COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK045784
Chemical Name: 8,8'-(ethane-1,2-diyldisulfanediyl)bis{7-[3-(4-chlorophenoxy)-2-hydroxypropyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione}
Smiles: OC(Cn1c(SCCSc2nc3c(n2CC(COc2ccc(cc2)Cl)O)c(=O)[nH]c(=O)n3C)nc2c1c(=O)[nH]c(=O)n2C)COc1ccc(cc1)Cl

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Molecular Weight: 791.69
Empirical Formula: C32H32Cl2N8O8S2

Available Amount: 0 mg

Lipinsky:
logP: 5.535
Rotatable bonds: 15
H-donors: 4
H-acceptors: 8
PSA: 243
Number of rings: 6

     

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