COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK758063
Chemical Name: ethyl(4-{(Z)-2-[5-amino-4-cyano-1-(2-hydroxyethyl)-1H-pyrazol-3-yl]-2-cyanoethenyl}-2-bromo-6-ethoxyphenoxy)acetate
Smiles: CCOC(=O)COc1c(Br)cc(cc1OCC)/C=C(/c1nn(c(c1C#N)N)CCO)\C#N

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Molecular Weight: 504.34
Empirical Formula: C21H22BrN5O5

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.065
Rotatable bonds: 12
H-donors: 3
H-acceptors: 5
PSA: 156
Number of rings: 2

     

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