Compound Detail
CHEMBL204174
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Basic Information
| ChEMBL ID | CHEMBL204174 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VLPUPQGQROBWIQ-KRWDZBQOSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
7
Publications
0
Known Names
Molecular Properties
381.5
MW (Da)
3.29
ALogP
5
HBA
0
HBD
63.7
PSA (Ų)
0.65
QED
0
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 6.34
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 7 CHEMBL3155 | Ki | 6.34 | 6.34 | 455.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 7 | Ki | = | 455.0 | nM | 6.34 | Displacement of [3H]5-HT from the cloned human 5-HT7 receptor expressed in CHO c... | 16337790 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 16337790 | 10.1016/j.bmcl.2005.11.067 | 5-hydroxytryptamine receptor 7 | 2 |
| 16337790 | 10.1016/j.bmcl.2005.11.067 | 5-hydroxytryptamine receptor 1A | 1 |
| 16337790 | 10.1016/j.bmcl.2005.11.067 | 5-hydroxytryptamine receptor 2A | 1 |
| 16337790 | 10.1016/j.bmcl.2005.11.067 | 5-hydroxytryptamine receptor 1B | 1 |
| 16337790 | 10.1016/j.bmcl.2005.11.067 | D(2) dopamine receptor | 1 |
| 16337790 | 10.1016/j.bmcl.2005.11.067 | Adrenergic receptor alpha-1 | 1 |
| 16337790 | 10.1016/j.bmcl.2005.11.067 | Voltage-gated inwardly rectifying potassium channel KCNH2 | 1 |
Data from ChEMBL 36 via Core Engine