COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK054281
Chemical Name: 2-bromo-4-[(E)-(3-ethyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-6-methoxyphenyl4-methylbenzenesulfonate
Smiles: CCN1C(=S)S/C(=C/c2cc(Br)c(c(c2)OC)OS(=O)(=O)c2ccc(cc2)C)/C1=O

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Molecular Weight: 528.47
Empirical Formula: C20H18BrNO5S3

Physical State: Dry powder
Available Amount: 84 mg

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

     

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