COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK685154
Chemical Name: (2E,6E)-2,6-bis(3,4-diethoxybenzylidene)-4-(2-methylbutan-2-yl)cyclohexanone
Smiles: CCOc1cc(ccc1OCC)/C=C/1\CC(C/C(=C\c2ccc(c(c2)OCC)OCC)/C1=O)C(CC)(C)C

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Molecular Weight: 520.71
Empirical Formula: C33H44O5

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 10.046
Rotatable bonds: 12
H-donors: 0
H-acceptors: 5
PSA: 53
Number of rings: 3

     

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