COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL432308
Chemical Name: ethyl(4-bromo-2-{(E)-[1-(3-chlorophenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl}phenoxy)acetate
Smiles: CCOC(=O)COc1ccc(cc1/C=C/1\C(=O)NN(C1=O)c1cccc(c1)Cl)Br

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Molecular Weight: 479.71
Empirical Formula: C20H16BrClN2O5

Physical State: Dry powder
Available Amount: 200 mg

Lipinsky:
logP: 4.673
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 84
Number of rings: 3

     

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