COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK967713
Chemical Name: 3-[(4Z)-4-(2-bromo-4-ethoxy-5-methoxybenzylidene)-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl]propanenitrile
Smiles: CCOc1cc(Br)c(cc1OC)/C=C\1/C(=NN(C1=O)CCC#N)C

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Molecular Weight: 392.25
Empirical Formula: C17H18BrN3O3

Physical State: Dry powder
Available Amount: 48 mg

Lipinsky:
logP: 2.715
Rotatable bonds: 6
H-donors: 0
H-acceptors: 3
PSA: 74
Number of rings: 2

     

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