COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL418612
Chemical Name: 2-({4-[(E)-(3,5-dioxo-1-phenylpyrazolidin-4-ylidene)methyl]-2-ethoxyphenoxy}methyl)benzonitrile
Smiles: CCOc1cc(ccc1OCc1ccccc1C#N)/C=C/1\C(=O)NN(C1=O)c1ccccc1

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Molecular Weight: 439.47
Empirical Formula: C26H21N3O4

Physical State: Dry powder
Available Amount: 144 mg

Lipinsky:
logP: 4.624
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 91
Number of rings: 4

     

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