Compound Detail
CHEMBL5184185
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Basic Information
| ChEMBL ID | CHEMBL5184185 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | BMEPZPDORMLOOK-DPJQDDQZSA-N |
| Parent Compound | CHEMBL5222088 |
| Active Moiety | CHEMBL5222088 |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
398.5
MW (Da)
3.31
ALogP
4
HBA
0
HBD
49.9
PSA (Ų)
0.67
QED
0
Ro5 Violations
8
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 9.12
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 7 CHEMBL3223 | Ki | 9.12 | 9.12 | 0.8 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 7 | Ki | = | 0.75 | nM | 9.12 | Binding affinity to rat brain 5-HT7 receptor assessed as inhibition constant inc... | 35939391 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 35939391 | 10.1021/acs.jmedchem.2c00633 | 5-hydroxytryptamine receptor 7 | 1 |
Data from ChEMBL 36 via Core Engine