COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK563297
Chemical Name: 2-methoxy-4-{(E)-[2-(1,3,7-trimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-9-ium-8-yl)hydrazinylidene]methyl}phenolate
Smiles: COc1cc(/C=N/Nc2[nH+]c3c(n2C)c(=O)n(c(=O)n3C)C)ccc1[O-]

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Molecular Weight: 358.36
Empirical Formula: C16H18N6O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.848
Rotatable bonds: 3
H-donors: 2
H-acceptors: 4
PSA: 116
Number of rings: 3

     

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