Compound Detail
CHEMBL129759
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NS(=O)(=O)Nc1ccc(NC(=O)/C=C2\CC(C(=O)O)Nc3cc(Cl)cc(Cl)c32)cc1
Basic Information
| ChEMBL ID | CHEMBL129759 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | RYCKGFRABRDMFC-RMKNXTFCSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
471.3
MW (Da)
2.90
ALogP
5
HBA
5
HBD
150.6
PSA (Ų)
0.42
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 8.17
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Glutamate NMDA receptor CHEMBL1907608 | Ki | 8.17 | 8.17 | 6.8 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Glutamate NMDA receptor | Ki | = | 6.761 | nM | 8.17 | 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