COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK179465
Chemical Name: N'-[(E)-(4-hydroxy-3-methoxy-5-nitrophenyl)methylidene]-5-nitro-1-benzofuran-2-carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2cc3c(o2)ccc(c3)[N+](=O)[O-])cc(c1O)[N+](=O)[O-]

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Molecular Weight: 400.3
Empirical Formula: C17H12N4O8

Physical State: Dry powder
Available Amount: 330 mg

Lipinsky:
logP: 2.338
Rotatable bonds: 4
H-donors: 2
H-acceptors: 8
PSA: 175
Number of rings: 3

     

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