COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL391955
Chemical Name: (2E)-1-(1-ethyl-5-methyl-1H-pyrazol-4-yl)-3-(4-nitrophenyl)prop-2-en-1-one
Smiles: CCn1ncc(c1C)C(=O)/C=C/c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 285.3
Empirical Formula: C15H15N3O3

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 3.152
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 80
Number of rings: 2

     

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