COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK065502
Chemical Name: 1,3-dimethyl-8-(morpholin-4-yl)-7-[3-(trifluoromethyl)benzyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cn1c(=O)n(C)c2c(c1=O)n(Cc1cccc(c1)C(F)(F)F)c(n2)N1CCOCC1

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Molecular Weight: 423.39
Empirical Formula: C19H20F3N5O3

Physical State: Dry powder
Available Amount: 207 mg

Lipinsky:
logP: 1.663
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 70
Number of rings: 4

     

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