Compound Detail
CHEMBL5532261
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Basic Information
| ChEMBL ID | CHEMBL5532261 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FPOUPKUQIVVQHP-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
333.4
MW (Da)
2.71
ALogP
5
HBA
0
HBD
72.8
PSA (Ų)
0.79
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 6.54
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Pyruvate kinase PKLR CHEMBL1075126 | EC50 | 6.54 | 6.54 | 290.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Pyruvate kinase PKLR | EC50 | = | 290.0 | nM | 6.54 | Allosteric activation at human liver pyruvate kinase | 38711345 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 38711345 | 10.1021/acs.jmedchem.3c01825 | Pyruvate kinase PKLR | 1 |
Data from ChEMBL 36 via Core Engine