COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL495768
Chemical Name: (4Z)-2-(2,4-dimethylphenyl)-5-methyl-4-[(5-nitrofuran-2-yl)methylidene]-2,4-dihydro-3H-pyrazol-3-one
Smiles: Cc1ccc(c(c1)C)N1N=C(/C(=C/c2ccc(o2)[N+](=O)[O-])/C1=O)C

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Molecular Weight: 325.32
Empirical Formula: C17H15N3O4

Physical State: Dry powder
Available Amount: 79 mg

Lipinsky:
logP: 3.425
Rotatable bonds: 1
H-donors: 0
H-acceptors: 4
PSA: 91
Number of rings: 3

     

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