COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK711999
Chemical Name: (4Z)-4-(2-{2-[4-(butan-2-yl)phenoxy]ethoxy}-5-chlorobenzylidene)-1-phenylpyrazolidine-3,5-dione
Smiles: CCC(c1ccc(cc1)OCCOc1ccc(cc1/C=C\1/C(=O)NN(C1=O)c1ccccc1)Cl)C

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Molecular Weight: 490.99
Empirical Formula: C28H27ClN2O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.421
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 67
Number of rings: 4

     

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