| Synonyms: | |
| Status: | Approved |
| Entry Type: | Small molecule |
| Molecule Category: | UNKNOWN |
| UNII: | M494UE2YEP |
Structure
| InChI Key | HCYFGRCYSCXKNQ-UHFFFAOYSA-N |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C9H10N4O4 |
| Molecular Weight | 238.2 |
| AlogP | -1.48 |
| Hydrogen Bond Acceptor | 7.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 99.12 |
| Molecular species | ACID |
| Aromatic Rings | 2.0 |
| Heavy Atoms | 17.0 |
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
|
- | - | - | 27600 | - |
Related Entries
Scaffolds
Cross References
| Resources | Reference |
|---|---|
| ChEBI | 94615 |
| ChEMBL | CHEMBL70246 |
| DrugBank | DB13573 |
| DrugCentral | 49 |
| EPA CompTox | DTXSID6057796 |
| FDA SRS | M494UE2YEP |
| PubChem | 69550 |
| SureChEMBL | SCHEMBL308514 |
| ZINC | ZINC000000057633 |
CONTENTS