COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL264485
Chemical Name: 8-{[2-(4-butoxyphenyl)-2-oxoethyl]sulfanyl}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCOc1ccc(cc1)C(=O)CSc1[nH]c2c(n1)n(C)c(=O)n(c2=O)C

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Molecular Weight: 402.47
Empirical Formula: C19H22N4O4S

Available Amount: 0 mg

Lipinsky:
logP: 4.367
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 120
Number of rings: 3

     

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