COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK004602
Chemical Name: {4-[(1E)-2-cyano-3-oxo-3-(propan-2-ylamino)prop-1-en-1-yl]-2-ethoxyphenoxy}aceticacid
Smiles: CCOc1cc(ccc1OCC(=O)O)/C=C(/C(=O)NC(C)C)\C#N

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Molecular Weight: 332.36
Empirical Formula: C17H20N2O5

Physical State: Dry powder
Available Amount: 123 mg

Lipinsky:
logP: 1.546
Rotatable bonds: 9
H-donors: 2
H-acceptors: 5
PSA: 108
Number of rings: 1

     

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