COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK770882
Chemical Name: N-(4-ethylphenyl)-2-{5-[(1,3,7-trimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]-1H-1,2,4-triazol-1-yl}acetamide
Smiles: CCc1ccc(cc1)NC(=O)Cn1ncnc1Sc1nc2c(n1C)c(=O)n(c(=O)n2C)C

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Molecular Weight: 454.51
Empirical Formula: C20H22N8O3S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.893
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 143
Number of rings: 4

     

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