COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK502108
Chemical Name: 1-(4-methyl-3-nitro-1H-pyrazol-1-yl)butan-2-one
Smiles: CCC(=O)Cn1cc(c(n1)[N+](=O)[O-])C

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Molecular Weight: 197.19
Empirical Formula: C8H11N3O3

Available Amount: 0 mg

Lipinsky:
logP: 0.824
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 80
Number of rings: 1

     

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