COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL035487
Chemical Name: 4-({6-[(5E)-5-benzylidene-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]hexanoyl}amino)-2-hydroxybenzoicacid
Smiles: O=C(Nc1ccc(c(c1)O)C(=O)O)CCCCCN1C(=S)S/C(=C/c2ccccc2)/C1=O

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Molecular Weight: 470.57
Empirical Formula: C23H22N2O5S2

Physical State: Dry powder
Available Amount: 49 mg

Lipinsky:
logP: 4.567
Rotatable bonds: 9
H-donors: 3
H-acceptors: 5
PSA: 164
Number of rings: 3

     

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