| Synonyms: | |
| Status: | Phase 2 |
| Entry Type: | Small molecule |
| Molecule Category: | UNKNOWN |
| UNII: | 8Y3GDT6YWV |
Structure
| InChI Key | DSFNLJXHXBIKDS-UHFFFAOYSA-N |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C22H15Br2N3O4 |
| Molecular Weight | 545.19 |
| AlogP | 5.69 |
| Hydrogen Bond Acceptor | 6.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 6.0 |
| Polar Surface Area | 97.48 |
| Molecular species | ACID |
| Aromatic Rings | 4.0 |
| Heavy Atoms | 31.0 |
Indications
| Mesh Heading | Maximum Phase | Mesh ID | Reference |
|---|---|---|---|
| Digestive System Diseases | 2 | D004066 | ClinicalTrials |
Related Entries
Scaffolds
Cross References
| Resources | Reference |
|---|---|
| ChEMBL | CHEMBL4297392 |
| DrugBank | DB12959 |
| FDA SRS | 8Y3GDT6YWV |
| PubChem | 135565181 |
| SureChEMBL | SCHEMBL1114552 |
| ZINC | ZINC000068151296 |
CONTENTS