Compound Detail
CHEMBL309544
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Basic Information
| ChEMBL ID | CHEMBL309544 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | NXGNIDQYOFOSQC-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
246.2
MW (Da)
-0.73
ALogP
5
HBA
3
HBD
110.4
PSA (Ų)
0.57
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 7.54
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Glutamate NMDA receptor CHEMBL1907608 | IC50 | 7.54 | 7.29 | 29.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Glutamate NMDA receptor | IC50 | = | 29.0 | nM | 7.54 | Tested in vitro for antagonistic activity at N-methyl-D-aspartate glutamate rece... | 9457246 |
| Glutamate NMDA receptor | IC50 | = | 92.0 | nM | 7.04 | Displacement of [3H]CPP from rat brain synaptic membrane N-methyl-D-aspartate gl... | 9457246 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 9457246 | 10.1021/jm970504g | Glutamate NMDA receptor | 2 |
| 9457246 | 10.1021/jm970504g | Mus musculus | 1 |
Data from ChEMBL 36 via Core Engine