COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL378918
Chemical Name: (5E)-5-{2-bromo-5-methoxy-4-[(4-nitrobenzyl)oxy]benzylidene}-3-(2-methoxyphenyl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: COc1cc(/C=C\2/SC(=S)N(C2=O)c2ccccc2OC)c(cc1OCc1ccc(cc1)[N+](=O)[O-])Br

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Molecular Weight: 587.47
Empirical Formula: C25H19BrN2O6S2

Physical State: Dry powder
Available Amount: 1002 mg

Lipinsky:
logP: 6.736
Rotatable bonds: 5
H-donors: 0
H-acceptors: 6
PSA: 151
Number of rings: 4

     

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