COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL444341
Chemical Name: 2-{[(E)-{3-ethoxy-4-[(4-nitrobenzyl)oxy]phenyl}methylidene]amino}-4,5-dimethylfuran-3-carbonitrile
Smiles: CCOc1cc(ccc1OCc1ccc(cc1)[N+](=O)[O-])/C=N/c1oc(c(c1C#N)C)C

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Molecular Weight: 419.44
Empirical Formula: C23H21N3O5

Physical State: Dry powder
Available Amount: 107 mg

Lipinsky:
logP: 5.26
Rotatable bonds: 5
H-donors: 0
H-acceptors: 5
PSA: 113
Number of rings: 3

     

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