COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL151159
Chemical Name: 8,8'-(ethane-1,2-diyldisulfanediyl)bis[6-hydroxy-3-methyl-7-(3-methylbenzyl)-3,7-dihydro-2H-purin-2-one]
Smiles: Cc1cccc(c1)Cn1c(SCCSc2nc3c(n2Cc2cccc(c2)C)c(O)nc(=O)n3C)nc2c1c(O)nc(=O)n2C

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Molecular Weight: 630.75
Empirical Formula: C30H30N8O4S2

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 5.124
Rotatable bonds: 11
H-donors: 2
H-acceptors: 4
PSA: 192
Number of rings: 6

     

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