COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK573021
Chemical Name: 6-hydroxy-7-(2-methoxyethyl)-3-methyl-8-[(4-methylphenyl)sulfanyl]-3,7-dihydro-2H-purin-2-one
Smiles: COCCn1c(Sc2ccc(cc2)C)nc2c1c(O)nc(=O)n2C

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Molecular Weight: 346.41
Empirical Formula: C16H18N4O3S

Physical State: Dry powder
Available Amount: 303 mg

Lipinsky:
logP: 2.502
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 105
Number of rings: 3

     

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