COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL147385
Chemical Name: 2-{[2-(8-bromo-6-hydroxy-3-methyl-2-oxo-2,3-dihydro-7H-purin-7-yl)ethyl]sulfanyl}-N-phenylacetamide
Smiles: O=C(Nc1ccccc1)CSCCn1c(Br)nc2c1c(O)nc(=O)n2C

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Molecular Weight: 438.3
Empirical Formula: C16H16BrN5O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.427
Rotatable bonds: 6
H-donors: 2
H-acceptors: 3
PSA: 125
Number of rings: 3

     

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