COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK839813
Chemical Name: 1,3-dimethyl-7-(3-methylbenzyl)-8-sulfanyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cc1cccc(c1)Cn1c(S)nc2c1c(=O)n(C)c(=O)n2C

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Molecular Weight: 316.38
Empirical Formula: C15H16N4O2S

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: 1.085
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 97
Number of rings: 3

     

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