COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL035673
Chemical Name: {4-[(5E)-4-oxo-2-thioxo-5-(3,4,5-trimethoxybenzylidene)-1,3-thiazolidin-3-yl]phenyl}aceticacid
Smiles: COc1cc(/C=C\2/SC(=S)N(C2=O)c2ccc(cc2)CC(=O)O)cc(c1OC)OC

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Molecular Weight: 445.52
Empirical Formula: C21H19NO6S2

Physical State: Dry powder
Available Amount: 37 mg

Lipinsky:
logP: 3.332
Rotatable bonds: 4
H-donors: 1
H-acceptors: 6
PSA: 142
Number of rings: 3

     

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