COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL369710
Chemical Name: (5Z)-5-{5-bromo-2-[(3-nitrobenzyl)oxy]benzylidene}-3-ethyl-1-methyl-2-thioxoimidazolidin-4-one
Smiles: CCN1C(=O)/C(=C/c2cc(Br)ccc2OCc2cccc(c2)[N+](=O)[O-])/N(C1=S)C

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Molecular Weight: 476.35
Empirical Formula: C20H18BrN3O4S

Physical State: Dry powder
Available Amount: 600 mg

Lipinsky:
logP: 4.802
Rotatable bonds: 5
H-donors: 0
H-acceptors: 4
PSA: 110
Number of rings: 3

     

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