COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL264506
Chemical Name: 2-{[5-(3-bromophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(3-nitrophenyl)ethanone
Smiles: Brc1cccc(c1)c1nnc([nH]1)SCC(=O)c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 419.26
Empirical Formula: C16H11BrN4O3S

Available Amount: 0 mg

Lipinsky:
logP: 5.02
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 129
Number of rings: 3

     

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