COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK398127
Chemical Name: 4-butoxy-3-chloro-5-ethoxybenzonitrile
Smiles: CCCCOc1c(Cl)cc(cc1OCC)C#N

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Molecular Weight: 253.73
Empirical Formula: C13H16ClNO2

Physical State: Dry powder
Available Amount: 20 mg

Lipinsky:
logP: 4.573
Rotatable bonds: 6
H-donors: 0
H-acceptors: 2
PSA: 42
Number of rings: 1

     

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