COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK999037
Chemical Name: 8-[(2-chloro-6-fluorobenzyl)sulfanyl]-7-hexadecyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCCCCCCCCn1c(SCc2c(F)cccc2Cl)nc2c1c(=O)[nH]c(=O)n2C

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Molecular Weight: 565.2
Empirical Formula: C29H42ClFN4O2S

Available Amount: 0 mg

Lipinsky:
logP: 10.582
Rotatable bonds: 18
H-donors: 1
H-acceptors: 2
PSA: 92
Number of rings: 3

     

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