COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK743672
Chemical Name: 1,3-dimethyl-7-(2-methylbenzyl)-8-[(1H-tetrazol-5-ylmethyl)sulfanyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cc1ccccc1Cn1c(SCc2nnn[nH]2)nc2c1c(=O)n(c(=O)n2C)C

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Molecular Weight: 398.45
Empirical Formula: C17H18N8O2S

Physical State: Dry powder
Available Amount: 314 mg

Lipinsky:
logP: 2.591
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 138
Number of rings: 4

     

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