COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL370024
Chemical Name: (5E)-3-(2-fluorobenzyl)-5-[3-nitro-4-(piperidin-1-yl)benzylidene]-1,3-thiazolidine-2,4-dione
Smiles: O=C1S/C(=C/c2ccc(c(c2)[N+](=O)[O-])N2CCCCC2)/C(=O)N1Cc1ccccc1F

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Molecular Weight: 441.48
Empirical Formula: C22H20FN3O4S

Physical State: Dry powder
Available Amount: 907 mg

Lipinsky:
logP: 6.542
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 111
Number of rings: 4

     

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