COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK795808
Chemical Name: 2-(5-bromo-3-nitro-1H-1,2,4-triazol-1-yl)-1-(piperidin-1-yl)ethanone
Smiles: O=C(N1CCCCC1)Cn1nc(nc1Br)[N+](=O)[O-]

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Molecular Weight: 318.13
Empirical Formula: C9H12BrN5O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.637
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 96
Number of rings: 2

     

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