COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL505614
Chemical Name: ethyl4-{(4E)-3-hydroxy-4-[(5-nitrofuran-2-yl)methylidene]-5-oxo-4,5-dihydro-1H-pyrazol-1-yl}benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1N=C(/C(=C\c2ccc(o2)[N+](=O)[O-])/C1=O)O

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Molecular Weight: 371.31
Empirical Formula: C17H13N3O7

Physical State: Dry powder
Available Amount: 291 mg

Lipinsky:
logP: 2.885
Rotatable bonds: 4
H-donors: 1
H-acceptors: 7
PSA: 138
Number of rings: 3

     

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