COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL307678
Chemical Name: butyl4-{(5E)-5-[3-(4-butoxy-4-oxobutyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}butanoate
Smiles: CCCCOC(=O)CCCN1C(=S)S/C(=C\2/SC(=S)N(C2=O)CCCC(=O)OCCCC)/C1=O

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Molecular Weight: 546.75
Empirical Formula: C22H30N2O6S4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.312
Rotatable bonds: 16
H-donors: 0
H-acceptors: 6
PSA: 208
Number of rings: 2

     

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