COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK064378
Chemical Name: (4E)-4-(5-bromo-2-{2-[2-methoxy-4-(prop-2-en-1-yl)phenoxy]ethoxy}benzylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: C=CCc1ccc(c(c1)OC)OCCOc1ccc(cc1/C=C/1\C(=NN(C1=O)c1ccccc1)C)Br

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Molecular Weight: 547.45
Empirical Formula: C29H27BrN2O4

Physical State: Dry powder
Available Amount: 430 mg

Lipinsky:
logP: 6.927
Rotatable bonds: 9
H-donors: 0
H-acceptors: 4
PSA: 60
Number of rings: 4

     

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