COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL416015
Chemical Name: methyl(2E)-3-[3-bromo-5-methoxy-4-(prop-2-yn-1-yloxy)phenyl]-2-cyanoprop-2-enoate
Smiles: C#CCOc1c(Br)cc(cc1OC)/C=C(/C(=O)OC)\C#N

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Molecular Weight: 350.17
Empirical Formula: C15H12BrNO4

Physical State: Dry powder
Available Amount: 215 mg

Lipinsky:
logP: 2.445
Rotatable bonds: 6
H-donors: 0
H-acceptors: 4
PSA: 68
Number of rings: 1

     

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