COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL322118
Chemical Name: 7-[2-hydroxy-2-(4-nitrophenyl)ethyl]-3-methyl-8-(morpholin-4-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: OC(c1ccc(cc1)[N+](=O)[O-])Cn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCOCC1

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Saltdata: HCl
Molecular Weight: 416.39
Empirical Formula: C18H20N6O6

Available Amount: 0 mg

Lipinsky:
logP: -0.454
Rotatable bonds: 3
H-donors: 2
H-acceptors: 6
PSA: 145
Number of rings: 4

     

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