COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL339494
Chemical Name: 3-[1,3-dimethyl-2,6-dioxo-8-(4-phenylpiperazin-1-yl)-1,2,3,6-tetrahydro-7H-purin-7-yl]propanenitrile
Smiles: N#CCCn1c(nc2c1c(=O)n(c(=O)n2C)C)N1CCN(CC1)c1ccccc1

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Molecular Weight: 393.45
Empirical Formula: C20H23N7O2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.703
Rotatable bonds: 2
H-donors: 0
H-acceptors: 2
PSA: 88
Number of rings: 4

     

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