COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK961598
Chemical Name: 4-[(1E)-2-cyano-3-ethoxy-3-oxoprop-1-en-1-yl]-2-methoxyphenyl4-bromobenzoate
Smiles: CCOC(=O)/C(=C/c1ccc(c(c1)OC)OC(=O)c1ccc(cc1)Br)/C#N

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Molecular Weight: 430.25
Empirical Formula: C20H16BrNO5

Available Amount: 0 mg

Lipinsky:
logP: 4.66
Rotatable bonds: 7
H-donors: 0
H-acceptors: 5
PSA: 85
Number of rings: 2

     

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