Compound Detail
CHEMBL5316205
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Basic Information
| ChEMBL ID | CHEMBL5316205 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | UACNRZUVCUEUPY-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
354.4
MW (Da)
4.25
ALogP
5
HBA
3
HBD
79.2
PSA (Ų)
0.72
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.09
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| RAW264.7 CHEMBL612557 | IC50 | 5.09 | 5.09 | 8100.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| RAW264.7 | IC50 | = | 8100.0 | nM | 5.09 | Antiinflammatory activity in mouse RAW264.7 cells assessed as inhibition of LPS-... | 26841168 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 26841168 | 10.1021/acs.jnatprod.5b00877 | RAW264.7 | 2 |
| 26841168 | 10.1021/acs.jnatprod.5b00877 | Nuclear factor erythroid 2-related factor 2 | 1 |
| 26841168 | 10.1021/acs.jnatprod.5b00877 | Influenza A virus | 1 |
| 26841168 | 10.1021/acs.jnatprod.5b00877 | Tyrosinase | 1 |
Data from ChEMBL 36 via Core Engine