Compound Detail
CHEMBL84288
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 | CHEMBL84288 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PRMXJXDYJXBBPT-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
227.7
MW (Da)
2.56
ALogP
2
HBA
2
HBD
49.3
PSA (Ų)
0.46
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.59
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Histone deacetylase CHEMBL2093865 | IC50 | 5.59 | 5.59 | 2580.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Histone deacetylase | IC50 | = | 2580.0 | nM | 5.59 | Inhibition of histone deacetylase (HDAC) activity in HeLa cell nuclear extract | 15109636 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 15109636 | 10.1016/j.bmcl.2004.03.012 | Histone deacetylase | 1 |
Data from ChEMBL 36 via Core Engine