COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK994606
Chemical Name: 2-({3-[(5Z)-5-(3,4-dimethoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoyl}amino)benzoicacid
Smiles: COc1cc(ccc1OC)/C=C/1\SC(=S)N(C1=O)CCC(=O)Nc1ccccc1C(=O)O

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Molecular Weight: 472.54
Empirical Formula: C22H20N2O6S2

Physical State: Dry powder
Available Amount: 40 mg

Lipinsky:
logP: 3.667
Rotatable bonds: 8
H-donors: 2
H-acceptors: 6
PSA: 162
Number of rings: 3

     

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