butane-1-thiol

SMILES:
CCCCS

Aroma Description:
sulfurous, garlic, onion, eggnog, coffee, fatty, beefy, roasted, cooked1

Receptor log10 EC50 Adj. Top Antagonist? Correlated Perceptual Qualities
OR2W1 - 2.5 2  fatty, sweet, herbal, cucumber, orange, tart, mimosa, spicy, coumarinic, passionfruit
 

butane-1-thiol

SMILES:
CCCCS

Aroma Description:
sulfurous, garlic, onion, eggnog, coffee, fatty, beefy, roasted, cooked

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.