COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL418904
Chemical Name: methyl2-(5-{(E)-[3-(4-nitrophenyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}furan-2-yl)benzoate
Smiles: COC(=O)c1ccccc1c1ccc(o1)/C=C\1/SC(=S)N(C1=O)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 466.5
Empirical Formula: C22H14N2O6S2

Physical State: Dry powder
Available Amount: 115 mg

Lipinsky:
logP: 5.274
Rotatable bonds: 4
H-donors: 0
H-acceptors: 6
PSA: 162
Number of rings: 4

     

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