COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK926444
Chemical Name: 2-[(5Z)-5-(2,3-dimethoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanedioicacid
Smiles: COc1c(/C=C/2\SC(=S)N(C2=O)C(C(=O)O)CC(=O)O)cccc1OC

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Molecular Weight: 397.43
Empirical Formula: C16H15NO7S2

Physical State: Dry powder
Available Amount: 350 mg

Lipinsky:
logP: 1.92
Rotatable bonds: 9
H-donors: 2
H-acceptors: 7
PSA: 170
Number of rings: 2

     

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