COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK667387
Chemical Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-{[1,3-dimethyl-7-(2-methylbenzyl)-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]sulfanyl}acetamide
Smiles: COc1cc(CCNC(=O)CSc2nc3c(n2Cc2ccccc2C)c(=O)n(c(=O)n3C)C)ccc1OC

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Molecular Weight: 537.64
Empirical Formula: C27H31N5O5S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.36
Rotatable bonds: 10
H-donors: 1
H-acceptors: 5
PSA: 131
Number of rings: 4

     

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