COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK567100
Chemical Name: (5Z)-1-methyl-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: O=C1N=C([O-])/C(=C/NNc2[nH+]c3c(n2C)c(=O)n(c(=O)n3C)C)/C(=O)N1C

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Molecular Weight: 376.33
Empirical Formula: C14H16N8O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: -1.239
Rotatable bonds: 1
H-donors: 3
H-acceptors: 5
PSA: 156
Number of rings: 3

     

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