COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK742897
Chemical Name: 7-(2-chlorobenzyl)-1,3-dimethyl-8-{[2-(morpholin-4-yl)-2-oxoethyl]sulfanyl}-3,7-dihydro-1H-purine-2,6-dione
Smiles: O=C(N1CCOCC1)CSc1nc2c(n1Cc1ccccc1Cl)c(=O)n(c(=O)n2C)C

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Molecular Weight: 463.94
Empirical Formula: C20H22ClN5O4S

Physical State: Dry powder
Available Amount: 61 mg

Lipinsky:
logP: 3.311
Rotatable bonds: 5
H-donors: 0
H-acceptors: 4
PSA: 113
Number of rings: 4

     

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