COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL157120
Chemical Name: [1,3-dimethyl-2,6-dioxo-8-(4-phenylpiperazin-1-yl)-1,2,3,6-tetrahydro-7H-purin-7-yl]aceticacid
Smiles: OC(=O)Cn1c(nc2c1c(=O)n(c(=O)n2C)C)N1CCN(CC1)c1ccccc1

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Molecular Weight: 398.42
Empirical Formula: C19H22N6O4

Physical State: Dry powder
Available Amount: 304 mg

Lipinsky:
logP: 0.696
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 102
Number of rings: 4

     

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