| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 1S169L7KAV |
Structure
| InChI Key | NMNXBEXPAHSXOK-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C15H15N3O1 |
| Molecular Weight | 253.12 |
| AlogP | 3.05 |
| Hydrogen Bond Acceptor | 4.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 50.94 |
| Heavy Atoms | 19.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 102791-47-9 |
| NORMAN SUSDAT | |
| FDA SRS | 1S169L7KAV |
CONTENTS
