| Synonyms: | |
| Status: | Phase 2 |
| Entry Type: | Small molecule |
| Molecule Category: | UNKNOWN |
| UNII: | ZH8CPX4YNB |
Structure
| InChI Key | ZBQMTQGDBFZUBG-NRFANRHFSA-N |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C22H20ClFN2O2 |
| Molecular Weight | 398.87 |
| AlogP | 4.95 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 45.33 |
| Molecular species | NEUTRAL |
| Aromatic Rings | 3.0 |
| Heavy Atoms | 28.0 |
Pharmacology
Indications
| Mesh Heading | Maximum Phase | Mesh ID | Reference |
|---|---|---|---|
| Irritable Bowel Syndrome | 2 | D043183 | ClinicalTrials |
Related Entries
Scaffolds
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 895169-20-7 |
| ChEMBL | CHEMBL4297311 |
| DrugBank | DB14802 |
| FDA SRS | ZH8CPX4YNB |
| PubChem | 11524127 |
| SureChEMBL | SCHEMBL2033676 |
CONTENTS