COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL005563
Chemical Name: 2-[(5Z)-5-(4-ethoxy-3-methoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]pentanedioicacid
Smiles: CCOc1ccc(cc1OC)/C=C/1\SC(=S)N(C1=O)C(C(=O)O)CCC(=O)O

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Molecular Weight: 425.48
Empirical Formula: C18H19NO7S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.626
Rotatable bonds: 11
H-donors: 2
H-acceptors: 7
PSA: 170
Number of rings: 2

     

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