COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL514374
Chemical Name: (2Z)-3-oxo-2-(pyridinium-3-ylmethylidene)-2,3-dihydro-1-benzofuran-6-olate
Smiles: [O-]c1ccc2c(c1)O/C(=C\c1ccc[nH+]c1)/C2=O

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Molecular Weight: 239.23
Empirical Formula: C14H9NO3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.727
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 63
Number of rings: 3

     

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