Compound Detail
CHEMBL274864
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Basic Information
| ChEMBL ID | CHEMBL274864 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WCWNYVYNQAPOOX-HNNXBMFYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
8
Publications
0
Known Names
Molecular Properties
423.5
MW (Da)
3.32
ALogP
4
HBA
0
HBD
43.9
PSA (Ų)
0.55
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 6.52
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 1A CHEMBL273 | Ki | 6.52 | 6.52 | 302.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 1A | Ki | = | 302.0 | nM | 6.52 | Displacement of [3H]-8-OHDPAT from 5-HT1A receptor in rat hippocampal membranes ... | 23902232 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 23902232 | 10.1021/jm400867d | Unchecked | 2 |
| 15828846 | 10.1021/jm0491391 | Alpha-1D adrenergic receptor | 1 |
| 15828846 | 10.1021/jm0491391 | Alpha-1B adrenergic receptor | 1 |
| 15828846 | 10.1021/jm0491391 | Alpha-1A adrenergic receptor | 1 |
| 15828846 | 10.1021/jm0491391 | 5-hydroxytryptamine receptor 1A | 1 |
| 15828846 | 10.1021/jm0491391 | D(2) dopamine receptor | 1 |
| 15828846 | 10.1021/jm0491391 | D(3) dopamine receptor | 1 |
| 23902232 | 10.1021/jm400867d | 5-hydroxytryptamine receptor 1A | 1 |
Data from ChEMBL 36 via Core Engine