COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK008065
Chemical Name: (4E)-4-{3-bromo-4-[2-(2,5-dimethylphenoxy)ethoxy]-5-ethoxybenzylidene}-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: CCOc1cc(/C=C/2\C(=NN(C2=O)c2ccccc2)C)cc(c1OCCOc1cc(C)ccc1C)Br

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Molecular Weight: 549.46
Empirical Formula: C29H29BrN2O4

Physical State: Dry powder
Available Amount: 103 mg

Lipinsky:
logP: 7.021
Rotatable bonds: 8
H-donors: 0
H-acceptors: 4
PSA: 60
Number of rings: 4

     

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