COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK183615
Chemical Name: (2E)-3-{3-bromo-4-[(3-nitrobenzyl)oxy]phenyl}-2-cyano-N-(2-fluorophenyl)prop-2-enamide
Smiles: N#C/C(=C\c1ccc(c(c1)Br)OCc1cccc(c1)[N+](=O)[O-])/C(=O)Nc1ccccc1F

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Molecular Weight: 496.29
Empirical Formula: C23H15BrFN3O4

Physical State: Dry powder
Available Amount: 150 mg

Lipinsky:
logP: 5.313
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 107
Number of rings: 3

     

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