| Synonyms: | |
| Status: | Phase 2 |
| Entry Type: | Small molecule |
| Molecule Category: | UNKNOWN |
| UNII: | V55S2QJN2X |
Structure
| InChI Key | KCWZGJVSDFYRIX-YFKPBYRVSA-N |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C7H15N5O4 |
| Molecular Weight | 233.23 |
| AlogP | -1.43 |
| Hydrogen Bond Acceptor | 6.0 |
| Hydrogen Bond Donor | 4.0 |
| Number of Rotational Bond | 6.0 |
| Polar Surface Area | 143.37 |
| Molecular species | NEUTRAL |
| Aromatic Rings | 0.0 |
| Heavy Atoms | 16.0 |
Pharmacology
| Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
|---|---|---|---|---|---|---|
|
Enzyme
|
- | 1500-2700 | - | - | - |
Indications
| Mesh Heading | Maximum Phase | Mesh ID | Reference |
|---|---|---|---|
| Asthma | 2 | D001249 | ClinicalTrials |
| Cardiovascular Diseases | 1 | D002318 | ClinicalTrials |
Cross References
| Resources | Reference |
|---|---|
| ChEBI | 7549 |
| ChEMBL | CHEMBL7890 |
| DrugBank | DB12750 |
| EPA CompTox | DTXSID5040540 |
| FDA SRS | V55S2QJN2X |
| Guide to Pharmacology | 5213 |
| KEGG | C04337 |
| SureChEMBL | SCHEMBL3034749 |
| ZINC | ZINC000015987659 |
CONTENTS