COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL326488
Chemical Name: 2-[(2E)-3-(4-methoxyphenyl)prop-2-enoyl]-5,5-dimethylcyclohexane-1,3-dione
Smiles: COc1ccc(cc1)/C=C/C(=O)C1C(=O)CC(CC1=O)(C)C

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Molecular Weight: 300.35
Empirical Formula: C18H20O4

Available Amount: 0 mg

Lipinsky:
logP: 2.402
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 60
Number of rings: 2

     

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