| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | I61243PDCC |
| EPA CompTox | DTXSID301024236 |
| InChI Key | OCFOTEIMZBKQFS-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C22H45N5O12 |
| Molecular Weight | 571.31 |
| AlogP | -7.95 |
| Hydrogen Bond Acceptor | 17.0 |
| Hydrogen Bond Donor | 13.0 |
| Number of Rotational Bond | 11.0 |
| Polar Surface Area | 314.87 |
| Heavy Atoms | 39.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 59733-86-7 |
| NORMAN SUSDAT | |
| FDA SRS | I61243PDCC |