COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL046804
Chemical Name: 6-hydroxy-3-methyl-8-[(2-methylprop-2-en-1-yl)sulfanyl]-7-(3-phenylpropyl)-3,7-dihydro-2H-purin-2-one
Smiles: CC(=C)CSc1nc2c(n1CCCc1ccccc1)c(O)nc(=O)n2C

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Molecular Weight: 370.48
Empirical Formula: C19H22N4O2S

Physical State: Dry powder
Available Amount: 308 mg

Lipinsky:
logP: 4.283
Rotatable bonds: 7
H-donors: 1
H-acceptors: 2
PSA: 96
Number of rings: 3

     

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