COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK093184
Chemical Name: 3-methyl-7-(2-phenylethyl)-8-[(2-phenylethyl)sulfanyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: O=c1[nH]c(=O)c2c(n1C)nc(n2CCc1ccccc1)SCCc1ccccc1

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Molecular Weight: 406.51
Empirical Formula: C22H22N4O2S

Physical State: Dry powder
Available Amount: 321 mg

Lipinsky:
logP: 5.015
Rotatable bonds: 5
H-donors: 1
H-acceptors: 2
PSA: 92
Number of rings: 4

     

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