COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK663374
Chemical Name: (2Z,6E)-2,6-bis(5-bromo-2-methoxybenzylidene)-4-tert-butylcyclohexanone
Smiles: COc1ccc(cc1/C=C/1\CC(C/C(=C/c2cc(Br)ccc2OC)/C1=O)C(C)(C)C)Br

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Molecular Weight: 548.31
Empirical Formula: C26H28Br2O3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 9.931
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 35
Number of rings: 3

     

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