COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK942614
Chemical Name: 8-(3,5-dimethyl-1H-pyrazol-1-yl)-7-(2-methoxyethyl)-3-methyl-1-(2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: COCCn1c(nc2c1c(=O)n(CCc1ccccc1)c(=O)n2C)n1nc(cc1C)C

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Molecular Weight: 422.49
Empirical Formula: C22H26N6O3

Physical State: Dry powder
Available Amount: 325 mg

Lipinsky:
logP: 4.403
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 85
Number of rings: 4

     

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