Compound Detail
CHEMBL339350
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Basic Information
| ChEMBL ID | CHEMBL339350 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | JCCJCTNJPWOBID-IZZDOVSWSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
449.3
MW (Da)
3.45
ALogP
4
HBA
5
HBD
133.6
PSA (Ų)
0.45
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 8.38
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Glutamate NMDA receptor CHEMBL1907608 | Ki | 8.38 | 8.38 | 4.2 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Glutamate NMDA receptor | Ki | = | 4.169 | nM | 8.38 | In vitro ability to inhibit the binding of [3H]glycine to glycine binding site o... | 14552796 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 14552796 | 10.1016/j.bmcl.2003.06.001 | Glutamate NMDA receptor | 1 |
Data from ChEMBL 36 via Core Engine