COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL350882
Chemical Name: 7,9-dimethyl-3-phenyl-1-[2-(4-phenylpiperazin-1-yl)ethyl]-1,4-dihydro[1,2,4]triazino[3,4-f]purine-6,8(7H,9H)-dione
Smiles: O=c1n(C)c2nc3n(c2c(=O)n1C)CC(=NN3CCN1CCN(CC1)c1ccccc1)c1ccccc1

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Molecular Weight: 498.59
Empirical Formula: C27H30N8O2

Physical State: Dry powder
Available Amount: 312 mg

Lipinsky:
logP: 3.324
Rotatable bonds: 2
H-donors: 0
H-acceptors: 2
PSA: 80
Number of rings: 6

     

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