Compound Detail
CHEMBL58186
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Basic Information
| ChEMBL ID | CHEMBL58186 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GQYXXZQBDSGBQZ-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
285.3
MW (Da)
1.90
ALogP
4
HBA
1
HBD
36.9
PSA (Ų)
0.86
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 6.58
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | Ki | 6.58 | 6.58 | 263.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | Ki | = | 263.0 | nM | 6.58 | In vitro alpha-2 adrenergic receptor binding affinity was determined on calf fro... | 12723959 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 12723959 | 10.1021/jm021050c | Rattus norvegicus | 4 |
| 12723959 | 10.1021/jm021050c | Nischarin | 2 |
| 12723959 | 10.1021/jm021050c | Unchecked | 2 |
Data from ChEMBL 36 via Core Engine