COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK995301
Chemical Name: 4-bromo-N-{(5E)-5-[(1-methyl-1H-pyrrol-2-yl)methylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}benzamide
Smiles: Brc1ccc(cc1)C(=O)NN1C(=S)S/C(=C/c2cccn2C)/C1=O

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Molecular Weight: 422.33
Empirical Formula: C16H12BrN3O2S2

Physical State: Dry powder
Available Amount: 351 mg

Lipinsky:
logP: 3.826
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 111
Number of rings: 3

     

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