Synonyms: | |
Status: | Phase 3 |
Entry Type: | Small molecule |
Molecule Category: | UNKNOWN |
UNII: | Y310PA316B |
InChI Key | HPMRFMKYPGXPEP-UHFFFAOYSA-N |
---|---|
Smile | |
InChI |
|
Property Name | Value |
---|---|
Molecular Formula | C11H12N2O2 |
Molecular Weight | 204.23 |
AlogP | 0.83 |
Hydrogen Bond Acceptor | 4.0 |
Hydrogen Bond Donor | 1.0 |
Number of Rotational Bond | 1.0 |
Polar Surface Area | 42.85 |
Molecular species | BASE |
Aromatic Rings | 1.0 |
Heavy Atoms | 15.0 |
Action | Mechanism of Action | Reference |
---|---|---|
ANTAGONIST | Adrenergic receptor alpha-2 antagonist | PubMed |
Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
---|---|---|---|---|---|---|
Enzyme
Oxidoreductase
|
- | - | - | 28 | - | |
Membrane receptor
Family A G protein-coupled receptor
Small molecule receptor (family A GPCR)
Monoamine receptor
Adrenergic receptor
|
- | 1650 | 2-32 | 2-11 | - | |
Other cytosolic protein
|
- | - | - | 8-1256 | - |
Mesh Heading | Maximum Phase | Mesh ID | Reference |
---|---|---|---|
Depressive Disorder, Major | 3 | D003865 | ClinicalTrials |
Alzheimer Disease | 0 | D000544 | ClinicalTrials |
Resources | Reference |
---|---|
CAS NUMBER | 79944-58-4 |
ChEBI | 5862 |
ChEMBL | CHEMBL10316 |
DrugBank | DB12551 |
EPA CompTox | DTXSID6045161 |
FDA SRS | Y310PA316B |
KEGG | C10968 |
PubChem | 54459 |
SureChEMBL | SCHEMBL114731 |