| Synonyms: | |
| Status: | Phase 1 |
| Entry Type: | Small molecule |
| Molecule Category: | UNKNOWN |
| UNII: | DJF621DE4F |
Structure
| InChI Key | FLBKPDIBGNWXMT-NIQZGXKPSA-N |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C21H26N10O4 |
| Molecular Weight | 482.51 |
| AlogP | -0.58 |
| Hydrogen Bond Acceptor | 14.0 |
| Hydrogen Bond Donor | 5.0 |
| Number of Rotational Bond | 8.0 |
| Polar Surface Area | 195.17 |
| Molecular species | NEUTRAL |
| Aromatic Rings | 4.0 |
| Heavy Atoms | 35.0 |
Pharmacology
| Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
|---|---|---|---|---|---|---|
|
Membrane receptor
Family A G protein-coupled receptor
Small molecule receptor (family A GPCR)
Nucleotide-like receptor (family A GPCR)
Adenosine receptor
|
51-1300 | 0 | 5 | 2-46 | - |
Indications
| Mesh Heading | Maximum Phase | Mesh ID | Reference |
|---|---|---|---|
| Acute Lung Injury | 1 | D055371 | ClinicalTrials |
Related Entries
Scaffolds
Cross References
| Resources | Reference |
|---|---|
| ChEMBL | CHEMBL186113 |
| FDA SRS | DJF621DE4F |
| PubChem | 9869857 |
| SureChEMBL | SCHEMBL1979140 |
| ZINC | ZINC000003951024 |
CONTENTS