Synonyms: | |
Status: | Approved (1987) |
Entry Type: | Small molecule |
Molecule Category: | UNKNOWN |
UNII: | C2A5X08042 |
InChI Key | ISEHJSHTIVKELA-UHFFFAOYSA-N |
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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 |
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ChEMBL | CHEMBL1201308 |
EPA CompTox | DTXSID3048443 |
FDA SRS | C2A5X08042 |
PubChem | 3729 |
SureChEMBL | SCHEMBL1534301 |