COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK979621
Chemical Name: 8-(1,3-benzodioxol-5-yl)-1,3-dimethyl-7-(3-nitrophenyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: [O-][N+](=O)c1cccc(c1)c1cn2c(n1c1ccc3c(c1)OCO3)nc1c2c(=O)n(C)c(=O)n1C

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Molecular Weight: 460.41
Empirical Formula: C22H16N6O6

Physical State: Dry powder
Available Amount: 404 mg

Lipinsky:
logP: 3.243
Rotatable bonds: 1
H-donors: 0
H-acceptors: 6
PSA: 127
Number of rings: 6

     

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