COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK560159
Chemical Name: 8-(4-benzylpiperidin-1-yl)-6-hydroxy-3-methyl-7-{3-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]propyl}-3,7-dihydro-2H-purin-2-one
Smiles: O=c1nc(O)c2c(n1C)nc(n2CCCSc1nnnn1c1ccccc1)N1CCC(CC1)Cc1ccccc1

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Molecular Weight: 557.68
Empirical Formula: C28H31N9O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.533
Rotatable bonds: 7
H-donors: 1
H-acceptors: 2
PSA: 142
Number of rings: 6

     

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