Compound Detail
CHEMBL332337
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 | CHEMBL332337 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YJAURZZMQJKPEW-NVXWUHKLSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
270.4
MW (Da)
3.27
ALogP
2
HBA
1
HBD
28.3
PSA (Ų)
0.93
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 7.48
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Dopamine receptor CHEMBL2093868 | IC50 | 7.48 | 7.48 | 33.0 | 1 |
| Cerebral cortex alpha adrenergic receptor CHEMBL2111420 | IC50 | 7.34 | 7.34 | 46.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Dopamine receptor | IC50 | = | 33.0 | nM | 7.48 | In vitro affinity for dopamine receptor by displacement of [3H]- apomorphine in ... | 6298427 |
| Cerebral cortex alpha adrenergic receptor | IC50 | = | 46.0 | nM | 7.34 | In vitro affinity for alpha adrenergic receptor by displacement of 3[H]clonidine... | 6298427 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 6298427 | 10.1021/jm00357a010 | Cerebral cortex alpha adrenergic receptor | 1 |
| 6298427 | 10.1021/jm00357a010 | Dopamine receptor | 1 |
| 6298427 | 10.1021/jm00357a010 | Rattus norvegicus | 1 |
Data from ChEMBL 36 via Core Engine