Compound Detail
CHEMBL338297
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL338297 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PQHQBRJAAZQXHL-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
307.1
MW (Da)
1.81
ALogP
3
HBA
1
HBD
44.5
PSA (Ų)
0.86
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 8.72
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Serotonin receptor 2a and 2c (5HT2A and 5HT2C) CHEMBL2111383 | Ki | 8.72 | 7.905 | 1.9 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Serotonin receptor 2a and 2c (5HT2A and 5HT2C) | Ki | = | 1.9 | nM | 8.72 | Tested for the binding affinity against the site labelled by the 5-hydroxytrypta... | 7996545 |
| Serotonin receptor 2a and 2c (5HT2A and 5HT2C) | Ki | = | 80.9 | nM | 7.09 | Tested for the binding affinity against the site labelled by the 5-hydroxytrypta... | 7996545 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 7996545 | 10.1021/jm00051a011 | Serotonin receptor 2a and 2c (5HT2A and 5HT2C) | 2 |
| 7996545 | 10.1021/jm00051a011 | Rattus norvegicus | 1 |
| 9748359 | 10.1021/jm980144c | Homo sapiens | 1 |
| - | 10.1007/s00044-012-9977-1 | Whole blood | 1 |
Data from ChEMBL 36 via Core Engine