COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL372080
Chemical Name: N-(3,4-dimethylphenyl)-2-[(5E)-5-{3-ethoxy-4-[(4-iodobenzyl)oxy]-5-(prop-2-en-1-yl)benzylidene}-2,4-dioxo-1,3-thiazolidin-3-yl]acetamide
Smiles: CCOc1cc(/C=C\2/SC(=O)N(C2=O)CC(=O)Nc2ccc(c(c2)C)C)cc(c1OCc1ccc(cc1)I)CC=C

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Molecular Weight: 682.58
Empirical Formula: C32H31IN2O5S

Physical State: Dry powder
Available Amount: 1135 mg

Lipinsky:
logP: 8.559
Rotatable bonds: 9
H-donors: 1
H-acceptors: 5
PSA: 110
Number of rings: 4

     

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