Compound Detail
CHEMBL5584056
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Basic Information
| ChEMBL ID | CHEMBL5584056 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VLRBSKBPXZIEIY-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
245.2
MW (Da)
0.50
ALogP
4
HBA
3
HBD
95.1
PSA (Ų)
0.72
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Kd 1 meas. best 4.13
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | Kd | 4.13 | 4.13 | 74000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | Kd | = | 74000.0 | nM | 4.13 | Binding affinity to human Avi-tagged MUS81 (246 to 551 residues)/2x8His-tagged E... | 39015284 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 39015284 | 10.1021/acsmedchemlett.3c00453 | Unchecked | 2 |
Data from ChEMBL 36 via Core Engine