COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK087326
Chemical Name: ethyl(5E)-5-(4-hydroxy-3,5-dimethoxybenzylidene)-2-[(4-methoxyphenyl)amino]-4-oxo-4,5-dihydrothiophene-3-carboxylate
Smiles: CCOC(=O)C1=C(Nc2ccc(cc2)OC)S/C(=C/c2cc(OC)c(c(c2)OC)O)/C1=O

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Molecular Weight: 457.5
Empirical Formula: C23H23NO7S

Physical State: Dry powder
Available Amount: 90 mg

Lipinsky:
logP: 3.643
Rotatable bonds: 6
H-donors: 2
H-acceptors: 7
PSA: 128
Number of rings: 3

     

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