Compound Detail
CHEMBL180087
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Basic Information
| ChEMBL ID | CHEMBL180087 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ZGNLRIPVMAAYNK-INIZCTEOSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
318.4
MW (Da)
4.30
ALogP
4
HBA
2
HBD
49.8
PSA (Ų)
0.68
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 7.48
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 7 CHEMBL3155 | Ki | 7.48 | 7.48 | 33.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 7 | Ki | = | 33.0 | nM | 7.48 | Binding affinity against 5-Hydroxy tryptamine 7 receptor | 15261280 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 15261280 | 10.1016/j.bmcl.2004.06.007 | 5-hydroxytryptamine receptor 7 | 1 |
Data from ChEMBL 36 via Core Engine