SMILES:
CCCCOC(=O)C1=CC=CC=C1N
Aroma Description:
petitgrain, plum, sweet, grape, fruity, winey, floral, berry, powdery, chemical1
SMILES:
CCCCOC(=O)C1=CC=CC=C1N
Aroma Description:
petitgrain, plum, sweet, grape, fruity, winey, floral, berry, powdery, chemical
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).