COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL047048
Chemical Name: (E)-1-benzofuran-2-yl{2-(2,5-dimethoxyphenyl)-1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: COc1ccc(c(c1)C1N(CCC[NH+]2CCOCC2)C(=O)C(=O)/C/1=C(\c1cc2c(o1)cccc2)/[O-])OC

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Molecular Weight: 506.56
Empirical Formula: C28H30N2O7

Physical State: Dry powder
Available Amount: 303 mg

Lipinsky:
logP: 3.366
Rotatable bonds: 8
H-donors: 1
H-acceptors: 7
PSA: 105
Number of rings: 5

     

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