COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL008821
Chemical Name: 3,9-dimethyl-7-[(2E)-3-phenylprop-2-en-1-yl]-1-(propan-2-yl)-1,4-dihydro[1,2,4]triazino[3,4-f]purine-6,8(7H,9H)-dione
Smiles: CC1=NN(C(C)C)c2n(C1)c1c(=O)n(C/C=C/c3ccccc3)c(=O)n(c1n2)C

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Molecular Weight: 392.46
Empirical Formula: C21H24N6O2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.938
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 74
Number of rings: 4

     

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