COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL418629
Chemical Name: 3-{[(E)-{3-methoxy-4-[(4-nitrobenzyl)oxy]phenyl}methylidene]amino}-2-thioxo-1,3-thiazolidin-4-one
Smiles: COc1cc(/C=N/N2C(=S)SCC2=O)ccc1OCc1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 417.47
Empirical Formula: C18H15N3O5S2

Physical State: Dry powder
Available Amount: 135 mg

Lipinsky:
logP: 3.42
Rotatable bonds: 5
H-donors: 0
H-acceptors: 5
PSA: 154
Number of rings: 3

     

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