COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK524586
Chemical Name: methyl4-{(5E)-5-[3-(4-methoxy-4-oxobutyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}butanoate
Smiles: COC(=O)CCCN1C(=S)S/C(=C\2/SC(=S)N(C2=O)CCCC(=O)OC)/C1=O

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Molecular Weight: 462.59
Empirical Formula: C16H18N2O6S4

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: -0.876
Rotatable bonds: 10
H-donors: 0
H-acceptors: 6
PSA: 208
Number of rings: 2

     

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