COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL053103
Chemical Name: (E)-(5-methylfuran-2-yl){1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxo-2-(pyridin-2-yl)pyrrolidin-3-ylidene}methanolate
Smiles: Cc1ccc(o1)/C(=C\1/C(c2ccccn2)N(C(=O)C1=O)CCC[NH+]1CCOCC1)/[O-]

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Molecular Weight: 411.46
Empirical Formula: C22H25N3O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.623
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 100
Number of rings: 4

     

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