COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL005222
Chemical Name: 8-[(4-methoxybenzyl)amino]-3-methyl-7-octyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCn1c(NCc2ccc(cc2)OC)nc2c1c(=O)[nH]c(=O)n2C

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Molecular Weight: 413.52
Empirical Formula: C22H31N5O3

Available Amount: 0 mg

Lipinsky:
logP: 4.83
Rotatable bonds: 8
H-donors: 2
H-acceptors: 3
PSA: 88
Number of rings: 3

     

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