COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK557630
Chemical Name: 7-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]-1,3-dimethyl-8-(piperidin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: COc1cc(ccc1OC)C(=O)Cn1c(nc2c1c(=O)n(C)c(=O)n2C)N1CCCCC1

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Molecular Weight: 441.49
Empirical Formula: C22H27N5O5

Physical State: Dry powder
Available Amount: 212 mg

Lipinsky:
logP: 2.495
Rotatable bonds: 5
H-donors: 0
H-acceptors: 5
PSA: 97
Number of rings: 4

     

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