| Synonyms: | |
| Status: | Phase 2 |
| Entry Type: | Small molecule |
| Molecule Category: | UNKNOWN |
| UNII: | JNG8L9460Y |
Structure
| InChI Key | AFNHHLILYQEHKK-BDAKNGLRSA-N |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C12H16N4O3 |
| Molecular Weight | 264.29 |
| AlogP | -0.96 |
| Hydrogen Bond Acceptor | 5.0 |
| Hydrogen Bond Donor | 4.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 105.24 |
| Molecular species | NEUTRAL |
| Aromatic Rings | 2.0 |
| Heavy Atoms | 19.0 |
Pharmacology
| Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
|---|---|---|---|---|---|---|
|
Enzyme
Transferase
|
- | - | - | 0-1 | - | |
|
Enzyme
|
- | - | - | 0-1 | - |
Indications
| Mesh Heading | Maximum Phase | Mesh ID | Reference |
|---|---|---|---|
| Osteoarthritis | 2 | D010003 | ClinicalTrials |
| Gout | 2 | D006073 | ClinicalTrials |
| Hyperuricemia | 2 | D033461 | ClinicalTrials |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 548486-59-5 |
| ChEMBL | CHEMBL269864 |
| DrugBank | DB12353 |
| EPA CompTox | DTXSID00203332 |
| FDA SRS | JNG8L9460Y |
| PubChem | 135449518 |
| SureChEMBL | SCHEMBL474735 |
CONTENTS