COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK560254
Chemical Name: 4-{(E)-[(3,5-dimethyl-4H-1,2,4-triazol-1-ium-4-yl)imino]methyl}-2-ethoxyphenolate
Smiles: CCOc1cc(ccc1[O-])/C=N/n1c(C)n[nH+]c1C

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Molecular Weight: 260.3
Empirical Formula: C13H16N4O2

Physical State: Dry powder
Available Amount: 314 mg

Lipinsky:
logP: 1.893
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 76
Number of rings: 2

     

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