COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL492839
Chemical Name: 4-({4-[3-methyl-6-oxo-1-(7H-purin-6-yl)-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-b]pyridin-4-yl]phenoxy}methyl)benzonitrile
Smiles: N#Cc1ccc(cc1)COc1ccc(cc1)C1CC(=O)Nc2c1c(C)nn2c1ncnc2c1[nH]cn2

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Molecular Weight: 476.5
Empirical Formula: C26H20N8O2

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 3.671
Rotatable bonds: 1
H-donors: 2
H-acceptors: 2
PSA: 134
Number of rings: 6

     

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