COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL418900
Chemical Name: (5E)-5-[4-hydroxy-3-methoxy-5-(prop-2-en-1-yl)benzylidene]-3-(3-nitrophenyl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: C=CCc1cc(/C=C\2/SC(=S)N(C2=O)c2cccc(c2)[N+](=O)[O-])cc(c1O)OC

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Molecular Weight: 428.49
Empirical Formula: C20H16N2O5S2

Physical State: Dry powder
Available Amount: 123 mg

Lipinsky:
logP: 4.433
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 152
Number of rings: 3

     

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