COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL148067
Chemical Name: 8-[(3-chloro-2-hydroxypropyl)sulfanyl]-6-hydroxy-3-methyl-7-pentyl-3,7-dihydro-2H-purin-2-one
Smiles: CCCCCn1c(SCC(CCl)O)nc2c1c(O)nc(=O)n2C

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Molecular Weight: 360.86
Empirical Formula: C14H21ClN4O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.476
Rotatable bonds: 10
H-donors: 2
H-acceptors: 3
PSA: 116
Number of rings: 2

     

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