COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL321900
Chemical Name: 3-methyl-8-[(2E)-2-(4-nitrobenzylidene)hydrazinyl]-7-nonyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCn1c(N/N=C/c2ccc(cc2)[N+](=O)[O-])nc2c1c(=O)[nH]c(=O)n2C

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Molecular Weight: 455.52
Empirical Formula: C22H29N7O4

Available Amount: 0 mg

Lipinsky:
logP: 5.68
Rotatable bonds: 9
H-donors: 2
H-acceptors: 4
PSA: 137
Number of rings: 3

     

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