COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL003223
Chemical Name: 8-{[(2Z)-3-chlorobut-2-en-1-yl]sulfanyl}-3-methyl-7-(4-methylbenzyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: C/C(=C/CSc1nc2c(n1Cc1ccc(cc1)C)c(=O)[nH]c(=O)n2C)/Cl

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Molecular Weight: 390.89
Empirical Formula: C18H19ClN4O2S

Available Amount: 0 mg

Lipinsky:
logP: 4.903
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 92
Number of rings: 3

     

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