COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL419223
Chemical Name: (5E)-5-[2-(butan-2-yloxy)benzylidene]-3-(3,4-dimethylphenyl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: CCC(Oc1ccccc1/C=C\1/SC(=S)N(C1=O)c1ccc(c(c1)C)C)C

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Molecular Weight: 397.56
Empirical Formula: C22H23NO2S2

Physical State: Dry powder
Available Amount: 62 mg

Lipinsky:
logP: 6.792
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 86
Number of rings: 3

     

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