| Synonyms: | |
| Status: | Phase 3 |
| Entry Type: | Small molecule |
| Molecule Category: | UNKNOWN |
| UNII: | 5X93W9OFZL |
Structure
| InChI Key | MCPKSFINULVDNX-UHFFFAOYSA-N |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C13H11N3O |
| Molecular Weight | 225.25 |
| AlogP | 2.43 |
| Hydrogen Bond Acceptor | 4.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 50.94 |
| Molecular species | NEUTRAL |
| Aromatic Rings | 3.0 |
| Heavy Atoms | 17.0 |
Related Entries
Scaffolds
Cross References
| Resources | Reference |
|---|---|
| ChEBI | 134926 |
| ChEMBL | CHEMBL1564747 |
| DrugCentral | 3166 |
| EPA CompTox | DTXSID1027479 |
| FDA SRS | 5X93W9OFZL |
| PubChem | 17113 |
| SureChEMBL | SCHEMBL15616 |
| ZINC | ZINC000000001336 |
CONTENTS