Compound Detail
CHEMBL289106
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Basic Information
| ChEMBL ID | CHEMBL289106 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | HOZLVWGBFHBKCK-AVRDEDQJSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
349.5
MW (Da)
5.46
ALogP
2
HBA
0
HBD
20.3
PSA (Ų)
0.62
QED
1
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 8.12
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 1A CHEMBL273 | Ki | 8.12 | 8.12 | 7.6 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 1A | Ki | = | 7.6 | nM | 8.12 | Binding affinity for 5-hydroxytryptamine 1A receptor in rat brain tissue using [... | 7530773 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 7530773 | 10.1021/jm00001a020 | Rattus norvegicus | 11 |
| 7530773 | 10.1021/jm00001a020 | 5-hydroxytryptamine receptor 1A | 1 |
Data from ChEMBL 36 via Core Engine