Compound Detail
CHEMBL3765482
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Basic Information
| ChEMBL ID | CHEMBL3765482 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PXKGLYZUOBHJQY-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
256.3
MW (Da)
3.50
ALogP
3
HBA
2
HBD
49.7
PSA (Ų)
0.82
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.1
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| NON-PROTEIN TARGET CHEMBL3879801 | IC50 | 5.1 | 4.92 | 7890.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| NON-PROTEIN TARGET | IC50 | = | 7890.0 | nM | 5.1 | Antiinflammatory activity in human neutrophils assessed as inhibition of FMLP/CB... | 26928286 |
| NON-PROTEIN TARGET | IC50 | = | 18250.0 | nM | 4.74 | Antiinflammatory activity in human neutrophils assessed as inhibition of FMLP/CB... | 26928286 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 26928286 | 10.1016/j.bmc.2016.01.049 | NON-PROTEIN TARGET | 4 |
Data from ChEMBL 36 via Core Engine