COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL046712
Chemical Name: (E)-1-benzofuran-2-yl{1-[3-(1H-imidazol-3-ium-1-yl)propyl]-2-(2-methoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: COc1ccccc1C1N(CCCn2c[nH+]cc2)C(=O)C(=O)/C/1=C(\c1cc2c(o1)cccc2)/[O-]

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Molecular Weight: 457.49
Empirical Formula: C26H23N3O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.523
Rotatable bonds: 7
H-donors: 1
H-acceptors: 5
PSA: 101
Number of rings: 5

     

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