Compound Detail
CHEMBL339737
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Basic Information
| ChEMBL ID | CHEMBL339737 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | KUJKKQNZGKXTSY-NKWVEPMBSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
241.2
MW (Da)
-0.83
ALogP
6
HBA
3
HBD
113.0
PSA (Ų)
0.62
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.08
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Glutamate NMDA receptor CHEMBL1907608 | IC50 | 5.08 | 4.77 | 8300.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Glutamate NMDA receptor | IC50 | = | 8300.0 | nM | 5.08 | Compound was tested in vitro for inhibition of binding of [3H]-CGS- 19755 radiol... | 9871691 |
| Glutamate NMDA receptor | IC50 | = | 34500.0 | nM | 4.46 | Compound was tested in vitro for its ability to inhibit depolarizations induced ... | 9871691 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 9871691 | 10.1016/s0960-894x(98)00038-9 | Glutamate NMDA receptor | 2 |
| 9871691 | 10.1016/s0960-894x(98)00038-9 | Mus musculus | 1 |
Data from ChEMBL 36 via Core Engine