COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK963640
Chemical Name: 3-benzyl-8-{[2-(4-chloro-3-methylphenoxy)ethyl]sulfanyl}-7-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Clc1ccc(cc1C)OCCSc1nc2c(n1C)c(=O)[nH]c(=O)n2Cc1ccccc1

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Molecular Weight: 456.95
Empirical Formula: C22H21ClN4O3S

Available Amount: 0 mg

Lipinsky:
logP: 5.47
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 101
Number of rings: 4

     

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