Compound Detail
CHEMBL319521
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Basic Information
| ChEMBL ID | CHEMBL319521 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | RSZKOTWXJHGINL-UHFFFAOYSA-N |
2
Targets
4
Activities
2
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
281.3
MW (Da)
1.12
ALogP
5
HBA
2
HBD
79.8
PSA (Ų)
0.85
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 2 meas. best 5.41
IC50 2 meas. best 5.66
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Rattus norvegicus CHEMBL376 | IC50 | 5.66 | 5.66 | 2200.0 | 2 |
| Sulfonylurea receptor 1, Kir6.2 CHEMBL2096972 | EC50 | 5.41 | 5.405 | 3870.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Rattus norvegicus | IC50 | = | 2200.0 | nM | 5.66 | Concentration required for 50% inhibition of insulin release in rat pancreatic B... | 15887958 |
| Rattus norvegicus | IC50 | = | 2200.0 | nM | 5.66 | Concentration required for 50% inhibition of insulin release in rat pancreatic B... | 15887958 |
| Sulfonylurea receptor 1, Kir6.2 | EC50 | = | 3870.0 | nM | 5.41 | Inhibition of Beta-cell KATP channel | 12270187 |
| Sulfonylurea receptor 1, Kir6.2 | EC50 | = | 3981.07 | nM | 5.4 | Negative log EC50 for Beta-cell KATP channel | 12270187 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 15887958 | 10.1021/jm0311339 | Rattus norvegicus | 12 |
| 12270187 | 10.1016/s0960-894x(02)00617-0 | Sulfonylurea receptor 1, Kir6.2 | 3 |
Data from ChEMBL 36 via Core Engine