COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK958869
Chemical Name: 3-[(4Z)-4-(3-bromo-4-ethoxy-5-methoxybenzylidene)-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl]propanenitrile
Smiles: N#CCCN1N=C(/C(=C/c2cc(Br)c(c(c2)OC)OCC)/C1=O)C

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Molecular Weight: 392.25
Empirical Formula: C17H18BrN3O3

Physical State: Dry powder
Available Amount: 26 mg

Lipinsky:
logP: 2.316
Rotatable bonds: 6
H-donors: 0
H-acceptors: 3
PSA: 74
Number of rings: 2

     

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