COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL053654
Chemical Name: {[(2Z)-2-(3-nitrobenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl]oxy}acetonitrile
Smiles: N#CCOc1ccc2c(c1)O/C(=C\c1cccc(c1)[N+](=O)[O-])/C2=O

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Molecular Weight: 322.28
Empirical Formula: C17H10N2O5

Physical State: Dry powder
Available Amount: 295 mg

Lipinsky:
logP: 3.032
Rotatable bonds: 3
H-donors: 0
H-acceptors: 5
PSA: 105
Number of rings: 3

     

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