Compound Detail
CHEMBL65214
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Basic Information
| ChEMBL ID | CHEMBL65214 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | LNIXLDMNAZUUGL-ONEGZZNKSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
319.2
MW (Da)
4.64
ALogP
2
HBA
0
HBD
18.5
PSA (Ų)
0.76
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.51
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| RAW264.7 CHEMBL612557 | IC50 | 5.51 | 5.51 | 3100.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| RAW264.7 | IC50 | = | 3100.0 | nM | 5.51 | Inhibitory effect on PGE-2 production in LPS-stimulated RAW264.7 cells | 15080988 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 15080988 | 10.1016/j.bmcl.2004.02.038 | RAW264.7 | 1 |
| 20627379 | 10.1016/j.ejmech.2010.05.019 | HT-29 | 1 |
| 20627379 | 10.1016/j.ejmech.2010.05.019 | Caco-2 | 1 |
Data from ChEMBL 36 via Core Engine