COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK287110
Chemical Name: 5-{5-[(1E)-2-cyano-3-ethoxy-3-oxoprop-1-en-1-yl]furan-2-yl}benzene-1,3-dicarboxylicacid
Smiles: CCOC(=O)/C(=C/c1ccc(o1)c1cc(cc(c1)C(=O)O)C(=O)O)/C#N

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Molecular Weight: 355.3
Empirical Formula: C18H13NO7

Physical State: Dry powder
Available Amount: 326 mg

Lipinsky:
logP: 3.58
Rotatable bonds: 8
H-donors: 2
H-acceptors: 7
PSA: 137
Number of rings: 2

     

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