Compound Detail
CHEMBL5277451
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Basic Information
| ChEMBL ID | CHEMBL5277451 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | JHIXEZNTXMFXEK-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
271.4
MW (Da)
3.80
ALogP
2
HBA
2
HBD
49.3
PSA (Ų)
0.47
QED
0
Ro5 Violations
14
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 5.12
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| NAD-dependent protein deacylase sirtuin-6 CHEMBL2163182 | EC50 | 5.12 | 5.12 | 7500.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| NAD-dependent protein deacylase sirtuin-6 | EC50 | = | 7500.0 | nM | 5.12 | Activation of recombinant His-tagged SIRT6 (unknown origin) deacetylase activity... | 34213345 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 34213345 | 10.1021/acs.jmedchem.1c00601 | NAD-dependent protein deacylase sirtuin-6 | 2 |
Data from ChEMBL 36 via Core Engine