COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK002445
Chemical Name: [(1-benzyl-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-4-yl)(4-nitrophenyl)methyl]propanedinitrile
Smiles: N#CC(C(C1C(=NN(C1=O)Cc1ccccc1)C)c1ccc(cc1)[N+](=O)[O-])C#N

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Molecular Weight: 387.4
Empirical Formula: C21H17N5O3

Physical State: Dry powder
Available Amount: 95 mg

Lipinsky:
logP: 3.362
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 126
Number of rings: 3

     

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