COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK897581
Chemical Name: 1,3,9-trimethyl-8-{[3-oxo-3-(piperidin-1-yl)propyl]sulfonyl}-3,9-dihydro-1H-purine-2,6-dione
Smiles: O=C(N1CCCCC1)CCS(=O)(=O)c1nc2c(n1C)n(C)c(=O)n(c2=O)C

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Molecular Weight: 397.46
Empirical Formula: C16H23N5O5S

Physical State: Dry powder
Available Amount: 85 mg

Lipinsky:
logP: 0.524
Rotatable bonds: 4
H-donors: 0
H-acceptors: 5
PSA: 121
Number of rings: 3

     

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