COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL271644
Chemical Name: 2-{4-benzyl-3-[(4-bromophenoxy)methyl]-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-1-yl}-N-(4-ethoxy-2-nitrophenyl)acetamide
Smiles: CCOc1ccc(c(c1)[N+](=O)[O-])NC(=O)Cn1nc(n(c1=S)Cc1ccccc1)COc1ccc(cc1)Br

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Molecular Weight: 598.48
Empirical Formula: C26H24BrN5O5S

Available Amount: 0 mg

Lipinsky:
logP: 4.816
Rotatable bonds: 7
H-donors: 1
H-acceptors: 5
PSA: 144
Number of rings: 4

     

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