| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | BXL934H392 |
| EPA CompTox | DTXSID5057967 |
Structure
| InChI Key | NZPKARLAFLAVLO-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C5H12N3P1S1 |
| Molecular Weight | 177.05 |
| AlogP | 0.06 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 18.05 |
| Heavy Atoms | 10.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 13687-09-7 |
| NORMAN SUSDAT | |
| FDA SRS | BXL934H392 |
CONTENTS
