COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK155133
Chemical Name: methyl2-{(5E)-5-[2-bromo-5-methoxy-4-(prop-2-yn-1-yloxy)benzylidene]-2,4-dioxo-1,3-thiazolidin-3-yl}propanoate
Smiles: COc1cc(/C=C\2/SC(=O)N(C2=O)C(C(=O)OC)C)c(cc1OCC#C)Br

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Molecular Weight: 454.3
Empirical Formula: C18H16BrNO6S

Physical State: Dry powder
Available Amount: 150 mg

Lipinsky:
logP: 4.034
Rotatable bonds: 7
H-donors: 0
H-acceptors: 6
PSA: 107
Number of rings: 2

     

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