COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL326632
Chemical Name: 2-butanoyl-5,5-dimethyl-3-(pyridin-4-ylamino)cyclohex-2-en-1-one
Smiles: CCCC(=O)C1=C(Nc2ccncc2)CC(CC1=O)(C)C

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Molecular Weight: 286.37
Empirical Formula: C17H22N2O2

Physical State: Dry powder
Available Amount: 59 mg

Lipinsky:
logP: 2.675
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 59
Number of rings: 2

     

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