COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK065198
Chemical Name: (4E)-4-(5-bromo-3-ethoxy-2-hydroxybenzylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: CCOc1cc(Br)cc(c1O)/C=C/1\C(=NN(C1=O)c1ccccc1)C

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Molecular Weight: 401.26
Empirical Formula: C19H17BrN2O3

Physical State: Dry powder
Available Amount: 103 mg

Lipinsky:
logP: 4.815
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 62
Number of rings: 3

     

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