COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK850783
Chemical Name: 7-[2-(1,3-benzoxazol-2-ylsulfanyl)ethyl]-8-[benzyl(methyl)amino]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CN(c1nc2c(n1CCSc1nc3c(o1)cccc3)c(=O)n(c(=O)n2C)C)Cc1ccccc1

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Molecular Weight: 476.56
Empirical Formula: C24H24N6O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.814
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 113
Number of rings: 5

     

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