COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK158454
Chemical Name: methyl(5E)-5-(4-ethoxybenzylidene)-4-oxo-2-(phenylamino)-4,5-dihydrothiophene-3-carboxylate
Smiles: CCOc1ccc(cc1)/C=C\1/SC(=C(C1=O)C(=O)OC)Nc1ccccc1

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Molecular Weight: 381.45
Empirical Formula: C21H19NO4S

Physical State: Dry powder
Available Amount: 230 mg

Lipinsky:
logP: 4.765
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 89
Number of rings: 3

     

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