COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK095119
Chemical Name: (4E)-4-(3-ethoxy-4-{2-[4-(hexyloxy)phenoxy]ethoxy}benzylidene)-1-phenylpyrazolidine-3,5-dione
Smiles: CCCCCCOc1ccc(cc1)OCCOc1ccc(cc1OCC)/C=C/1\C(=O)NN(C1=O)c1ccccc1

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Molecular Weight: 544.65
Empirical Formula: C32H36N2O6

Physical State: Dry powder
Available Amount: 320 mg

Lipinsky:
logP: 7.83
Rotatable bonds: 12
H-donors: 1
H-acceptors: 6
PSA: 86
Number of rings: 4

     

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