COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL003562
Chemical Name: 1,3-dimethyl-8-(morpholin-4-ylmethyl)-7-(3-oxobutan-2-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(=O)C(n1c(CN2CCOCC2)nc2c1c(=O)n(c(=O)n2C)C)C

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Molecular Weight: 349.39
Empirical Formula: C16H23N5O4

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: -0.728
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 87
Number of rings: 3

     

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