COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK153055
Chemical Name: methyl(2-ethoxy-4-{(Z)-[3-(3-nitrobenzyl)-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl}phenoxy)acetate
Smiles: CCOc1cc(ccc1OCC(=O)OC)/C=C/1\SC(=O)N(C1=O)Cc1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 472.48
Empirical Formula: C22H20N2O8S

Physical State: Dry powder
Available Amount: 357 mg

Lipinsky:
logP: 3.595
Rotatable bonds: 9
H-donors: 0
H-acceptors: 8
PSA: 153
Number of rings: 3

     

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