COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL428367
Chemical Name: (5E)-5-[5-nitro-2-(piperidin-1-yl)benzylidene]-3-phenyl-2-thioxo-1,3-thiazolidin-4-one
Smiles: S=C1S/C(=C/c2cc(ccc2N2CCCCC2)[N+](=O)[O-])/C(=O)N1c1ccccc1

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Molecular Weight: 425.53
Empirical Formula: C21H19N3O3S2

Physical State: Dry powder
Available Amount: 121 mg

Lipinsky:
logP: 5.839
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 126
Number of rings: 4

     

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