| Synonyms: | |
| Status: | Phase 2 |
| Entry Type: | Small molecule |
| Molecule Category: | UNKNOWN |
| UNII: | 5XQC91CO1F |
Structure
| InChI Key | LTVKZVGAALCRFW-UHFFFAOYSA-N |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C16H18N8O2S |
| Molecular Weight | 386.44 |
| AlogP | -0.48 |
| Hydrogen Bond Acceptor | 10.0 |
| Hydrogen Bond Donor | 3.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 130.54 |
| Molecular species | BASE |
| Aromatic Rings | 3.0 |
| Heavy Atoms | 27.0 |
Pharmacology
| Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
|---|---|---|---|---|---|---|
|
Membrane receptor
|
- | - | - | - | 93 |
Indications
| Mesh Heading | Maximum Phase | Mesh ID | Reference |
|---|---|---|---|
| ST Elevation Myocardial Infarction | 2 | D000072657 | ClinicalTrials |
| Coronary Disease | 1 | D003327 | ClinicalTrials |
Related Entries
Scaffolds
Cross References
| Resources | Reference |
|---|---|
| ChEMBL | CHEMBL3114577 |
| FDA SRS | 5XQC91CO1F |
| SureChEMBL | SCHEMBL15130193 |
| ZINC | ZINC000103269095 |
CONTENTS