COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK160402
Chemical Name: (4E)-5-methyl-4-{2-[(4-nitrobenzyl)oxy]benzylidene}-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: CC1=NN(C(=O)/C/1=C/c1ccccc1OCc1ccc(cc1)[N+](=O)[O-])c1ccccc1

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Molecular Weight: 413.43
Empirical Formula: C24H19N3O4

Physical State: Dry powder
Available Amount: 150 mg

Lipinsky:
logP: 4.704
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 87
Number of rings: 4

     

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