COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK158433
Chemical Name: ethyl(5E)-2-[(4-chlorophenyl)amino]-4-oxo-5-(2,3,4-trimethoxybenzylidene)-4,5-dihydrothiophene-3-carboxylate
Smiles: CCOC(=O)C1=C(Nc2ccc(cc2)Cl)S/C(=C/c2ccc(c(c2OC)OC)OC)/C1=O

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Molecular Weight: 475.95
Empirical Formula: C23H22ClNO6S

Physical State: Dry powder
Available Amount: 157 mg

Lipinsky:
logP: 5.429
Rotatable bonds: 7
H-donors: 1
H-acceptors: 6
PSA: 108
Number of rings: 3

     

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