COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK824122
Chemical Name: (4E)-5-methyl-4-(2-nitrobenzylidene)-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: CC1=NN(C(=O)/C/1=C/c1ccccc1[N+](=O)[O-])c1ccccc1

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Molecular Weight: 307.31
Empirical Formula: C17H13N3O3

Physical State: Dry powder
Available Amount: 507 mg

Lipinsky:
logP: 2.863
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 78
Number of rings: 3

     

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