| Trade Names: | |
| Synonyms: | |
| Status: | Approved |
| Entry Type: | Small molecule |
| Molecule Category: | UNKNOWN |
| UNII: | 6V3I57K9UL |
Structure
| InChI Key | LAYLQVBQIBQVLL-UHFFFAOYSA-N |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C19H29IO2 |
| Molecular Weight | 416.34 |
| AlogP | 6.08 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 0.0 |
| Number of Rotational Bond | 11.0 |
| Polar Surface Area | 26.3 |
| Molecular species | None |
| Aromatic Rings | 1.0 |
| Heavy Atoms | 22.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 99-79-6 |
| ChEMBL | CHEMBL951 |
| EPA CompTox | DTXSID2052869 |
| FDA SRS | 6V3I57K9UL |
| SureChEMBL | SCHEMBL492663 |
CONTENTS