Compound Detail
CHEMBL5806544
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Basic Information
| ChEMBL ID | CHEMBL5806544 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CJTIYLJHCHNPMW-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
331.4
MW (Da)
5.55
ALogP
2
HBA
1
HBD
42.1
PSA (Ų)
0.68
QED
1
Ro5 Violations
3
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 6.74
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Bromodomain-containing protein 4 CHEMBL1163125 | Ki | 6.74 | 6.74 | 184.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Bromodomain-containing protein 4 | Ki | = | 184.0 | nM | 6.74 | TR-FRET Assay: Compound dilution series were prepared in DMSO via a 3-fold seria... | - |
Data from ChEMBL 36 via Core Engine