COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK564186
Chemical Name: 7-[3-(4-chlorophenoxy)-2-hydroxypropyl]-6-hydroxy-3-methyl-8-(propylsulfanyl)-3,7-dihydro-2H-purin-2-one
Smiles: CCCSc1nc2c(n1CC(COc1ccc(cc1)Cl)O)c(O)nc(=O)n2C

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Molecular Weight: 424.91
Empirical Formula: C18H21ClN4O4S

Physical State: Dry powder
Available Amount: 304 mg

Lipinsky:
logP: 3.434
Rotatable bonds: 9
H-donors: 2
H-acceptors: 4
PSA: 125
Number of rings: 3

     

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