COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK852453
Chemical Name: 8-{[4-(furan-2-ylcarbonyl)piperazin-1-yl]methyl}-1,3-dimethyl-7-(3-methylbenzyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cc1cccc(c1)Cn1c(CN2CCN(CC2)C(=O)c2ccco2)nc2c1c(=O)n(c(=O)n2C)C

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Molecular Weight: 476.54
Empirical Formula: C25H28N6O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.932
Rotatable bonds: 4
H-donors: 0
H-acceptors: 4
PSA: 95
Number of rings: 5

     

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