COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK553382
Chemical Name: ethyl(2E,3E)-3-(2-{[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(phenoxymethyl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)-2-(hydroxyimino)butanoate
Smiles: CCOC(=O)/C(=N/O)/C(=N/NC(=O)c1nnn(c1COc1ccccc1)c1nonc1N)/C

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Molecular Weight: 457.41
Empirical Formula: C18H19N9O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.317
Rotatable bonds: 9
H-donors: 4
H-acceptors: 6
PSA: 205
Number of rings: 3

     

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