COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK040849
Chemical Name: (4E)-4-{5-bromo-2-[2-(3,5-dimethylphenoxy)ethoxy]benzylidene}-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: Brc1ccc(c(c1)/C=C/1\C(=NN(C1=O)c1ccccc1)C)OCCOc1cc(C)cc(c1)C

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Molecular Weight: 505.41
Empirical Formula: C27H25BrN2O3

Physical State: Dry powder
Available Amount: 68 mg

Lipinsky:
logP: 7.008
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 51
Number of rings: 4

     

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