COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL008155
Chemical Name: 8-[4-(2-chloro-6-fluorobenzyl)piperazin-1-yl]-3-methyl-7-(3-methylbutyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(CCn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCN(CC1)Cc1c(F)cccc1Cl)C

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Molecular Weight: 462.95
Empirical Formula: C22H28ClFN6O2

Available Amount: 0 mg

Lipinsky:
logP: 2.723
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 73
Number of rings: 4

     

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