COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL434399
Chemical Name: 4-(3-bromo-4-fluorophenyl)-5-nitro-1-(propan-2-yl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Smiles: [O-][N+](=O)C1C(=O)Nc2c(C1c1ccc(c(c1)Br)F)cnn2C(C)C

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Molecular Weight: 397.2
Empirical Formula: C15H14BrFN4O3

Physical State: Dry powder
Available Amount: 68 mg

Lipinsky:
logP: 2.773
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 92
Number of rings: 3

     

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