Synonyms | |
Status | |
Molecule Category | UNKNOWN |
ATC | C04AX10 G04BE06 |
UNII | PW8QYA7KI0 |
EPA CompTox | DTXSID4023339 |
InChI Key | VRYMTAVOXVTQEF-UHFFFAOYSA-N |
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Smiles | |
InChI |
|
Property Name | Value |
---|---|
Molecular Formula | C16H25NO3 |
Molecular Weight | 279.38 |
AlogP | 2.98 |
Hydrogen Bond Acceptor | 4.0 |
Hydrogen Bond Donor | 0.0 |
Number of Rotational Bond | 6.0 |
Polar Surface Area | 38.77 |
Molecular species | BASE |
Aromatic Rings | 1.0 |
Heavy Atoms | 20.0 |
Mechanism of Action | Action | Reference |
---|---|---|
Adrenergic receptor alpha antagonist | ANTAGONIST | PubMed |
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: 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: Adrenergic receptor alpha Description: Alpha-1B adrenergic receptor Organism : Homo sapiens P35368 ENSG00000170214 |
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Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
---|---|---|---|---|---|---|
Membrane receptor
Family A G protein-coupled receptor
Small molecule receptor (family A GPCR)
Monoamine receptor
Adrenergic receptor
|
- | - | 31623 | - | - |
Resources | Reference |
---|---|
ChEBI | 94754 |
ChEMBL | CHEMBL159226 |
DrugBank | DB09205 |
DrugCentral | 1855 |
FDA SRS | PW8QYA7KI0 |
PubChem | 4260 |
SureChEMBL | SCHEMBL456546 |
ZINC | ZINC000000057401 |