COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK076261
Chemical Name: 1,3-dimethyl-8-[(4-methylbenzyl)sulfanyl]-3,9-dihydro-1H-purine-2,6-dione
Smiles: Cc1ccc(cc1)CSc1nc2c([nH]1)n(C)c(=O)n(c2=O)C

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Molecular Weight: 316.38
Empirical Formula: C15H16N4O2S

Physical State: Dry powder
Available Amount: 81 mg

Lipinsky:
logP: 3.456
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 94
Number of rings: 3

     

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