Compound Detail
CHEMBL67296
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Basic Information
| ChEMBL ID | CHEMBL67296 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WOMHYXYCYIKZAG-RMKNXTFCSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
200.2
MW (Da)
3.46
ALogP
2
HBA
0
HBD
22.4
PSA (Ų)
0.76
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.4
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| RAW264.7 CHEMBL612557 | IC50 | 6.4 | 5.645 | 400.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| RAW264.7 | IC50 | = | 400.0 | nM | 6.4 | Inhibitory effect on PGE-2 production in LPS-stimulated RAW264.7 cells | 15080988 |
| RAW264.7 | IC50 | = | 13000.0 | nM | 4.89 | Inhibitory activity against nitric oxide production in lipopolysaccharide-activa... | 14552759 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 15080988 | 10.1016/j.bmcl.2004.02.038 | RAW264.7 | 1 |
| 14552759 | 10.1016/j.bmcl.2003.08.013 | RAW264.7 | 1 |
Data from ChEMBL 36 via Core Engine