COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK062555
Chemical Name: (4E)-4-{2-[2-(3,4-dimethylphenoxy)ethoxy]-5-methoxybenzylidene}-1-phenylpyrazolidine-3,5-dione
Smiles: COc1ccc(c(c1)/C=C/1\C(=O)NN(C1=O)c1ccccc1)OCCOc1ccc(c(c1)C)C

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Molecular Weight: 458.51
Empirical Formula: C27H26N2O5

Physical State: Dry powder
Available Amount: 90 mg

Lipinsky:
logP: 5.8
Rotatable bonds: 7
H-donors: 1
H-acceptors: 5
PSA: 77
Number of rings: 4

     

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