COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK549037
Chemical Name: 2-[(E)-(2-{[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(3-nitrophenyl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]-4-bromophenylbenzoate
Smiles: Brc1ccc(c(c1)/C=N/NC(=O)c1nnn(c1c1cccc(c1)[N+](=O)[O-])c1nonc1N)OC(=O)c1ccccc1

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Molecular Weight: 618.36
Empirical Formula: C25H16BrN9O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.134
Rotatable bonds: 6
H-donors: 3
H-acceptors: 6
PSA: 209
Number of rings: 5

     

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