COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK840837
Chemical Name: 1,3-dimethyl-7-(3-methylbenzyl)-8-(propan-2-ylsulfanyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cc1cccc(c1)Cn1c(SC(C)C)nc2c1c(=O)n(C)c(=O)n2C

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Molecular Weight: 358.46
Empirical Formula: C18H22N4O2S

Physical State: Dry powder
Available Amount: 283 mg

Lipinsky:
logP: 4.455
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 83
Number of rings: 3

     

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