COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL032951
Chemical Name: 2-(3-oxobutyl)cyclohexane-1,3-dione
Smiles: CC(=O)CCC1C(=O)CCCC1=O

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Molecular Weight: 182.22
Empirical Formula: C10H14O3

Physical State: Dry powder
Available Amount: 1004 mg

Lipinsky:
logP: -0.71
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 51
Number of rings: 1

     

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