COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK854125
Chemical Name: 3,7,9-trimethyl-1-(2-oxopropyl)-1,4-dihydro[1,2,4]triazino[3,4-f]purine-6,8(7H,9H)-dione
Smiles: CC(=O)CN1N=C(C)Cn2c1nc1c2c(=O)n(c(=O)n1C)C

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Molecular Weight: 304.31
Empirical Formula: C13H16N6O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: -0.555
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 91
Number of rings: 3

     

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