Compound Detail
CHEMBL4852743
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Basic Information
| ChEMBL ID | CHEMBL4852743 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XAOIJMBOKVCSAH-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
360.8
MW (Da)
3.79
ALogP
4
HBA
1
HBD
58.1
PSA (Ų)
0.90
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.79
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 1F CHEMBL1805 | IC50 | 6.79 | 6.79 | 160.9 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 1F | IC50 | = | 160.9 | nM | 6.79 | Agonist activity at 5HT1F receptor (unknown origin) expressed in HEK293 cells me... | 34419891 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 34419891 | 10.1016/j.ejmech.2021.113782 | 5-hydroxytryptamine receptor 1F | 1 |
Data from ChEMBL 36 via Core Engine