COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK522803
Chemical Name: (2E)-3-[5-bromo-2-(prop-2-en-1-yloxy)phenyl]-2-cyano-N-(2-methoxy-4-nitrophenyl)prop-2-enamide
Smiles: C=CCOc1ccc(cc1/C=C(/C(=O)Nc1ccc(cc1OC)[N+](=O)[O-])\C#N)Br

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Molecular Weight: 458.27
Empirical Formula: C20H16BrN3O5

Physical State: Dry powder
Available Amount: 140 mg

Lipinsky:
logP: 5.947
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 117
Number of rings: 2

     

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