COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK034514
Chemical Name: (4E)-4-(4-{2-[2-(3,4-dimethylphenoxy)ethoxy]ethoxy}-3-methoxybenzylidene)-1-phenylpyrazolidine-3,5-dione
Smiles: COc1cc(ccc1OCCOCCOc1ccc(c(c1)C)C)/C=C/1\C(=O)NN(C1=O)c1ccccc1

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Molecular Weight: 502.57
Empirical Formula: C29H30N2O6

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 5.467
Rotatable bonds: 10
H-donors: 1
H-acceptors: 6
PSA: 86
Number of rings: 4

     

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