COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL003911
Chemical Name: 3-methyl-8-(4-methylpiperazin-1-yl)-7-(naphthalen-1-ylmethyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CN1CCN(CC1)c1nc2c(n1Cc1cccc3c1cccc3)c(=O)[nH]c(=O)n2C

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Molecular Weight: 404.47
Empirical Formula: C22H24N6O2

Available Amount: 0 mg

Lipinsky:
logP: 2.045
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 73
Number of rings: 5

     

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