COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK055509
Chemical Name: ethyl(5Z)-5-(3-ethoxy-4-hydroxybenzylidene)-2-[(4-methoxyphenyl)amino]-4-oxo-4,5-dihydrothiophene-3-carboxylate
Smiles: CCOC(=O)C1=C(Nc2ccc(cc2)OC)S/C(=C\c2ccc(c(c2)OCC)O)/C1=O

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Molecular Weight: 441.5
Empirical Formula: C23H23NO6S

Physical State: Dry powder
Available Amount: 413 mg

Lipinsky:
logP: 4.529
Rotatable bonds: 7
H-donors: 2
H-acceptors: 6
PSA: 119
Number of rings: 3

     

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