| Synonyms: | |
| Status: | Phase 3 |
| Entry Type: | Small molecule |
| Molecule Category: | UNKNOWN |
| ATC: | R06AX28 |
| UNII: | 2AE8M83G3E |
Structure
| InChI Key | WUZYKBABMWJHDL-UHFFFAOYSA-N |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C26H26ClN3 |
| Molecular Weight | 415.97 |
| AlogP | 5.63 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 0.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 29.02 |
| Molecular species | NEUTRAL |
| Aromatic Rings | 3.0 |
| Heavy Atoms | 30.0 |
Pharmacology
| Primary Target | |
|---|---|
| H1 receptor |
| Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
|---|---|---|---|---|---|---|
|
Membrane receptor
Family A G protein-coupled receptor
Small molecule receptor (family A GPCR)
Lipid-like ligand receptor (family A GPCR)
PAF receptor
|
- | 3700 | - | - | - | |
|
Membrane receptor
Family A G protein-coupled receptor
Small molecule receptor (family A GPCR)
Monoamine receptor
Histamine receptor
|
- | 4 | - | 4 | - |
Indications
| Mesh Heading | Maximum Phase | Mesh ID | Reference |
|---|---|---|---|
| Urticaria | 3 | D014581 | ClinicalTrials |
| Arthritis, Rheumatoid | 3 | D001172 | ClinicalTrials |
| Mastocytosis | 2 | D008415 | ClinicalTrials |
Related Entries
MCS
Scaffolds
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 158876-82-5 |
| ChEBI | 135673 |
| ChEMBL | CHEMBL91397 |
| DrugBank | DB11614 |
| DrugCentral | 2413 |
| EPA CompTox | DTXSID00166534 |
| FDA SRS | 2AE8M83G3E |
| Human Metabolome Database | HMDB0240234 |
| Guide to Pharmacology | 10103 |
| PharmGKB | PA165107052 |
| PubChem | 133017 |
| SureChEMBL | SCHEMBL27703 |
| ZINC | ZINC000000598829 |
CONTENTS