COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK743904
Chemical Name: 1-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Brc1cc2OCOc2cc1Cn1c(=O)c2n(C)cnc2n(c1=O)C

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Molecular Weight: 393.2
Empirical Formula: C15H13BrN4O4

Physical State: Dry powder
Available Amount: 103 mg

Lipinsky:
logP: 2.412
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 76
Number of rings: 4

     

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