COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK292950
Chemical Name: 3-[(E)-2-{4-[(4-bromobenzyl)oxy]-3-ethoxyphenyl}-1-cyanoethenyl]benzonitrile
Smiles: CCOc1cc(ccc1OCc1ccc(cc1)Br)/C=C(\c1cccc(c1)C#N)/C#N

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Molecular Weight: 459.34
Empirical Formula: C25H19BrN2O2

Physical State: Dry powder
Available Amount: 90 mg

Lipinsky:
logP: 6.687
Rotatable bonds: 6
H-donors: 0
H-acceptors: 2
PSA: 66
Number of rings: 3

     

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