COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK182296
Chemical Name: (2E)-3-(3-bromo-4-hydroxy-5-nitrophenyl)-2-cyano-N-(4-ethoxyphenyl)prop-2-enamide
Smiles: CCOc1ccc(cc1)NC(=O)/C(=C/c1cc(Br)c(c(c1)[N+](=O)[O-])O)/C#N

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Molecular Weight: 432.23
Empirical Formula: C18H14BrN3O5

Physical State: Dry powder
Available Amount: 150 mg

Lipinsky:
logP: 4.58
Rotatable bonds: 4
H-donors: 2
H-acceptors: 5
PSA: 128
Number of rings: 2

     

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