COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK630047
Chemical Name: 1,3,9-trimethyl-7-(3-phenylpropyl)-1,4-dihydro[1,2,4]triazino[3,4-f]purine-6,8(7H,9H)-dione
Smiles: CC1=NN(C)c2n(C1)c1c(=O)n(CCCc3ccccc3)c(=O)n(c1n2)C

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Molecular Weight: 366.42
Empirical Formula: C19H22N6O2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.302
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 74
Number of rings: 4

     

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