| Synonyms: | |
| Status: | Phase 1 |
| Entry Type: | Small molecule |
| Molecule Category: | UNKNOWN |
| UNII: | 1QTA9P992C |
Structure
| InChI Key | AWDJJMXJUOHGLC-UHFFFAOYSA-N |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C21H25N7O2S |
| Molecular Weight | 439.55 |
| AlogP | 3.76 |
| Hydrogen Bond Acceptor | 10.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 6.0 |
| Polar Surface Area | 103.78 |
| Molecular species | NEUTRAL |
| Aromatic Rings | 4.0 |
| Heavy Atoms | 31.0 |
Indications
| Mesh Heading | Maximum Phase | Mesh ID | Reference |
|---|---|---|---|
| Huntington Disease | 1 | D006816 | ClinicalTrials |
| Depressive Disorder | 1 | D003866 | ClinicalTrials |
Related Entries
Scaffolds
Cross References
| Resources | Reference |
|---|---|
| ChEMBL | CHEMBL4297384 |
| DrugBank | DB12542 |
| EPA CompTox | DTXSID40222401 |
| FDA SRS | 1QTA9P992C |
| PubChem | 10252640 |
| SureChEMBL | SCHEMBL2412775 |
| ZINC | ZINC000038428932 |
CONTENTS