COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK206673
Chemical Name: (4E)-4-[4-(diethylamino)benzylidene]-2-(4-nitrophenyl)-5-phenyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: CCN(c1ccc(cc1)/C=C\1/C(=O)N(N=C1c1ccccc1)c1ccc(cc1)[N+](=O)[O-])CC

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Molecular Weight: 440.5
Empirical Formula: C26H24N4O3

Physical State: Dry powder
Available Amount: 391 mg

Lipinsky:
logP: 5.679
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 81
Number of rings: 4

     

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