COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL057147
Chemical Name: (8E)-1,3-dimethyl-8-[(2E)-(4-methylbenzylidene)hydrazinylidene]-7-(naphthalen-1-ylmethyl)-3,7,8,9-tetrahydro-1H-purine-2,6-dione
Smiles: Cc1ccc(cc1)/C=N/N=c/1\[nH]c2c(n1Cc1cccc3c1cccc3)c(=O)n(c(=O)n2C)C

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Molecular Weight: 452.52
Empirical Formula: C26H24N6O2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.844
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 80
Number of rings: 5

     

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