COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK805573
Chemical Name: 7-benzyl-3-methyl-8-[(2-phenylethyl)sulfanyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cn1c(=O)[nH]c(=O)c2c1nc(n2Cc1ccccc1)SCCc1ccccc1

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Molecular Weight: 392.48
Empirical Formula: C21H20N4O2S

Physical State: Dry powder
Available Amount: 252 mg

Lipinsky:
logP: 4.599
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 92
Number of rings: 4

     

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