COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL505598
Chemical Name: (4E)-5-hydroxy-4-[4-(morpholin-4-yl)-3-nitrobenzylidene]-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: OC1=NN(C(=O)/C/1=C/c1ccc(c(c1)[N+](=O)[O-])N1CCOCC1)c1ccccc1

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Molecular Weight: 394.39
Empirical Formula: C20H18N4O5

Physical State: Dry powder
Available Amount: 207 mg

Lipinsky:
logP: 3.822
Rotatable bonds: 2
H-donors: 1
H-acceptors: 5
PSA: 111
Number of rings: 4

     

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