COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK529421
Chemical Name: 8-[bis(2-hydroxyethyl)amino]-7-hexyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCn1c(nc2c1c(=O)[nH]c(=O)n2C)N(CCO)CCO

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Molecular Weight: 353.42
Empirical Formula: C16H27N5O4

Physical State: Dry powder
Available Amount: 323 mg

Lipinsky:
logP: 0.784
Rotatable bonds: 11
H-donors: 3
H-acceptors: 4
PSA: 110
Number of rings: 2

     

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