COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK153965
Chemical Name: ethyl(2E)-3-{3-bromo-5-ethoxy-4-[2-(2-methylphenoxy)ethoxy]phenyl}-2-cyanoprop-2-enoate
Smiles: CCOC(=O)/C(=C/c1cc(Br)c(c(c1)OCC)OCCOc1ccccc1C)/C#N

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Molecular Weight: 474.35
Empirical Formula: C23H24BrNO5

Physical State: Dry powder
Available Amount: 192 mg

Lipinsky:
logP: 5.607
Rotatable bonds: 11
H-donors: 0
H-acceptors: 5
PSA: 77
Number of rings: 2

     

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