| Status: | Approved |
| Entry Type: | Small molecule |
| Molecule Category: | UNKNOWN |
| UNII: | TN1B5910V2 |
Structure
| InChI Key | DSFGXPJYDCSWTA-UHFFFAOYSA-N |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C13H21N5O4 |
| Molecular Weight | 311.34 |
| AlogP | -2.28 |
| Hydrogen Bond Acceptor | 9.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 6.0 |
| Polar Surface Area | 105.52 |
| Molecular species | BASE |
| Aromatic Rings | 2.0 |
| Heavy Atoms | 22.0 |
Related Entries
Scaffolds
Cross References
| Resources | Reference |
|---|---|
| ChEBI | 94314 |
| ChEMBL | CHEMBL1624126 |
| DrugBank | DB09092 |
| DrugCentral | 4368 |
| EPA CompTox | DTXSID1048255 |
| FDA SRS | TN1B5910V2 |
| PubChem | 9913 |
| SureChEMBL | SCHEMBL121656 |
CONTENTS