COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK527848
Chemical Name: 2-[(3-methyl-7-octyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]-N-phenylacetamide
Smiles: CCCCCCCCn1c(SCC(=O)Nc2ccccc2)nc2c1c(=O)[nH]c(=O)n2C

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Molecular Weight: 443.57
Empirical Formula: C22H29N5O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.355
Rotatable bonds: 10
H-donors: 2
H-acceptors: 3
PSA: 121
Number of rings: 3

     

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