COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK559863
Chemical Name: methyl2-{[6-hydroxy-3-methyl-7-(3-methylbutyl)-2-oxo-3,7-dihydro-2H-purin-8-yl]sulfanyl}propanoate
Smiles: COC(=O)C(Sc1nc2c(n1CCC(C)C)c(O)nc(=O)n2C)C

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Molecular Weight: 354.43
Empirical Formula: C15H22N4O4S

Physical State: Dry powder
Available Amount: 302 mg

Lipinsky:
logP: 2.669
Rotatable bonds: 8
H-donors: 1
H-acceptors: 4
PSA: 122
Number of rings: 2

     

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