COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL380011
Chemical Name: (5E)-3-(1,3-benzodioxol-5-yl)-5-[(2-methyl-1H-indol-3-yl)methylidene]-2-thioxo-1,3-thiazolidin-4-one
Smiles: S=C1S/C(=C/c2c(C)[nH]c3c2cccc3)/C(=O)N1c1ccc2c(c1)OCO2

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Molecular Weight: 394.47
Empirical Formula: C20H14N2O3S2

Physical State: Dry powder
Available Amount: 855 mg

Lipinsky:
logP: 4.702
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 111
Number of rings: 5

     

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