Compound Detail
CHEMBL324546
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Basic Information
| ChEMBL ID | CHEMBL324546 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | IEZITYYNMLSDRX-UHFFFAOYSA-N |
1
Targets
2
Activities
2
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
336.2
MW (Da)
4.63
ALogP
4
HBA
2
HBD
62.6
PSA (Ų)
0.72
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.91
Ki 1 meas. best 7.17
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Glutamate NMDA receptor CHEMBL1907608 | Ki | 7.17 | 7.17 | 67.0 | 1 |
| Glutamate NMDA receptor CHEMBL1907608 | IC50 | 5.91 | 5.91 | 1230.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Glutamate NMDA receptor | Ki | = | 67.0 | nM | 7.17 | Ability to displace strychnine-insensitive [3H]glycine binding to N-methyl-D-asp... | 1326635 |
| Glutamate NMDA receptor | IC50 | = | 1230.0 | nM | 5.91 | Inhibition of [3H]MK-801 binding to a N-methyl-D-aspartate glutamate receptor in... | 1326635 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 1326635 | 10.1021/jm00096a019 | Glutamate NMDA receptor | 2 |
Data from ChEMBL 36 via Core Engine