COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK861802
Chemical Name: (5E)-3-[2-(3,4-dimethoxyphenyl)ethyl]-5-(3-ethoxy-4-hydroxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one
Smiles: CCOc1cc(ccc1O)/C=C\1/SC(=S)N(C1=O)CCc1ccc(c(c1)OC)OC

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Molecular Weight: 445.56
Empirical Formula: C22H23NO5S2

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 3.557
Rotatable bonds: 9
H-donors: 1
H-acceptors: 5
PSA: 125
Number of rings: 3

     

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