COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL419121
Chemical Name: methyl(2-bromo-4-{(E)-[3-(3,4-dimethylphenyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}phenoxy)acetate
Smiles: COC(=O)COc1ccc(cc1Br)/C=C\1/SC(=S)N(C1=O)c1ccc(c(c1)C)C

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Molecular Weight: 492.41
Empirical Formula: C21H18BrNO4S2

Physical State: Dry powder
Available Amount: 169 mg

Lipinsky:
logP: 5.23
Rotatable bonds: 5
H-donors: 0
H-acceptors: 4
PSA: 113
Number of rings: 3

     

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