COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK698242
Chemical Name: ethyl(2E)-3-{3-bromo-4-[2-(4-tert-butylphenoxy)ethoxy]-5-ethoxyphenyl}-2-cyanoprop-2-enoate
Smiles: CCOC(=O)/C(=C/c1cc(Br)c(c(c1)OCC)OCCOc1ccc(cc1)C(C)(C)C)/C#N

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Molecular Weight: 516.43
Empirical Formula: C26H30BrNO5

Physical State: Dry powder
Available Amount: 250 mg

Lipinsky:
logP: 6.835
Rotatable bonds: 10
H-donors: 0
H-acceptors: 5
PSA: 77
Number of rings: 2

     

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