COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL416020
Chemical Name: methyl(2E)-3-{3-bromo-4-[(4-bromobenzyl)oxy]-5-methoxyphenyl}-2-cyanoprop-2-enoate
Smiles: COC(=O)/C(=C/c1cc(Br)c(c(c1)OC)OCc1ccc(cc1)Br)/C#N

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Molecular Weight: 481.14
Empirical Formula: C19H15Br2NO4

Physical State: Dry powder
Available Amount: 238 mg

Lipinsky:
logP: 4.835
Rotatable bonds: 6
H-donors: 0
H-acceptors: 4
PSA: 68
Number of rings: 2

     

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