Compound Detail
CHEMBL154088
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 | CHEMBL154088 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | MNWJZXUINCGSBQ-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
479.5
MW (Da)
2.33
ALogP
9
HBA
1
HBD
112.3
PSA (Ų)
0.60
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 8.11
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Adrenergic receptor alpha-1 CHEMBL1907610 | Ki | 8.11 | 8.11 | 7.8 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Adrenergic receptor alpha-1 | Ki | = | 7.8 | nM | 8.11 | Compound was tested for its binding affinity for alpha-1 adrenergic receptor sit... | 2879919 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 2879919 | 10.1021/jm00384a009 | Rattus norvegicus | 2 |
| 2879919 | 10.1021/jm00384a009 | Adrenergic receptor alpha-1 | 1 |
| 2879919 | 10.1021/jm00384a009 | Adrenergic receptor alpha-2 | 1 |
Data from ChEMBL 36 via Core Engine