COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL317250
Chemical Name: 3,4,9-trimethyl-7-(2-methylprop-2-en-1-yl)-1,4-dihydro[1,2,4]triazino[3,4-f]purine-6,8(7H,9H)-dione
Smiles: CC(=C)Cn1c(=O)n(C)c2c(c1=O)n1c(n2)NN=C(C1C)C

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Molecular Weight: 302.34
Empirical Formula: C14H18N6O2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.788
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 82
Number of rings: 3

     

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