Compound Detail
CHEMBL266081
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Basic Information
| ChEMBL ID | CHEMBL266081 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | KRFFYWFYIARGFH-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
441.9
MW (Da)
2.93
ALogP
7
HBA
1
HBD
93.8
PSA (Ų)
0.61
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 7.93
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Adrenergic receptor alpha-1 CHEMBL1907610 | IC50 | 7.93 | 7.93 | 11.8 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Adrenergic receptor alpha-1 | IC50 | = | 11.75 | nM | 7.93 | Binding affinity at Alpha-1 adrenergic receptor sites on rat cerebral cortical m... | 2535878 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 2535878 | 10.1021/jm00121a020 | Adrenergic receptor alpha-1 | 2 |
Data from ChEMBL 36 via Core Engine