Compound Detail
CHEMBL568077
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Basic Information
| ChEMBL ID | CHEMBL568077 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GZQMSNKBMQEZJK-HNNXBMFYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
287.4
MW (Da)
2.76
ALogP
2
HBA
1
HBD
35.6
PSA (Ų)
0.90
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Kd 1 meas. best 8.7
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 1A CHEMBL214 | Kd | 8.7 | 8.7 | 2.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 1A | Kd | = | 1.995 | nM | 8.7 | Binding affinity to 5HT1A receptor | 19754201 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 19754201 | 10.1021/jm901096y | 5-hydroxytryptamine receptor 1A | 1 |
Data from ChEMBL 36 via Core Engine