Compound Detail
CHEMBL58561
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Basic Information
| ChEMBL ID | CHEMBL58561 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WUYOUADFBDRPLL-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
374.6
MW (Da)
2.83
ALogP
2
HBA
1
HBD
56.0
PSA (Ų)
0.38
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.3
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Homo sapiens CHEMBL372 | IC50 | 6.3 | 6.3 | 500.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Homo sapiens | IC50 | = | 500.0 | nM | 6.3 | Ability to block GRO-alpha driven human neutrophil chemotaxis | 11459668 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 11459668 | 10.1016/s0960-894x(01)00326-2 | Homo sapiens | 1 |
| 11459668 | 10.1016/s0960-894x(01)00326-2 | C-X-C chemokine receptor type 2 | 1 |
Data from ChEMBL 36 via Core Engine