COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL363979
Chemical Name: 1-(azepan-1-yl)-2-(3-nitro-1H-1,2,4-triazol-1-yl)ethanone
Smiles: O=C(N1CCCCCC1)Cn1cnc(n1)[N+](=O)[O-]

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Molecular Weight: 253.26
Empirical Formula: C10H15N5O3

Available Amount: 0 mg

Lipinsky:
logP: 0.659
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 96
Number of rings: 2

     

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