COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL295946
Chemical Name: (4E)-4-[(2E)-3-(5-nitrofuran-2-yl)prop-2-en-1-ylidene]-1-phenylpyrazolidine-3,5-dione
Smiles: O=C1NN(C(=O)/C/1=C/C=C/c1ccc(o1)[N+](=O)[O-])c1ccccc1

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Molecular Weight: 325.28
Empirical Formula: C16H11N3O5

Physical State: Dry powder
Available Amount: 81 mg

Lipinsky:
logP: 2.16
Rotatable bonds: 2
H-donors: 1
H-acceptors: 5
PSA: 108
Number of rings: 3

     

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