COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK089168
Chemical Name: (4Z)-4-{3-ethoxy-4-[(3-methylbenzyl)oxy]benzylidene}-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: CCOc1cc(ccc1OCc1cccc(c1)C)/C=C\1/C(=NN(C1=O)c1ccccc1)C

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Molecular Weight: 426.52
Empirical Formula: C27H26N2O3

Physical State: Dry powder
Available Amount: 77 mg

Lipinsky:
logP: 5.787
Rotatable bonds: 6
H-donors: 0
H-acceptors: 3
PSA: 51
Number of rings: 4

     

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