COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK434349
Chemical Name: (2Z)-4,4-dimethyl-3-oxo-2-(4-propoxybenzylidene)pentanenitrile
Smiles: CCCOc1ccc(cc1)/C=C(\C(=O)C(C)(C)C)/C#N

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Molecular Weight: 271.36
Empirical Formula: C17H21NO2

Physical State: Dry powder
Available Amount: 704 mg

Lipinsky:
logP: 4.061
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 50
Number of rings: 1

     

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