COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL002031
Chemical Name: methyl{8-[(4-benzylpiperazin-1-yl)methyl]-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl}acetate
Smiles: COC(=O)Cn1c(CN2CCN(CC2)Cc2ccccc2)nc2c1c(=O)n(c(=O)n2C)C

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Molecular Weight: 440.5
Empirical Formula: C22H28N6O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.512
Rotatable bonds: 4
H-donors: 0
H-acceptors: 4
PSA: 91
Number of rings: 4

     

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