COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL368548
Chemical Name: (5Z)-5-{3-bromo-5-methoxy-4-[(3-nitrobenzyl)oxy]benzylidene}-3-ethyl-1,3-thiazolidine-2,4-dione
Smiles: CCN1C(=O)S/C(=C\c2cc(Br)c(c(c2)OC)OCc2cccc(c2)[N+](=O)[O-])/C1=O

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Molecular Weight: 493.33
Empirical Formula: C20H17BrN2O6S

Physical State: Dry powder
Available Amount: 870 mg

Lipinsky:
logP: 4.897
Rotatable bonds: 6
H-donors: 0
H-acceptors: 6
PSA: 126
Number of rings: 3

     

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