COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK565807
Chemical Name: 2,6-dimethoxy-4-[(E)-(4H-1,2,4-triazol-1-ium-4-ylimino)methyl]phenolate
Smiles: COc1cc(/C=N/n2c[nH+]nc2)cc(c1[O-])OC

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Molecular Weight: 248.24
Empirical Formula: C11H12N4O3

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 0.611
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 85
Number of rings: 2

     

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