COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL378919
Chemical Name: (5E)-5-(2-chloro-5-nitrobenzylidene)-3-(2-methoxyphenyl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: COc1ccccc1N1C(=S)S/C(=C/c2cc(ccc2Cl)[N+](=O)[O-])/C1=O

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Molecular Weight: 406.87
Empirical Formula: C17H11ClN2O4S2

Physical State: Dry powder
Available Amount: 931 mg

Lipinsky:
logP: 4.707
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 132
Number of rings: 3

     

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