COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK199188
Chemical Name: N'-[(E)-{3-ethoxy-4-[(4-nitrobenzyl)oxy]-5-(prop-2-en-1-yl)phenyl}methylidene]-5-nitro-1-benzofuran-2-carbohydrazide
Smiles: C=CCc1cc(/C=N/NC(=O)c2cc3c(o2)ccc(c3)[N+](=O)[O-])cc(c1OCc1ccc(cc1)[N+](=O)[O-])OCC

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Molecular Weight: 544.52
Empirical Formula: C28H24N4O8

Physical State: Dry powder
Available Amount: 297 mg

Lipinsky:
logP: 5.169
Rotatable bonds: 9
H-donors: 1
H-acceptors: 8
PSA: 164
Number of rings: 4

     

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