Compound Detail
CHEMBL6025821
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Basic Information
| ChEMBL ID | CHEMBL6025821 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | BYHCEWJXJQSUEV-UHFFFAOYSA-N |
2
Targets
6
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
315.3
MW (Da)
1.62
ALogP
4
HBA
5
HBD
110.7
PSA (Ų)
0.43
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 6 meas. best 8.08
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Histone deacetylase 6 CHEMBL1865 | IC50 | 8.08 | 8.08 | 8.3 | 3 |
| Histone deacetylase 1 CHEMBL325 | IC50 | 5.97 | 5.97 | 1060.0 | 3 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Histone deacetylase 6 | IC50 | = | 8.3 | nM | 8.08 | Inhibition Assay: HDAC inhibition assays were performed by Reaction Biology Corp... | - |
| Histone deacetylase 6 | IC50 | = | 8.3 | nM | 8.08 | HDAC Inhibition Assays: HDAC inhibition assays were performed by Reaction Biolog... | - |
| Histone deacetylase 6 | IC50 | = | 8.3 | nM | 8.08 | Inhibition Assay: HDAC inhibition assays were performed by Reaction Biology Corp... | - |
| Histone deacetylase 1 | IC50 | = | 1060.0 | nM | 5.97 | Inhibition Assay: HDAC inhibition assays were performed by Reaction Biology Corp... | - |
| Histone deacetylase 1 | IC50 | = | 1060.0 | nM | 5.97 | HDAC Inhibition Assays: HDAC inhibition assays were performed by Reaction Biolog... | - |
| Histone deacetylase 1 | IC50 | = | 1060.0 | nM | 5.97 | Inhibition Assay: HDAC inhibition assays were performed by Reaction Biology Corp... | - |
Data from ChEMBL 36 via Core Engine