COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL050894
Chemical Name: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-(4-nitrophenyl)ethylidene]-5-(thiophen-2-yl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: O=C(c1nnn(c1c1cccs1)c1nonc1N)N/N=C(/c1ccc(cc1)[N+](=O)[O-])\C

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Molecular Weight: 439.41
Empirical Formula: C17H13N9O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.046
Rotatable bonds: 3
H-donors: 3
H-acceptors: 4
PSA: 211
Number of rings: 4

     

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