COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL160044
Chemical Name: 4-(6-bromo-4H-1,3-benzodioxin-8-yl)-6-hydroxy-1-(propan-2-yl)-1,2,4,5-tetrahydro-3H-pyrazolo[3,4-b]pyridin-3-one
Smiles: Brc1cc(c2c(c1)COCO2)C1CC(=Nc2c1c(=O)[nH]n2C(C)C)O

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Molecular Weight: 408.25
Empirical Formula: C17H18BrN3O4

Physical State: Dry powder
Available Amount: 308 mg

Lipinsky:
logP: 1.815
Rotatable bonds: 3
H-donors: 2
H-acceptors: 4
PSA: 83
Number of rings: 4

     

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