COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK398131
Chemical Name: 2-bromo-4-butoxy-5-methoxybenzonitrile
Smiles: COc1cc(C#N)c(cc1OCCCC)Br

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Molecular Weight: 284.15
Empirical Formula: C12H14BrNO2

Physical State: Dry powder
Available Amount: 57 mg

Lipinsky:
logP: 4.117
Rotatable bonds: 5
H-donors: 0
H-acceptors: 2
PSA: 42
Number of rings: 1

     

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