COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK007938
Chemical Name: (3,5-dimethyl-1H-pyrazol-1-yl)(3-nitrophenyl)methanone
Smiles: Cc1nn(c(c1)C)C(=O)c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 245.24
Empirical Formula: C12H11N3O3

Physical State: Dry powder
Available Amount: 521 mg

Lipinsky:
logP: 2.96
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 80
Number of rings: 2

     

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