COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK048116
Chemical Name: (4E)-4-{3-bromo-5-methoxy-4-[2-(3-methoxyphenoxy)ethoxy]benzylidene}-1-phenylpyrazolidine-3,5-dione
Smiles: COc1cccc(c1)OCCOc1c(Br)cc(cc1OC)/C=C/1\C(=O)NN(C1=O)c1ccccc1

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Molecular Weight: 539.38
Empirical Formula: C26H23BrN2O6

Physical State: Dry powder
Available Amount: 105 mg

Lipinsky:
logP: 5.225
Rotatable bonds: 8
H-donors: 1
H-acceptors: 6
PSA: 86
Number of rings: 4

     

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