COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL046403
Chemical Name: 8,8'-(ethane-1,2-diyldisulfanediyl)bis{7-[3-(4-chlorophenoxy)-2-hydroxypropyl]-6-hydroxy-3-methyl-3,7-dihydro-2H-purin-2-one}
Smiles: OC(Cn1c(SCCSc2nc3c(n2CC(COc2ccc(cc2)Cl)O)c(O)nc(=O)n3C)nc2c1c(O)nc(=O)n2C)COc1ccc(cc1)Cl

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Molecular Weight: 791.69
Empirical Formula: C32H32Cl2N8O8S2

Physical State: Dry powder
Available Amount: 9 mg

Lipinsky:
logP: 4.835
Rotatable bonds: 17
H-donors: 4
H-acceptors: 8
PSA: 250
Number of rings: 6

     

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