COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL431980
Chemical Name: ethyl(2-{(Z)-[1-(4-bromophenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl}phenoxy)acetate
Smiles: CCOC(=O)COc1ccccc1/C=C\1/C(=O)NN(C1=O)c1ccc(cc1)Br

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Molecular Weight: 445.27
Empirical Formula: C20H17BrN2O5

Physical State: Dry powder
Available Amount: 129 mg

Lipinsky:
logP: 3.757
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 84
Number of rings: 3

     

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