COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL418527
Chemical Name: (5E)-5-(3-bromo-4-hydroxy-5-methoxybenzylidene)-3-(4-nitrophenyl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: COc1cc(/C=C\2/SC(=S)N(C2=O)c2ccc(cc2)[N+](=O)[O-])cc(c1O)Br

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Molecular Weight: 467.32
Empirical Formula: C17H11BrN2O5S2

Physical State: Dry powder
Available Amount: 36 mg

Lipinsky:
logP: 4.584
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 152
Number of rings: 3

     

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