COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL371629
Chemical Name: (5Z)-5-{3-chloro-5-methoxy-4-[(4-nitrobenzyl)oxy]benzylidene}-3-ethyl-2-thioxoimidazolidin-4-one
Smiles: CCN1C(=S)N/C(=C\c2cc(Cl)c(c(c2)OC)OCc2ccc(cc2)[N+](=O)[O-])/C1=O

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Molecular Weight: 447.9
Empirical Formula: C20H18ClN3O5S

Physical State: Dry powder
Available Amount: 1000 mg

Lipinsky:
logP: 4.555
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 128
Number of rings: 3

     

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