COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL049205
Chemical Name: 8-cyclohexyl-1,3-dimethyl-7-(4-nitrophenyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: [O-][N+](=O)c1ccc(cc1)c1cn2c(n1C1CCCCC1)nc1c2c(=O)n(C)c(=O)n1C

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Molecular Weight: 422.44
Empirical Formula: C21H22N6O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.504
Rotatable bonds: 1
H-donors: 0
H-acceptors: 4
PSA: 108
Number of rings: 5

     

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