COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK076490
Chemical Name: 1,3-dimethyl-8-(4-methylpiperidin-1-yl)-7-[3-(trifluoromethyl)benzyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC1CCN(CC1)c1nc2c(n1Cc1cccc(c1)C(F)(F)F)c(=O)n(c(=O)n2C)C

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Molecular Weight: 435.45
Empirical Formula: C21H24F3N5O2

Physical State: Dry powder
Available Amount: 210 mg

Lipinsky:
logP: 3.701
Rotatable bonds: 2
H-donors: 0
H-acceptors: 2
PSA: 61
Number of rings: 4

     

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