COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL363896
Chemical Name: (2E)-3-[5-(4-chloro-3-nitrophenyl)furan-2-yl]-2-cyano-N-(3-ethoxyphenyl)prop-2-enamide
Smiles: CCOc1cccc(c1)NC(=O)/C(=C/c1ccc(o1)c1ccc(c(c1)[N+](=O)[O-])Cl)/C#N

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Molecular Weight: 437.84
Empirical Formula: C22H16ClN3O5

Physical State: Dry powder
Available Amount: 110 mg

Lipinsky:
logP: 5.477
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 121
Number of rings: 3

     

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