COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL369467
Chemical Name: ethyl(5Z)-5-[4-(diethylamino)benzylidene]-2-{[(4-methoxyphenyl)carbonyl]amino}-4-oxo-4,5-dihydrothiophene-3-carboxylate
Smiles: CCOC(=O)C1=C(S/C(=C\c2ccc(cc2)N(CC)CC)/C1=O)NC(=O)c1ccc(cc1)OC

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Molecular Weight: 480.58
Empirical Formula: C26H28N2O5S

Physical State: Dry powder
Available Amount: 867 mg

Lipinsky:
logP: 5.755
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 110
Number of rings: 3

     

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