COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK019247
Chemical Name: (4E)-4-{2-[(2,4-dichlorobenzyl)oxy]-5-methoxybenzylidene}-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: COc1ccc(c(c1)/C=C/1\C(=NN(C1=O)c1ccccc1)C)OCc1ccc(cc1Cl)Cl

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Molecular Weight: 467.35
Empirical Formula: C25H20Cl2N2O3

Physical State: Dry powder
Available Amount: 245 mg

Lipinsky:
logP: 6.202
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 51
Number of rings: 4

     

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