COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL382781
Chemical Name: (2E)-N-(4-bromo-2-fluorophenyl)-2-cyano-3-(4-nitrophenyl)prop-2-enamide
Smiles: N#C/C(=C\c1ccc(cc1)[N+](=O)[O-])/C(=O)Nc1ccc(cc1F)Br

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Molecular Weight: 390.17
Empirical Formula: C16H9BrFN3O3

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 4.285
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 98
Number of rings: 2

     

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