COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL428706
Chemical Name: [(5E)-5-{3-bromo-4-[(3-fluorobenzyl)oxy]-5-methoxybenzylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]aceticacid
Smiles: COc1cc(/C=C\2/SC(=S)N(C2=O)CC(=O)O)cc(c1OCc1cccc(c1)F)Br

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Molecular Weight: 512.38
Empirical Formula: C20H15BrFNO5S2

Physical State: Dry powder
Available Amount: 214 mg

Lipinsky:
logP: 3.962
Rotatable bonds: 8
H-donors: 1
H-acceptors: 5
PSA: 133
Number of rings: 3

     

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