COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL493102
Chemical Name: 3-methyl-4-[4-(methylsulfonyl)phenyl]-1-(7H-purin-6-yl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Smiles: O=C1CC(c2ccc(cc2)S(=O)(=O)C)c2c(N1)n(nc2C)c1ncnc2c1[nH]cn2

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Molecular Weight: 423.46
Empirical Formula: C19H17N7O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.945
Rotatable bonds: 0
H-donors: 2
H-acceptors: 3
PSA: 143
Number of rings: 5

     

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