COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK839763
Chemical Name: 7-[2-hydroxy-3-(4-methoxyphenoxy)propyl]-1,3-dimethyl-8-(piperidin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: COc1ccc(cc1)OCC(Cn1c(nc2c1c(=O)n(C)c(=O)n2C)N1CCCCC1)O

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Molecular Weight: 443.5
Empirical Formula: C22H29N5O5

Physical State: Dry powder
Available Amount: 302 mg

Lipinsky:
logP: 2.231
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 100
Number of rings: 4

     

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