COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK973368
Chemical Name: methyl3-[(5E)-5-(3-bromo-4-hydroxy-5-methoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoate
Smiles: COC(=O)CCN1C(=S)S/C(=C/c2cc(Br)c(c(c2)OC)O)/C1=O

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Molecular Weight: 432.32
Empirical Formula: C15H14BrNO5S2

Physical State: Dry powder
Available Amount: 160 mg

Lipinsky:
logP: 2.535
Rotatable bonds: 7
H-donors: 1
H-acceptors: 5
PSA: 133
Number of rings: 2

     

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