COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL171095
Chemical Name: (5E)-5-{3-[(4-nitrobenzyl)oxy]benzylidene}-2-thioxoimidazolidin-4-one
Smiles: S=C1NC(=O)/C(=C\c2cccc(c2)OCc2ccc(cc2)[N+](=O)[O-])/N1

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Molecular Weight: 355.37
Empirical Formula: C17H13N3O4S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 3.622
Rotatable bonds: 3
H-donors: 2
H-acceptors: 4
PSA: 128
Number of rings: 3

     

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