COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK056005
Chemical Name: (4E)-4-{3-chloro-5-ethoxy-4-[(3-methylbenzyl)oxy]benzylidene}-1-phenylpyrazolidine-3,5-dione
Smiles: CCOc1cc(/C=C/2\C(=O)NN(C2=O)c2ccccc2)cc(c1OCc1cccc(c1)C)Cl

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Molecular Weight: 462.93
Empirical Formula: C26H23ClN2O4

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 6.434
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 67
Number of rings: 4

     

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