Compound Detail
CHEMBL7067
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Basic Information
| ChEMBL ID | CHEMBL7067 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | IIVGKARVLHONDS-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
6
Publications
0
Known Names
Molecular Properties
365.5
MW (Da)
2.92
ALogP
4
HBA
3
HBD
80.3
PSA (Ų)
0.57
QED
0
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Kd 1 meas. best 6.2
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Adrenergic receptor alpha-1 CHEMBL2094251 | Kd | 6.2 | 6.2 | 631.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Adrenergic receptor alpha-1 | Kd | = | 630.96 | nM | 6.2 | The compound was evaluated for the antagonistic activity against alpha-1 adrener... | 3012084 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 3012084 | 10.1021/jm00156a019 | Rattus norvegicus | 4 |
| 3012084 | 10.1021/jm00156a019 | Beta-1 adrenergic receptor | 2 |
| 3012084 | 10.1021/jm00156a019 | Beta-2 adrenergic receptor | 1 |
| 3012084 | 10.1021/jm00156a019 | Adrenergic receptor alpha-1 | 1 |
| 3012084 | 10.1021/jm00156a019 | Adrenergic receptor alpha-2 | 1 |
| 3012084 | 10.1021/jm00156a019 | Cavia porcellus | 1 |
Data from ChEMBL 36 via Core Engine