COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK082372
Chemical Name: (4E)-4-{4-[2-(4-cyclohexylphenoxy)ethoxy]-3-methoxybenzylidene}-1-phenylpyrazolidine-3,5-dione
Smiles: COc1cc(ccc1OCCOc1ccc(cc1)C1CCCCC1)/C=C/1\C(=O)NN(C1=O)c1ccccc1

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Molecular Weight: 512.61
Empirical Formula: C31H32N2O5

Physical State: Dry powder
Available Amount: 82 mg

Lipinsky:
logP: 7.196
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 77
Number of rings: 5

     

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