COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL047328
Chemical Name: 4-bromo-2-{(E)-[(3,5-dimethyl-4H-1,2,4-triazol-1-ium-4-yl)imino]methyl}phenolate
Smiles: Brc1ccc(c(c1)/C=N/n1c(C)n[nH+]c1C)[O-]

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Molecular Weight: 295.14
Empirical Formula: C11H11BrN4O

Physical State: Dry powder
Available Amount: 303 mg

Lipinsky:
logP: 2.909
Rotatable bonds: 2
H-donors: 1
H-acceptors: 1
PSA: 67
Number of rings: 2

     

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