COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK744203
Chemical Name: 8-chloro-1,3-dimethyl-7-[2-(2-methyl-5-nitro-1H-imidazol-1-yl)ethyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: [O-][N+](=O)c1cnc(n1CCn1c(Cl)nc2c1c(=O)n(C)c(=O)n2C)C

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Molecular Weight: 367.75
Empirical Formula: C13H14ClN7O4

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 1.714
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 122
Number of rings: 3

     

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