COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL419112
Chemical Name: (5E)-5-[5-bromo-3-methoxy-2-(prop-2-yn-1-yloxy)benzylidene]-3-(3,4-dimethylphenyl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: C#CCOc1c(cc(cc1OC)Br)/C=C\1/SC(=S)N(C1=O)c1ccc(c(c1)C)C

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Molecular Weight: 488.43
Empirical Formula: C22H18BrNO3S2

Physical State: Dry powder
Available Amount: 178 mg

Lipinsky:
logP: 6.514
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 96
Number of rings: 3

     

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