| Synonyms | |
| Molecule Category | Free-form |
| UNII | 03LY784Y58 |
| Source | Gaulton A, Kale N, van Westen GJ, Bellis LJ, Bento AP, Davies M, Hersey A, Papadatos G, Forster M, Wege P, Overington JP. A large-scale crop protection bioassay data set. Sci Data. 2015 Jul 7;2:150032. Read more ... |
Structure
| InChI Key | BGHCVCJVXZWKCC-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C14H30 |
| Molecular Weight | 198.39 |
| AlogP | 6.76 |
| Number of Rotational Bond | 11.0 |
| Heavy Atoms | 14.0 |
Cross References
| Resources | Reference |
|---|---|
| ChEMBL | CHEMBL135488 |
| FDA SRS | 03LY784Y58 |
| PDB | C14 |
| PubChem | 12389 |
| SureChEMBL | SCHEMBL33320 |
| ZINC | ZINC01698519 |
CONTENTS
