2-(2-methylprop-1-enyl)-4-methyltetrahydropyran
SMILES:
CC1CCOC(C1)C=C(C)C
Aroma Description:
green, red_rose, spicy, fresh, geranium, vegetable, floral, herbal, camphoreous1
2-(2-methylprop-1-enyl)-4-methyltetrahydropyran
SMILES:
CC1CCOC(C1)C=C(C)C
Aroma Description:
green, red_rose, spicy, fresh, geranium, vegetable, floral, herbal, camphoreous
| Receptor | Agonist? | Dock Score | Pose1 | LSRB - LSP | Correlated Perceptual Qualities |
|---|
Dock Score: This is a measure of whether the algorithm thinks the odorant is an agonist of the receptor.
Affinity: The binding affinity, in kJ/mol, of the ligand docked in the active or inactive model, whichever is greater.
LSP: Ligand Surface Polarity, i.e. how much of the ligand's surface is hydrophilic.
LSRB: Ligand Surface Receptor Binding, i.e. how much of the ligand's surface interacts with receptor atoms.