COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK567799
Chemical Name: (2Z)-2-[(5-methylfuran-2-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl4-nitrobenzoate
Smiles: Cc1ccc(o1)/C=C/1\Oc2c(C1=O)ccc(c2)OC(=O)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 391.34
Empirical Formula: C21H13NO7

Physical State: Dry powder
Available Amount: 352 mg

Lipinsky:
logP: 4.942
Rotatable bonds: 3
H-donors: 0
H-acceptors: 7
PSA: 111
Number of rings: 4

     

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