COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL044764
Chemical Name: 6-hydroxy-3-methyl-8-{[2-(piperidin-1-yl)ethyl]sulfanyl}-7-(prop-2-en-1-yl)-3,7-dihydro-2H-purin-2-one
Smiles: C=CCn1c(SCCN2CCCCC2)nc2c1c(O)nc(=O)n2C

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Molecular Weight: 349.46
Empirical Formula: C16H23N5O2S

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 2.523
Rotatable bonds: 6
H-donors: 1
H-acceptors: 2
PSA: 99
Number of rings: 3

     

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