COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK779961
Chemical Name: 8-(diethylamino)-7-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: COc1cc(ccc1OC)C(=O)Cn1c(nc2c1c(=O)n(C)c(=O)n2C)N(CC)CC

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Molecular Weight: 429.48
Empirical Formula: C21H27N5O5

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 2.79
Rotatable bonds: 7
H-donors: 0
H-acceptors: 5
PSA: 97
Number of rings: 3

     

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