| Trade Names | |
| Synonyms | |
| Status | |
| Molecule Category | Salt-form |
| UNII | YV33CH63HI |
| EPA CompTox | DTXSID50238098 |
| Parent Compound: | PITOLISANT |
| InChI Key | XLFKECRRMPOAQS-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C17H27Cl2NO |
| Molecular Weight | 332.32 |
| AlogP | 4.17 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 8.0 |
| Polar Surface Area | 12.47 |
| Molecular species | BASE |
| Aromatic Rings | 1.0 |
| Heavy Atoms | 20.0 |
| Mechanism of Action | Action | Reference |
|---|---|---|
| Histamine H3 receptor inverse agonist | INVERSE AGONIST | FDA PubMed PubMed |
| 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
Histamine receptor
|
- | - | - | 27.6 | - |
|
Protein: Histamine H3 receptor Description: Histamine H3 receptor Organism : Homo sapiens Q9Y5N1 ENSG00000101180 |
||||
| Resources | Reference |
|---|---|
| ChEMBL | CHEMBL4164059 |
| FDA SRS | YV33CH63HI |
| PubChem | 11551689 |
| SureChEMBL | SCHEMBL4591893 |