COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL372084
Chemical Name: (5E)-3-(1,3-benzodioxol-5-yl)-5-(2-ethoxy-3,5-diiodobenzylidene)-2-thioxo-1,3-thiazolidin-4-one
Smiles: CCOc1c(cc(cc1I)I)/C=C\1/SC(=S)N(C1=O)c1ccc2c(c1)OCO2

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Molecular Weight: 637.26
Empirical Formula: C19H13I2NO4S2

Physical State: Dry powder
Available Amount: 1285 mg

Lipinsky:
logP: 6.799
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 105
Number of rings: 4

     

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