COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL349680
Chemical Name: 2-butanoyl-3-(hexylamino)-5,5-dimethylcyclohex-2-en-1-one
Smiles: CCCCCCNC1=C(C(=O)CCC)C(=O)CC(C1)(C)C

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Molecular Weight: 293.45
Empirical Formula: C18H31NO2

Physical State: Dry powder
Available Amount: 10 mg

Lipinsky:
logP: 4.497
Rotatable bonds: 8
H-donors: 1
H-acceptors: 2
PSA: 46
Number of rings: 1

     

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