Compound Detail
CHEMBL5422921
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Basic Information
| ChEMBL ID | CHEMBL5422921 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FOHYFZOKHMZCQK-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
337.4
MW (Da)
2.61
ALogP
4
HBA
2
HBD
55.8
PSA (Ų)
0.67
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 7.82
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Histone deacetylase 6 CHEMBL1865 | IC50 | 7.82 | 7.82 | 15.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Histone deacetylase 6 | IC50 | = | 15.0 | nM | 7.82 | Inhibition of human recombinant HDAC6 using RHKKAc (379 to 382 residues) as subs... | 37902787 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 37902787 | 10.1021/acs.jmedchem.3c01385 | Histone deacetylase 6 | 1 |
Data from ChEMBL 36 via Core Engine