COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK078988
Chemical Name: (4E)-4-{3-bromo-4-[2-(2-chlorophenoxy)ethoxy]-5-methoxybenzylidene}-1-phenylpyrazolidine-3,5-dione
Smiles: COc1cc(cc(c1OCCOc1ccccc1Cl)Br)/C=C/1\C(=O)NN(C1=O)c1ccccc1

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Molecular Weight: 543.8
Empirical Formula: C25H20BrClN2O5

Physical State: Dry powder
Available Amount: 96 mg

Lipinsky:
logP: 5.974
Rotatable bonds: 7
H-donors: 1
H-acceptors: 5
PSA: 77
Number of rings: 4

     

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