COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK768364
Chemical Name: 8-{[1-(4-methoxy-3-nitrobenzyl)-1H-1,2,4-triazol-3-yl]sulfanyl}-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: COc1ccc(cc1[N+](=O)[O-])Cn1cnc(n1)Sc1nc2c(n1C)c(=O)n(c(=O)n2C)C

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Molecular Weight: 458.46
Empirical Formula: C18H18N8O5S

Physical State: Dry powder
Available Amount: 11 mg

Lipinsky:
logP: 2.185
Rotatable bonds: 5
H-donors: 0
H-acceptors: 5
PSA: 169
Number of rings: 4

     

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