COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK079431
Chemical Name: (5E)-5-{4-[3-(4-tert-butylphenoxy)propoxy]-3-ethoxybenzylidene}-3-(prop-2-en-1-yl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: C=CCN1C(=S)S/C(=C/c2ccc(c(c2)OCC)OCCCOc2ccc(cc2)C(C)(C)C)/C1=O

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Molecular Weight: 511.71
Empirical Formula: C28H33NO4S2

Physical State: Dry powder
Available Amount: 99 mg

Lipinsky:
logP: 6.906
Rotatable bonds: 10
H-donors: 0
H-acceptors: 4
PSA: 105
Number of rings: 3

     

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