COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL380654
Chemical Name: ethyl{[7-(4-bromobenzyl)-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]sulfanyl}acetate
Smiles: CCOC(=O)CSc1nc2c(n1Cc1ccc(cc1)Br)c(=O)n(c(=O)n2C)C

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Molecular Weight: 467.34
Empirical Formula: C18H19BrN4O4S

Physical State: Dry powder
Available Amount: 12 mg

Lipinsky:
logP: 4.52
Rotatable bonds: 6
H-donors: 0
H-acceptors: 4
PSA: 110
Number of rings: 3

     

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