COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL234884
Chemical Name: (5E)-5-benzylidene-3-[6-(4-methylpiperazin-1-yl)-6-oxohexyl]-2-thioxo-1,3-thiazolidin-4-one
Smiles: CN1CCN(CC1)C(=O)CCCCCN1C(=S)S/C(=C/c2ccccc2)/C1=O

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Molecular Weight: 417.6
Empirical Formula: C21H27N3O2S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.325
Rotatable bonds: 6
H-donors: 0
H-acceptors: 2
PSA: 101
Number of rings: 3

     

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