COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK835852
Chemical Name: (5Z)-5-(4-ethylbenzylidene)-3-[4-(4-methylpiperazin-1-yl)-4-oxobutyl]-2-thioxo-1,3-thiazolidin-4-one
Smiles: CCc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)CCCC(=O)N1CCN(CC1)C

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Molecular Weight: 417.6
Empirical Formula: C21H27N3O2S2

Physical State: Dry powder
Available Amount: 353 mg

Lipinsky:
logP: 2.786
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 101
Number of rings: 3

     

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