COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK086859
Chemical Name: 3-{[3-(1-hydroxyethyl)phenyl]amino}-5,5-dimethylcyclohex-2-en-1-one
Smiles: O=C1C=C(Nc2cccc(c2)C(O)C)CC(C1)(C)C

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Molecular Weight: 259.35
Empirical Formula: C16H21NO2

Physical State: Dry powder
Available Amount: 69 mg

Lipinsky:
logP: 1.747
Rotatable bonds: 2
H-donors: 2
H-acceptors: 2
PSA: 49
Number of rings: 2

     

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