COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL042396
Chemical Name: 7-[2-(1H-benzimidazol-2-ylsulfanyl)ethyl]-8-[benzyl(methyl)amino]-6-hydroxy-3-methyl-3,7-dihydro-2H-purin-2-one
Smiles: CN(c1nc2c(n1CCSc1nc3c([nH]1)cccc3)c(O)nc(=O)n2C)Cc1ccccc1

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Molecular Weight: 461.55
Empirical Formula: C23H23N7O2S

Physical State: Dry powder
Available Amount: 304 mg

Lipinsky:
logP: 3.377
Rotatable bonds: 5
H-donors: 2
H-acceptors: 2
PSA: 127
Number of rings: 5

     

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