| Synonyms: | |
| Status: | Phase 1 |
| Entry Type: | Small molecule |
| Molecule Category: | UKNOWN |
| UNII: | EAO0TD9B13 |
Structure
| InChI Key | KMUNHOKTIVSFRA-KXFIGUGUSA-N |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C11H13N5O3 |
| Molecular Weight | 263.26 |
| AlogP | -1.08 |
| Hydrogen Bond Acceptor | 7.0 |
| Hydrogen Bond Donor | 4.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 130.05 |
| Molecular species | NEUTRAL |
| Aromatic Rings | 2.0 |
| Heavy Atoms | 19.0 |
Pharmacology
| Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
|---|---|---|---|---|---|---|
|
Enzyme
|
- | - | - | 3 | - |
Related Entries
Scaffolds
Cross References
| Resources | Reference |
|---|---|
| ChEMBL | CHEMBL265948 |
| DrugBank | DB12438 |
| EPA CompTox | DTXSID10212612 |
| FDA SRS | EAO0TD9B13 |
| SureChEMBL | SCHEMBL1335812 |
| ZINC | ZINC000027651900 |
CONTENTS