COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL037304
Chemical Name: 8-(cyclohexylamino)-7-[3-(4-ethylphenoxy)-2-hydroxypropyl]-6-hydroxy-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: CCc1ccc(cc1)OCC(Cn1c(NC2CCCCC2)nc2c1c(O)nc(=O)n2C)O

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Molecular Weight: 441.53
Empirical Formula: C23H31N5O4

Physical State: Dry powder
Available Amount: 320 mg

Lipinsky:
logP: 3.525
Rotatable bonds: 7
H-donors: 3
H-acceptors: 4
PSA: 112
Number of rings: 4

     

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