COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK157909
Chemical Name: (2E,5E)-5-(4,5-dimethoxy-2-nitrobenzylidene)-2-[(4-ethoxyphenyl)imino]-1,3-thiazolidin-4-one
Smiles: CCOc1ccc(cc1)/N=C/1\NC(=O)/C(=C\c2cc(OC)c(cc2[N+](=O)[O-])OC)/S1

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Molecular Weight: 429.45
Empirical Formula: C20H19N3O6S

Physical State: Dry powder
Available Amount: 397 mg

Lipinsky:
logP: 2.599
Rotatable bonds: 4
H-donors: 1
H-acceptors: 6
PSA: 140
Number of rings: 3

     

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