COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK123806
Chemical Name: 3-{(5E)-5-[3-ethoxy-4-hydroxy-5-(prop-2-en-1-yl)benzylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}benzoicacid
Smiles: CCOc1cc(/C=C\2/SC(=S)N(C2=O)c2cccc(c2)C(=O)O)cc(c1O)CC=C

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Molecular Weight: 441.53
Empirical Formula: C22H19NO5S2

Physical State: Dry powder
Available Amount: 280 mg

Lipinsky:
logP: 4.91
Rotatable bonds: 8
H-donors: 2
H-acceptors: 5
PSA: 144
Number of rings: 3

     

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