Compound Detail
CHEMBL5399590
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Basic Information
| ChEMBL ID | CHEMBL5399590 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DHDBIHXRAZQSIF-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
337.4
MW (Da)
4.37
ALogP
4
HBA
1
HBD
51.6
PSA (Ų)
0.65
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 10.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Toll-like receptor 8 CHEMBL5805 | IC50 | 10.0 | 10.0 | 0.1 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Toll-like receptor 8 | IC50 | = | 0.1 | nM | 10.0 | Antagonist activity at human TLR8 | 37163340 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 37163340 | 10.1021/acs.jmedchem.2c01655 | Toll-like receptor 8 | 1 |
Data from ChEMBL 36 via Core Engine