COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK565773
Chemical Name: 2-[(1E)-1-{2-[(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-9-ium-7-yl)acetyl]hydrazinylidene}ethyl]phenolate
Smiles: O=C(Cn1c[nH+]c2c1c(=O)n(C)c(=O)n2C)N/N=C(/c1ccccc1[O-])\C

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Molecular Weight: 370.37
Empirical Formula: C17H18N6O4

Physical State: Dry powder
Available Amount: 303 mg

Lipinsky:
logP: 1.29
Rotatable bonds: 4
H-donors: 2
H-acceptors: 4
PSA: 124
Number of rings: 3

     

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