COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL055426
Chemical Name: (8E)-8-[(2E)-3,4-dihydronaphthalen-1(2H)-ylidenehydrazinylidene]-7-(4-fluorobenzyl)-1,3-dimethyl-3,7,8,9-tetrahydro-1H-purine-2,6-dione
Smiles: Fc1ccc(cc1)Cn1/c(=N/N=C/2\CCCc3c2cccc3)/[nH]c2c1c(=O)n(c(=O)n2C)C

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Molecular Weight: 446.48
Empirical Formula: C24H23FN6O2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.693
Rotatable bonds: 1
H-donors: 1
H-acceptors: 2
PSA: 80
Number of rings: 5

     

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