COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL035889
Chemical Name: ethyl4-{[(5E)-5-(4-ethoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetyl}piperazine-1-carboxylate
Smiles: CCOc1ccc(cc1)/C=C\1/SC(=S)N(C1=O)CC(=O)N1CCN(CC1)C(=O)OCC

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Molecular Weight: 463.58
Empirical Formula: C21H25N3O5S2

Physical State: Dry powder
Available Amount: 52 mg

Lipinsky:
logP: 3.144
Rotatable bonds: 5
H-donors: 0
H-acceptors: 5
PSA: 136
Number of rings: 3

     

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