COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK546505
Chemical Name: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(2,3-dihydro-1H-indol-1-ylmethyl)-N'-{(E)-[4-(2,4-dinitrophenoxy)-3-ethoxyphenyl]methylidene}-1H-1,2,3-triazole-4-carbohydrazide
Smiles: CCOc1cc(/C=N/NC(=O)c2nnn(c2CN2CCc3c2cccc3)c2nonc2N)ccc1Oc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]

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Molecular Weight: 655.59
Empirical Formula: C29H25N11O8

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 1.664
Rotatable bonds: 9
H-donors: 3
H-acceptors: 8
PSA: 250
Number of rings: 6

     

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