COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL378899
Chemical Name: (5Z)-5-[4-(benzyloxy)-3,5-diiodobenzylidene]-3-(4-ethoxyphenyl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: CCOc1ccc(cc1)N1C(=S)S/C(=C\c2cc(I)c(c(c2)I)OCc2ccccc2)/C1=O

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Molecular Weight: 699.37
Empirical Formula: C25H19I2NO3S2

Physical State: Dry powder
Available Amount: 594 mg

Lipinsky:
logP: 8.336
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 96
Number of rings: 4

     

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