| Synonyms: | |
| Status: | Approved (1987) |
| Entry Type: | Small molecule |
| Molecule Category: | UNKNOWN |
| UNII: | C2A5X08042 |
| InChI Key | ISEHJSHTIVKELA-UHFFFAOYSA-N |
|---|---|
| Smile | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C12H18IN |
| Molecular Weight | 303.19 |
| AlogP | 3.22 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 12.03 |
| Molecular species | BASE |
| Aromatic Rings | 1.0 |
| Heavy Atoms | 14.0 |
| Resources | Reference |
|---|---|
| ChEMBL | CHEMBL1201308 |
| EPA CompTox | DTXSID3048443 |
| FDA SRS | C2A5X08042 |
| PubChem | 3729 |
| SureChEMBL | SCHEMBL1534301 |