COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL357937
Chemical Name: {4-[(E)-{3-[4-(dimethylamino)phenyl]-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene}methyl]-2-ethoxyphenoxy}acetonitrile
Smiles: CCOc1cc(ccc1OCC#N)/C=C\1/SC(=S)N(C1=O)c1ccc(cc1)N(C)C

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Molecular Weight: 439.56
Empirical Formula: C22H21N3O3S2

Physical State: Dry powder
Available Amount: 1196 mg

Lipinsky:
logP: 4.613
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 123
Number of rings: 3

     

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