COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK026113
Chemical Name: ethyl(5Z)-5-(4-ethoxybenzylidene)-2-[(4-methylphenyl)amino]-4-oxo-4,5-dihydrothiophene-3-carboxylate
Smiles: CCOC(=O)C1=C(Nc2ccc(cc2)C)S/C(=C\c2ccc(cc2)OCC)/C1=O

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Molecular Weight: 409.51
Empirical Formula: C23H23NO4S

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: 5.757
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 89
Number of rings: 3

     

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