COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL148902
Chemical Name: 2,4-diiodo-6-{(E)-[2-(1,3,7-trimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-9-ium-8-yl)hydrazinylidene]methyl}phenolate
Smiles: Ic1cc(/C=N/Nc2[nH+]c3c(n2C)c(=O)n(c(=O)n3C)C)c(c(c1)I)[O-]

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Molecular Weight: 580.12
Empirical Formula: C15H14I2N6O3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.726
Rotatable bonds: 2
H-donors: 2
H-acceptors: 3
PSA: 107
Number of rings: 3

     

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