COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL044637
Chemical Name: (E)-1-benzofuran-2-yl{1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxo-2-(pyridin-4-yl)pyrrolidin-3-ylidene}methanolate
Smiles: O=C1C(=O)/C(=C(\c2cc3c(o2)cccc3)/[O-])/C(N1CCC[NH+]1CCOCC1)c1ccncc1

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Molecular Weight: 447.49
Empirical Formula: C25H25N3O5

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 1.993
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 100
Number of rings: 5

     

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