COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL304657
Chemical Name: (4E)-2-(4-bromophenyl)-5-methyl-4-(4-nitrobenzylidene)-2,4-dihydro-3H-pyrazol-3-one
Smiles: Brc1ccc(cc1)N1N=C(/C(=C\c2ccc(cc2)[N+](=O)[O-])/C1=O)C

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Molecular Weight: 386.2
Empirical Formula: C17H12BrN3O3

Available Amount: 0 mg

Lipinsky:
logP: 3.864
Rotatable bonds: 0
H-donors: 0
H-acceptors: 3
PSA: 78
Number of rings: 3

     

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