COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL428797
Chemical Name: (5E)-5-(4-bromo-3-nitrobenzylidene)-3-(4-methoxyphenyl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: COc1ccc(cc1)N1C(=S)S/C(=C/c2ccc(c(c2)[N+](=O)[O-])Br)/C1=O

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Molecular Weight: 451.32
Empirical Formula: C17H11BrN2O4S2

Physical State: Dry powder
Available Amount: 126 mg

Lipinsky:
logP: 4.963
Rotatable bonds: 1
H-donors: 0
H-acceptors: 4
PSA: 132
Number of rings: 3

     

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