COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL420597
Chemical Name: {(5E)-5-[2-(morpholin-4-yl)-5-nitrobenzylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}aceticacid
Smiles: OC(=O)CN1C(=S)S/C(=C/c2cc(ccc2N2CCOCC2)[N+](=O)[O-])/C1=O

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Molecular Weight: 409.44
Empirical Formula: C16H15N3O6S2

Physical State: Dry powder
Available Amount: 105 mg

Lipinsky:
logP: 1.437
Rotatable bonds: 4
H-donors: 1
H-acceptors: 6
PSA: 173
Number of rings: 3

     

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