COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL380256
Chemical Name: (5Z)-3-benzyl-5-[4-(2,4-dinitrophenoxy)-3-ethoxybenzylidene]-2-thioxo-1,3-thiazolidin-4-one
Smiles: CCOc1cc(ccc1Oc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])/C=C/1\SC(=S)N(C1=O)Cc1ccccc1

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Molecular Weight: 537.57
Empirical Formula: C25H19N3O7S2

Physical State: Dry powder
Available Amount: 776 mg

Lipinsky:
logP: 4.052
Rotatable bonds: 6
H-donors: 0
H-acceptors: 7
PSA: 187
Number of rings: 4

     

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