COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK771697
Chemical Name: 1-{3,5-dimethyl-1-[(3-nitrophenyl)carbonyl]-1H-pyrazol-4-yl}ethanone
Smiles: [O-][N+](=O)c1cccc(c1)C(=O)n1nc(c(c1C)C(=O)C)C

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Molecular Weight: 287.28
Empirical Formula: C14H13N3O4

Physical State: Dry powder
Available Amount: 69 mg

Lipinsky:
logP: 2.406
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 97
Number of rings: 2

     

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