Compound Detail
CHEMBL2331790
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Basic Information
| ChEMBL ID | CHEMBL2331790 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | JZNMNGVJKQNDNM-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
370.2
MW (Da)
1.78
ALogP
4
HBA
1
HBD
47.2
PSA (Ų)
0.82
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 5.14
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 2C CHEMBL225 | Ki | 5.14 | 5.14 | 7200.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 2C | Ki | = | 7244.36 | nM | 5.14 | Displacement of [3H]mesulergine from human 5HT2C receptor expressed in tsA201 ce... | 23301527 |
| 5-hydroxytryptamine receptor 2C | Ki | = | 7200.0 | nM | 5.14 | Displacement of [3H]mesulergine from human 5HT2C receptor expressed in tsA201 ce... | 23301527 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 23301527 | 10.1021/jm301656h | 5-hydroxytryptamine receptor 2C | 2 |
| 23301527 | 10.1021/jm301656h | 5-hydroxytryptamine receptor 2A | 1 |
Data from ChEMBL 36 via Core Engine