COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK959879
Chemical Name: (4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)(2,4-dinitrophenyl)methanone
Smiles: [O-][N+](=O)c1cc(ccc1C(=O)n1nc(c(c1C)Cl)C)[N+](=O)[O-]

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Molecular Weight: 324.68
Empirical Formula: C12H9ClN4O5

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.04
Rotatable bonds: 1
H-donors: 0
H-acceptors: 5
PSA: 126
Number of rings: 2

     

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