COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL045714
Chemical Name: (E)-furan-2-yl{1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxo-2-(thiophen-2-yl)pyrrolidin-3-ylidene}methanolate
Smiles: O=C1C(=O)/C(=C(\c2ccco2)/[O-])/C(N1CCC[NH+]1CCOCC1)c1cccs1

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Molecular Weight: 402.47
Empirical Formula: C20H22N2O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.333
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 115
Number of rings: 4

     

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