COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK052008
Chemical Name: (5E)-5-[2-bromo-5-methoxy-4-(prop-2-yn-1-yloxy)benzylidene]-3-(prop-2-yn-1-yl)-1,3-thiazolidine-2,4-dione
Smiles: C#CCOc1cc(Br)c(cc1OC)/C=C\1/SC(=O)N(C1=O)CC#C

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Molecular Weight: 406.26
Empirical Formula: C17H12BrNO4S

Physical State: Dry powder
Available Amount: 92 mg

Lipinsky:
logP: 3.893
Rotatable bonds: 5
H-donors: 0
H-acceptors: 4
PSA: 81
Number of rings: 2

     

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