COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL361169
Chemical Name: (3E)-3-[(4-ethoxyphenyl)(nitro)methylidene]-2-benzofuran-1(3H)-one
Smiles: CCOc1ccc(cc1)/C(=C/1\OC(=O)c2c1cccc2)/[N+](=O)[O-]

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Molecular Weight: 311.29
Empirical Formula: C17H13NO5

Physical State: Dry powder
Available Amount: 106 mg

Lipinsky:
logP: 3.472
Rotatable bonds: 1
H-donors: 0
H-acceptors: 5
PSA: 81
Number of rings: 3

     

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