COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK158458
Chemical Name: ethyl(5Z)-5-[(5-nitrofuran-2-yl)methylidene]-4-oxo-2-(phenylamino)-4,5-dihydrothiophene-3-carboxylate
Smiles: CCOC(=O)C1=C(Nc2ccccc2)S/C(=C\c2ccc(o2)[N+](=O)[O-])/C1=O

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Molecular Weight: 386.39
Empirical Formula: C18H14N2O6S

Physical State: Dry powder
Available Amount: 195 mg

Lipinsky:
logP: 4.012
Rotatable bonds: 4
H-donors: 1
H-acceptors: 6
PSA: 139
Number of rings: 3

     

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