COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK398248
Chemical Name: 3-{(4Z)-4-[5-bromo-2-(cyanomethoxy)benzylidene]-5-oxo-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl}benzoicacid
Smiles: N#CCOc1ccc(cc1/C=C/1\C(=O)N(N=C1c1ccccc1)c1cccc(c1)C(=O)O)Br

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Molecular Weight: 502.32
Empirical Formula: C25H16BrN3O4

Physical State: Dry powder
Available Amount: 64 mg

Lipinsky:
logP: 4.843
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 102
Number of rings: 4

     

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