COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL368358
Chemical Name: 8-[(4-chlorophenyl)sulfanyl]-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Clc1ccc(cc1)Sc1nc2c(n1C)c(=O)n(c(=O)n2C)C

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Molecular Weight: 336.8
Empirical Formula: C14H13ClN4O2S

Physical State: Dry powder
Available Amount: 20 mg

Lipinsky:
logP: 3.927
Rotatable bonds: 1
H-donors: 0
H-acceptors: 2
PSA: 83
Number of rings: 3

     

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