COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL041973
Chemical Name: 6-hydroxy-8-[(4-methoxybenzyl)amino]-3-methyl-7-octyl-3,7-dihydro-2H-purin-2-one
Smiles: CCCCCCCCn1c(NCc2ccc(cc2)OC)nc2c1c(O)nc(=O)n2C

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Molecular Weight: 413.52
Empirical Formula: C22H31N5O3

Physical State: Dry powder
Available Amount: 259 mg

Lipinsky:
logP: 4.48
Rotatable bonds: 9
H-donors: 2
H-acceptors: 3
PSA: 91
Number of rings: 3

     

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