| Trade Names | |
| Synonyms | |
| Status | |
| Molecule Category | Salt-form |
| UNII | E669Z6S1JG |
| EPA CompTox | DTXSID9021718 |
Structure
| InChI Key | RHTNTTODYGNRSP-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C10H13ClN2 |
| Molecular Weight | 196.68 |
| AlogP | 1.23 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 24.39 |
| Molecular species | BASE |
| Aromatic Rings | 1.0 |
| Heavy Atoms | 12.0 |
Pharmacology
| Mechanism of Action | Action | Reference |
|---|---|---|
| Adrenergic receptor alpha antagonist | ANTAGONIST | ISBN PubMed PubMed DailyMed |
| Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
|---|---|---|---|---|---|---|
|
Transporter
Electrochemical transporter
SLC superfamily of solute carriers
SLC21/SLCO family of organic anion transporting polypeptides
|
- | - | - | - | 74.2-98.49 |
Cricetulus griseus
Target Conservation
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Protein: Adrenergic receptor alpha Description: Alpha-2A adrenergic receptor Organism : Homo sapiens P08913 ENSG00000150594 |
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Protein: Adrenergic receptor alpha Description: Alpha-2B adrenergic receptor Organism : Homo sapiens P18089 ENSG00000274286 |
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Protein: Adrenergic receptor alpha Description: Alpha-2C adrenergic receptor Organism : Homo sapiens P18825 ENSG00000184160 |
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Protein: Histamine H2 receptor Description: Histamine H2 receptor Organism : Homo sapiens P25021 ENSG00000113749 |
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Protein: Adrenergic receptor alpha Description: Alpha-1D adrenergic receptor Organism : Homo sapiens P25100 ENSG00000171873 |
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Protein: Adrenergic receptor alpha Description: Alpha-1A adrenergic receptor Organism : Homo sapiens P35348 ENSG00000120907 |
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Protein: Histamine H1 receptor Description: Histamine H1 receptor Organism : Homo sapiens P35367 ENSG00000196639 |
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Protein: Adrenergic receptor alpha Description: Alpha-1B adrenergic receptor Organism : Homo sapiens P35368 ENSG00000170214 |
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Cross References
| Resources | Reference |
|---|---|
| ChEBI | 9615 |
| ChEMBL | CHEMBL1689 |
| FDA SRS | E669Z6S1JG |
| PubChem | 6048 |
| SureChEMBL | SCHEMBL34869 |
CONTENTS
