COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK033100
Chemical Name: (5E)-5-{5-bromo-2-[(3-methylbenzyl)oxy]benzylidene}-3-(prop-2-yn-1-yl)-1,3-thiazolidine-2,4-dione
Smiles: C#CCN1C(=O)S/C(=C/c2cc(Br)ccc2OCc2cccc(c2)C)/C1=O

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Molecular Weight: 442.33
Empirical Formula: C21H16BrNO3S

Physical State: Dry powder
Available Amount: 97 mg

Lipinsky:
logP: 6.09
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 71
Number of rings: 3

     

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