COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK742495
Chemical Name: 4-{5-[(1E)-2-cyano-3-ethoxy-3-oxoprop-1-en-1-yl]furan-2-yl}benzoicacid
Smiles: CCOC(=O)/C(=C/c1ccc(o1)c1ccc(cc1)C(=O)O)/C#N

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Molecular Weight: 311.29
Empirical Formula: C17H13NO5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.544
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 100
Number of rings: 2

     

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