COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK922480
Chemical Name: 8-{[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]sulfanyl}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: O=C(c1ccc2c(c1)OCO2)CSc1[nH]c2c(n1)n(C)c(=O)n(c2=O)C

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Molecular Weight: 374.38
Empirical Formula: C16H14N4O5S

Available Amount: 0 mg

Lipinsky:
logP: 2.109
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 130
Number of rings: 4

     

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