COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL331383
Chemical Name: methyl6-[(5E)-5-(4-butoxy-3-methoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]hexanoate
Smiles: CCCCOc1ccc(cc1OC)/C=C\1/SC(=S)N(C1=O)CCCCCC(=O)OC

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Molecular Weight: 451.61
Empirical Formula: C22H29NO5S2

Physical State: Dry powder
Available Amount: 160 mg

Lipinsky:
logP: 4.305
Rotatable bonds: 13
H-donors: 0
H-acceptors: 5
PSA: 122
Number of rings: 2

     

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