COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL147989
Chemical Name: 8,8'-sulfanediylbis(6-hydroxy-3-methyl-7-octyl-3,7-dihydro-2H-purin-2-one)
Smiles: CCCCCCCCn1c(Sc2nc3c(n2CCCCCCCC)c(O)nc(=O)n3C)nc2c1c(O)nc(=O)n2C

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Molecular Weight: 586.76
Empirical Formula: C28H42N8O4S

Physical State: Dry powder
Available Amount: 145 mg

Lipinsky:
logP: 7.133
Rotatable bonds: 18
H-donors: 2
H-acceptors: 4
PSA: 166
Number of rings: 4

     

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