COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL401603
Chemical Name: 2-({(4E)-4-[(1,3-dimethyl-1H-pyrazol-4-yl)methylidene]-1-ethyl-5-oxo-4,5-dihydro-1H-imidazol-2-yl}sulfanyl)-N-(4-nitrophenyl)acetamide
Smiles: CCN1C(=N/C(=C/c2cn(nc2C)C)/C1=O)SCC(=O)Nc1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 428.47
Empirical Formula: C19H20N6O4S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 3.116
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 150
Number of rings: 3

     

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