Compound Detail
CHEMBL4207901
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Basic Information
| ChEMBL ID | CHEMBL4207901 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | RTQQHWAYUSQYSP-UHFFFAOYSA-N |
1
Targets
3
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
228.3
MW (Da)
2.34
ALogP
3
HBA
1
HBD
38.1
PSA (Ų)
0.81
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 3 meas. best 6.3
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 7 CHEMBL3155 | Ki | 6.3 | 6.3 | 501.2 | 3 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 7 | Ki | = | 506.0 | nM | 6.3 | Displacement of [3H]LSD from human 5-HT7 receptor expressed in HEK cell membrane... | 30028132 |
| 5-hydroxytryptamine receptor 7 | Ki | = | 501.19 | nM | 6.3 | Displacement of [3H]LSD from human 5-HT7 receptor expressed in HEK cell membrane... | 30028132 |
| 5-hydroxytryptamine receptor 7 | Ki | = | 506.0 | nM | 6.3 | Measurement of Binding Affinity for Serotonin 5-HT7 Receptor: Human gene recombi... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 30028132 | 10.1021/acs.jmedchem.8b00642 | 5-hydroxytryptamine receptor 7 | 2 |
Data from ChEMBL 36 via Core Engine