COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK804487
Chemical Name: 8-[(1,3-benzodioxol-5-ylmethyl)amino]-1-(2-fluorobenzyl)-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Fc1ccccc1Cn1c(=O)n(C)c2c(c1=O)n(C)c(n2)NCc1ccc2c(c1)OCO2

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Molecular Weight: 437.43
Empirical Formula: C22H20FN5O4

Physical State: Dry powder
Available Amount: 25 mg

Lipinsky:
logP: 3.596
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 88
Number of rings: 5

     

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