COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL416016
Chemical Name: methyl(2E)-3-[4-(benzyloxy)-3-bromo-5-methoxyphenyl]-2-cyanoprop-2-enoate
Smiles: COC(=O)/C(=C/c1cc(Br)c(c(c1)OC)OCc1ccccc1)/C#N

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Molecular Weight: 402.24
Empirical Formula: C19H16BrNO4

Physical State: Dry powder
Available Amount: 240 mg

Lipinsky:
logP: 4.063
Rotatable bonds: 6
H-donors: 0
H-acceptors: 4
PSA: 68
Number of rings: 2

     

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