COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK694394
Chemical Name: 2-(3,4-diethoxyphenyl)-3-oxobutanenitrile
Smiles: CCOc1cc(ccc1OCC)C(C(=O)C)C#N

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Molecular Weight: 247.29
Empirical Formula: C14H17NO3

Physical State: Dry powder
Available Amount: 71 mg

Lipinsky:
logP: 2.035
Rotatable bonds: 6
H-donors: 0
H-acceptors: 3
PSA: 59
Number of rings: 1

     

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