COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL054375
Chemical Name: 8-(azepan-1-yl)-7-[2-(azepan-1-yl)ethyl]-6-hydroxy-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: O=c1nc(O)c2c(n1C)nc(n2CCN1CCCCCC1)N1CCCCCC1

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Molecular Weight: 388.51
Empirical Formula: C20H32N6O2

Physical State: Dry powder
Available Amount: 314 mg

Lipinsky:
logP: 2.345
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 77
Number of rings: 4

     

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