COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK155061
Chemical Name: methyl2-[(5E)-5-{4-[(3-nitrobenzyl)oxy]benzylidene}-2,4-dioxo-1,3-thiazolidin-3-yl]propanoate
Smiles: COC(=O)C(N1C(=O)S/C(=C/c2ccc(cc2)OCc2cccc(c2)[N+](=O)[O-])/C1=O)C

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Molecular Weight: 442.45
Empirical Formula: C21H18N2O7S

Physical State: Dry powder
Available Amount: 150 mg

Lipinsky:
logP: 4.348
Rotatable bonds: 5
H-donors: 0
H-acceptors: 7
PSA: 144
Number of rings: 3

     

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