COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL357498
Chemical Name: 2-{[(2-hydroxy-2-phenylethyl)amino]methylidene}-5,5-dimethylcyclohexane-1,3-dione
Smiles: OC(c1ccccc1)CNC=C1C(=O)CC(CC1=O)(C)C

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Molecular Weight: 287.36
Empirical Formula: C17H21NO3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 1.83
Rotatable bonds: 3
H-donors: 2
H-acceptors: 3
PSA: 66
Number of rings: 2

     

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