Compound Detail
CHEMBL522417
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Basic Information
| ChEMBL ID | CHEMBL522417 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DQBQZHQMSBSJGQ-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
393.5
MW (Da)
3.58
ALogP
4
HBA
0
HBD
36.0
PSA (Ų)
0.64
QED
0
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 7.2
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 7 CHEMBL3155 | Ki | 7.2 | 7.2 | 63.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 7 | Ki | = | 63.0 | nM | 7.2 | Displacement of [3H]LSD from human recombinant 5HT7 receptor expressed in CHOK1 ... | 19326916 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 19326916 | 10.1021/jm8014553 | 5-hydroxytryptamine receptor 7 | 1 |
| 19326916 | 10.1021/jm8014553 | 5-hydroxytryptamine receptor 1A | 1 |
Data from ChEMBL 36 via Core Engine