COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK570538
Chemical Name: (5Z)-1-(2-methoxyphenyl)-2,6-dioxo-5-{[2-(1,3,7-trimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-9-ium-8-yl)hydrazinyl]methylidene}-1,2,5,6-tetrahydropyrimidin-4-olate
Smiles: COc1ccccc1N1C(=O)N=C(/C(=C/NNc2[nH+]c3c(n2C)c(=O)n(c(=O)n3C)C)/C1=O)[O-]

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Molecular Weight: 468.43
Empirical Formula: C20H20N8O6

Physical State: Dry powder
Available Amount: 298 mg

Lipinsky:
logP: 0.428
Rotatable bonds: 2
H-donors: 3
H-acceptors: 6
PSA: 165
Number of rings: 4

     

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