COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL351237
Chemical Name: 3,7,9-trimethyl-1-[2-(4-phenylpiperazin-1-yl)ethyl]-1,4-dihydro[1,2,4]triazino[3,4-f]purine-6,8(7H,9H)-dione
Smiles: CC1=NN(CCN2CCN(CC2)c2ccccc2)c2n(C1)c1c(n2)n(C)c(=O)n(c1=O)C

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Molecular Weight: 436.52
Empirical Formula: C22H28N8O2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.572
Rotatable bonds: 2
H-donors: 0
H-acceptors: 2
PSA: 80
Number of rings: 5

     

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