Compound Detail
CHEMBL48666
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL48666 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | AUKDHITYOZWWGZ-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
380.3
MW (Da)
5.00
ALogP
2
HBA
2
HBD
60.2
PSA (Ų)
0.25
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.34
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Beta-TC6 CHEMBL614357 | IC50 | 5.34 | 5.34 | 4600.0 | 1 |
| Rattus norvegicus CHEMBL376 | IC50 | 5.06 | 5.06 | 8700.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Beta-TC6 | IC50 | = | 4600.0 | nM | 5.34 | In vitro inhibition of insulin release from murine beta-TC6 cells | 11425552 |
| Rattus norvegicus | IC50 | = | 8700.0 | nM | 5.06 | In vitro ability to relax phenylephrine contracted rat aorta rings | 11425552 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 11425552 | 10.1016/s0960-894x(01)00297-9 | Beta-TC6 | 2 |
| 11425552 | 10.1016/s0960-894x(01)00297-9 | Rattus norvegicus | 1 |
| 11425552 | 10.1016/s0960-894x(01)00297-9 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine