Compound Detail
CHEMBL4514550
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Basic Information
| ChEMBL ID | CHEMBL4514550 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | BCSCGCOVRJYILO-QEGBUVANSA-N |
1
Targets
3
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
308.3
MW (Da)
-2.27
ALogP
7
HBA
5
HBD
131.6
PSA (Ų)
0.42
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 3 meas. best 5.35
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | Ki | 5.35 | 5.16 | 4500.0 | 3 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | Ki | = | 4500.0 | nM | 5.35 | Inhibition of rabbit muscle Glycogen phosphorylase a using glucose-1-phosphate a... | 31251604 |
| Unchecked | Ki | = | 8400.0 | nM | 5.08 | Inhibition of human liver Glycogen phosphorylase a using glucose-1-phosphate as ... | 31251604 |
| Unchecked | Ki | = | 9000.0 | nM | 5.05 | Inhibition of rabbit muscle Glycogen phosphorylase b using glucose-1-phosphate a... | 31251604 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 31251604 | 10.1021/acs.jmedchem.9b00356 | Unchecked | 4 |
Data from ChEMBL 36 via Core Engine