COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL368899
Chemical Name: ethyl(5Z)-5-[3-ethoxy-4-(prop-2-yn-1-yloxy)benzylidene]-4-oxo-2-(phenylamino)-4,5-dihydrothiophene-3-carboxylate
Smiles: CCOc1cc(ccc1OCC#C)/C=C/1\SC(=C(C1=O)C(=O)OCC)Nc1ccccc1

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Molecular Weight: 449.53
Empirical Formula: C25H23NO5S

Physical State: Dry powder
Available Amount: 214 mg

Lipinsky:
logP: 5.216
Rotatable bonds: 8
H-donors: 1
H-acceptors: 5
PSA: 99
Number of rings: 3

     

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