COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK766302
Chemical Name: 7-benzyl-1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Clc1cc2OCOc2cc1Cn1c(=O)n(C)c2c(c1=O)n(cn2)Cc1ccccc1

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Molecular Weight: 424.84
Empirical Formula: C21H17ClN4O4

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.905
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 76
Number of rings: 5

     

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