COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK133502
Chemical Name: (4Z)-4-[4-(benzyloxy)-3-bromo-5-methoxybenzylidene]-2,5-diphenyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: COc1cc(cc(c1OCc1ccccc1)Br)/C=C/1\C(=O)N(N=C1c1ccccc1)c1ccccc1

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Molecular Weight: 539.43
Empirical Formula: C30H23BrN2O3

Physical State: Dry powder
Available Amount: 339 mg

Lipinsky:
logP: 6.615
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 51
Number of rings: 5

     

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