COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL420619
Chemical Name: [(5E)-5-{3-bromo-4-[(2,4-dichlorobenzyl)oxy]benzylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]aceticacid
Smiles: OC(=O)CN1C(=S)S/C(=C/c2ccc(c(c2)Br)OCc2ccc(cc2Cl)Cl)/C1=O

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Molecular Weight: 533.25
Empirical Formula: C19H12BrCl2NO4S2

Physical State: Dry powder
Available Amount: 203 mg

Lipinsky:
logP: 5.111
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 124
Number of rings: 3

     

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