COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK994288
Chemical Name: (5E)-5-(4-ethylbenzylidene)-3-[3-(4-methylpiperazin-1-yl)-3-oxopropyl]-2-thioxo-1,3-thiazolidin-4-one
Smiles: CCc1ccc(cc1)/C=C\1/SC(=S)N(C1=O)CCC(=O)N1CCN(CC1)C

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Molecular Weight: 403.57
Empirical Formula: C20H25N3O2S2

Physical State: Dry powder
Available Amount: 65 mg

Lipinsky:
logP: 2.569
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 101
Number of rings: 3

     

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