COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL378911
Chemical Name: (5E)-5-[3,5-diiodo-4-(prop-2-yn-1-yloxy)benzylidene]-3-(2-methoxyphenyl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: C#CCOc1c(I)cc(cc1I)/C=C\1/SC(=S)N(C1=O)c1ccccc1OC

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Molecular Weight: 633.27
Empirical Formula: C20H13I2NO3S2

Physical State: Dry powder
Available Amount: 1304 mg

Lipinsky:
logP: 6.186
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 96
Number of rings: 3

     

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