| Trade Names | |
| Synonyms | |
| Status | |
| Molecule Category | Salt-form |
| UNII | 1K860WSG25 |
| EPA CompTox | DTXSID3046792 |
| Parent Compound: | CINACALCET |
| InChI Key | QANQWUQOEJZMLL-PKLMIRHRSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C22H23ClF3N |
| Molecular Weight | 393.88 |
| AlogP | 6.14 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 6.0 |
| Polar Surface Area | 12.03 |
| Molecular species | BASE |
| Aromatic Rings | 3.0 |
| Heavy Atoms | 26.0 |
| Mechanism of Action | Action | Reference |
|---|---|---|
| Calcium sensing receptor positive allosteric modulator | POSITIVE ALLOSTERIC MODULATOR | DailyMed |
| Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
|---|---|---|---|---|---|---|
|
Membrane receptor
Family C G protein-coupled receptor
Ion receptor (family C GPCR)
Calcium sensing receptor
Calcium sensing receptor
|
19.95-180 | - | - | - | - |
|
Protein: Calcium sensing receptor Description: Extracellular calcium-sensing receptor Organism : Homo sapiens P41180 ENSG00000036828 |
||||
| Resources | Reference |
|---|---|
| ChEBI | 48391 |
| ChEMBL | CHEMBL1200776 |
| FDA SRS | 1K860WSG25 |
| KEGG | D03504 |
| PubChem | 156418 |
| SureChEMBL | SCHEMBL133710 |
| ZINC | ZINC01550499 |