COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK561040
Chemical Name: (E)-1-benzofuran-2-yl{2-(2,5-dimethoxyphenyl)-1-[3-(dimethylammonio)propyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: COc1ccc(c(c1)C1N(CCC[NH+](C)C)C(=O)C(=O)/C/1=C(\c1cc2c(o1)cccc2)/[O-])OC

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Molecular Weight: 464.52
Empirical Formula: C26H28N2O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.76
Rotatable bonds: 8
H-donors: 1
H-acceptors: 6
PSA: 96
Number of rings: 4

     

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