 0.08 nM and 1377 nM for ¦Ò1 and ¦Ò2 respectively). PD 144418 devoids of any significant affinity for other receptors, ion channels and enzymes. PD 144418 shows potential antipsychotic activity[1][2].
DESCRIPTION Potent, non-substrate EAAT2 inhibitor (Tocris Bioactive Compound Library)
DESCRIPTION PD 144418 oxalate is a very selective sigma 1 agent (Ki values are 0.08 and 1377 nM for σ1 and σ2 respectively), devoid of any significant affinity for other receptors and that sigma 1 site may modulate actions in the CNS. PD 144418 antagonizes mescaline-induced scratching in mice following i.p. administration, and also attenuates cocaine-induced hyperactivity in mice. (BOC Sciences Bioactive Compounds)
DESCRIPTION PD 144418 oxalate is a highly potent and selective sigma 1 (σ1) receptor ligand with a Ki value of 0.08 nM for σ1 and 1377 nM for σ2, exhibiting negligible affinity for other receptors, ion channels, and enzymes, and demonstrating potential antipsychotic activity. (TargetMol Bioactive Compound Library)
Cell lines
0
Organisms
1
Compound Sets
7
BOC Sciences Bioactive Compounds
pd-144418-oxalate-cas-154130-99-1-item-167738
DrugMAP
DMJKH28
Guide to Pharmacology
10731
MedChem Express Bioactive Compound Library
HY-108512A
HY-108512
ReFrame library
TargetMol Bioactive Compound Library
T39211
Tocris Bioactive Compound Library
2606
External IDs
21
Properties
(calculated by RDKit )
Molecular Weight
282.17
Hydrogen Bond Acceptors
3
Hydrogen Bond Donors
0
Rotatable Bonds
4
Ring Count
3
Aromatic Ring Count
2
cLogP
4.15
TPSA
29.27
Fraction CSP3
0.39
Chiral centers
0.0
Largest ring
6.0
QED
0.84
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Target
Sigma Receptor
Primary Target
?1 Receptors
MOA
Ligand
Therapeutic Class
Antiviral Agents
Pathway
Neuronal Signaling
GPCR/G protein
Solubility
DMSO to 50 mM
Source data