COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK008070
Chemical Name: 2-bromo-6-ethoxy-4-[(E)-(3-methyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]phenyl4-methylbenzenesulfonate
Smiles: CCOc1cc(/C=C\2/SC(=S)N(C2=O)C)cc(c1OS(=O)(=O)c1ccc(cc1)C)Br

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Molecular Weight: 528.47
Empirical Formula: C20H18BrNO5S3

Physical State: Dry powder
Available Amount: 94 mg

Lipinsky:
logP: 4.241
Rotatable bonds: 5
H-donors: 0
H-acceptors: 5
PSA: 138
Number of rings: 3

     

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