COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL326281
Chemical Name: 3-[3-methyl-8-(4-methylpiperazin-1-yl)-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl]propanenitrile
Smiles: N#CCCn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCN(CC1)C

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Molecular Weight: 317.35
Empirical Formula: C14H19N7O2

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: -1.318
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 97
Number of rings: 3

     

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