4-isopropylbenzaldehyde

SMILES:
CC(C)c1ccc(C=O)cc1

Aroma Description:
spicy, cumin, green, herbal1

Receptor log10 EC50 Adj. Top Antagonist? Correlated Perceptual Qualities
OR2W1 -4.509 3 -  fatty, sweet, herbal, cucumber, orange, tart, mimosa, spicy, coumarinic, passionfruit
OR51I2 - -0.9091 2   
 

4-isopropylbenzaldehyde

SMILES:
CC(C)c1ccc(C=O)cc1

Aroma Description:
spicy, cumin, green, herbal

Receptor Dock Score Affinity A100 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.
A100: A measure of the degree of activation of the receptor. See Ibrahim et al (2019).