COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK869153
Chemical Name: 1,3-dimethyl-7-(prop-2-en-1-yl)-8-[3-(trifluoromethyl)phenoxy]-3,7-dihydro-1H-purine-2,6-dione
Smiles: C=CCn1c(Oc2cccc(c2)C(F)(F)F)nc2c1c(=O)n(c(=O)n2C)C

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Molecular Weight: 380.33
Empirical Formula: C17H15F3N4O3

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 4.48
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 67
Number of rings: 3

     

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