COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK001763
Chemical Name: (5Z)-5-{3-bromo-4-[2-(2,6-dimethylphenoxy)ethoxy]-5-ethoxybenzylidene}-3-(prop-2-en-1-yl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: C=CCN1C(=S)S/C(=C\c2cc(Br)c(c(c2)OCC)OCCOc2c(C)cccc2C)/C1=O

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Molecular Weight: 548.52
Empirical Formula: C25H26BrNO4S2

Physical State: Liquid
Available Amount: 188 mg

Lipinsky:
logP: 6.442
Rotatable bonds: 9
H-donors: 0
H-acceptors: 4
PSA: 105
Number of rings: 3

     

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