Compound Detail
CHEMBL161405
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Basic Information
| ChEMBL ID | CHEMBL161405 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | AKPWVFNIKACKQW-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
231.3
MW (Da)
2.07
ALogP
2
HBA
2
HBD
32.3
PSA (Ų)
0.82
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.41
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Glutamate NMDA receptor CHEMBL1907608 | IC50 | 5.41 | 5.41 | 3935.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Glutamate NMDA receptor | IC50 | = | 3935.0 | nM | 5.41 | Evaluated for their affinity at the PCP site for displacement of [3H]TCP in rat ... | 8459395 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 8459395 | 10.1021/jm00058a002 | No relevant target | 1 |
| 8459395 | 10.1021/jm00058a002 | Glutamate NMDA receptor | 1 |
Data from ChEMBL 36 via Core Engine