COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL382760
Chemical Name: (2E)-3-[4-(2-amino-2-oxoethoxy)phenyl]-N-(2-bromo-4-nitrophenyl)-2-cyanoprop-2-enamide
Smiles: N#C/C(=C\c1ccc(cc1)OCC(=O)N)/C(=O)Nc1ccc(cc1Br)[N+](=O)[O-]

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Molecular Weight: 445.23
Empirical Formula: C18H13BrN4O5

Physical State: Dry powder
Available Amount: 80 mg

Lipinsky:
logP: 2.902
Rotatable bonds: 3
H-donors: 3
H-acceptors: 5
PSA: 151
Number of rings: 2

     

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