COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL369716
Chemical Name: (5Z)-5-{3-chloro-4-[(4-nitrobenzyl)oxy]benzylidene}-1,3-dimethyl-2-thioxoimidazolidin-4-one
Smiles: S=C1N(C)C(=O)/C(=C/c2ccc(c(c2)Cl)OCc2ccc(cc2)[N+](=O)[O-])/N1C

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Molecular Weight: 417.87
Empirical Formula: C19H16ClN3O4S

Physical State: Dry powder
Available Amount: 647 mg

Lipinsky:
logP: 3.673
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 110
Number of rings: 3

     

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