Compound Detail
CHEMBL183676
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Basic Information
| ChEMBL ID | CHEMBL183676 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | MVIHSJGOHZXKPF-SFHVURJKSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
333.4
MW (Da)
4.38
ALogP
3
HBA
0
HBD
21.7
PSA (Ų)
0.71
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 7.12
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 7 CHEMBL3223 | Ki | 7.12 | 7.12 | 75.9 | 1 |
| Unchecked CHEMBL612545 | Ki | 6.23 | 6.23 | 594.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 7 | Ki | = | 75.9 | nM | 7.12 | Binding affinity for rat serotonin 5-HT7 receptor expressed in Sf9 cells using [... | 15664850 |
| Unchecked | Ki | = | 594.0 | nM | 6.23 | Binding affinity for rat serotonin 5-HT1A receptor using [3H]8-OH-DPAT as radiol... | 15664850 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 15664850 | 10.1016/j.bmcl.2004.11.013 | Unchecked | 2 |
| 15664850 | 10.1016/j.bmcl.2004.11.013 | 5-hydroxytryptamine receptor 7 | 1 |
Data from ChEMBL 36 via Core Engine