COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK547392
Chemical Name: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(diethylamino)methyl]-N'-{(E)-[4-(2,4-dinitrophenoxy)-3-ethoxyphenyl]methylidene}-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1cc(/C=N/NC(=O)c2nnn(c2CN(CC)CC)c2nonc2N)ccc1Oc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]

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Molecular Weight: 609.56
Empirical Formula: C25H27N11O8

Physical State: Dry powder
Available Amount: 309 mg

Lipinsky:
logP: 0.9
Rotatable bonds: 10
H-donors: 3
H-acceptors: 8
PSA: 250
Number of rings: 4

     

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