Compound Detail
CHEMBL2064461
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Basic Information
| ChEMBL ID | CHEMBL2064461 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | AALNDPMHPZUGAO-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
191.2
MW (Da)
0.75
ALogP
4
HBA
0
HBD
67.2
PSA (Ų)
0.57
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 7.24
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| RAW264.7 CHEMBL612557 | IC50 | 7.24 | 7.24 | 58.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| RAW264.7 | IC50 | = | 58.0 | nM | 7.24 | Antiinflammatory activity in mouse RAW264.7 cells assessed as inhibition of IFNg... | 22533790 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 22533790 | 10.1021/jm3003922 | RAW264.7 | 1 |
| 22533790 | 10.1021/jm3003922 | NAD(P)H dehydrogenase [quinone] 1 | 1 |
Data from ChEMBL 36 via Core Engine