COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL028836
Chemical Name: 4-hydroxy-4-(pyridin-2-yl)butan-2-one
Smiles: CC(=O)CC(c1ccccn1)O

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Molecular Weight: 165.19
Empirical Formula: C9H11NO2

Physical State: Dry powder
Available Amount: 1014 mg

Lipinsky:
logP: -0.802
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 50
Number of rings: 1

     

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