COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK529747
Chemical Name: ethyl4-{5-[(1E)-2-cyano-3-(hexadecyloxy)-3-oxoprop-1-en-1-yl]furan-2-yl}benzoate
Smiles: CCCCCCCCCCCCCCCCOC(=O)/C(=C/c1ccc(o1)c1ccc(cc1)C(=O)OCC)/C#N

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Molecular Weight: 535.72
Empirical Formula: C33H45NO5

Physical State: Dry powder
Available Amount: 325 mg

Lipinsky:
logP: 11.607
Rotatable bonds: 20
H-donors: 0
H-acceptors: 5
PSA: 89
Number of rings: 2

     

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