COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK006171
Chemical Name: (5E)-3-ethyl-5-{3-methoxy-4-[(3-methylbenzyl)oxy]benzylidene}-2-thioxo-1,3-thiazolidin-4-one
Smiles: CCN1C(=S)S/C(=C/c2ccc(c(c2)OC)OCc2cccc(c2)C)/C1=O

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Molecular Weight: 399.53
Empirical Formula: C21H21NO3S2

Physical State: Dry powder
Available Amount: 92 mg

Lipinsky:
logP: 4.342
Rotatable bonds: 6
H-donors: 0
H-acceptors: 3
PSA: 96
Number of rings: 3

     

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