 |
| Ligand Name: 4‐ethyl‐4‐methylcyclohexan‐1‐one |
| Ligand Type: non-polymer |
| Ligand ID: COVPDB744 |
PubChem:
19084533
|
Synonym(s):
- 4-ethyl-4-methylcyclohexanone
- 35155-49-8
- 4-ethyl-4-methyl-cyclohexanone
- schembl7750061
- dtxsid50597915
- cyclohexanone, 4-ethyl-4-methyl-
- zinc72294352
- akos016844721
- mcule-9350827413
- ne47555
- j-515288
- z1359429512
show 11 synonym(s)
|
| DrugBank: - |
ChEMBL: - |
| Canonical SMILES: CCC1(C)CCC(=O)CC1 |
| Standard InChI: InChI=1S/C9H16O/c1-3-9(2)6-4-8(10)5-7-9/h3-7H2,1-2H3 |
| Molecular Formula: C9H16O |
Mol. Weight: 140.12012 |
logP: 2.5458 |
| HBD: 0 | HBA: 1 |
| #Rotatable Bonds: 1 | TPSA: 17.07 |