COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK400618
Chemical Name: 2-bromo-5-ethoxy-4-(prop-2-en-1-yloxy)benzonitrile
Smiles: C=CCOc1cc(Br)c(cc1OCC)C#N

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Molecular Weight: 282.14
Empirical Formula: C12H12BrNO2

Physical State: Dry powder
Available Amount: 107 mg

Lipinsky:
logP: 3.859
Rotatable bonds: 5
H-donors: 0
H-acceptors: 2
PSA: 42
Number of rings: 1

     

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