COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK675553
Chemical Name: 5,5-dimethyl-2-(1,1,1-trichloro-4-oxopentan-3-yl)cyclohexane-1,3-dione
Smiles: CC(=O)C(C1C(=O)CC(CC1=O)(C)C)CC(Cl)(Cl)Cl

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Molecular Weight: 327.63
Empirical Formula: C13H17Cl3O3

Physical State: Dry powder
Available Amount: 57 mg

Lipinsky:
logP: 2.497
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 51
Number of rings: 1

     

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