COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK158444
Chemical Name: methyl(5Z)-5-[4-(diethylamino)benzylidene]-4-oxo-2-(phenylamino)-4,5-dihydrothiophene-3-carboxylate
Smiles: CCN(c1ccc(cc1)/C=C/1\SC(=C(C1=O)C(=O)OC)Nc1ccccc1)CC

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Molecular Weight: 408.52
Empirical Formula: C23H24N2O3S

Physical State: Dry powder
Available Amount: 673 mg

Lipinsky:
logP: 5.857
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 83
Number of rings: 3

     

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